#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 -3.29 1.12 3.14 -1.26 -4.88 118.33 113.16 1nho n VAL 2 Ca 0.00 0.00 -0.38 0.00 -2.96 0.00 0.00 64.34 61.00 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 0.01 5.17 -0.20 1.55 1.01 -1.25 -4.85 120.40 121.83 1nho s VAL 3 Ca 0.00 0.97 -0.05 0.00 0.00 0.00 0.00 61.98 62.91 1nho s VAL 3 Cb 0.00 -3.83 0.07 0.00 0.00 0.00 0.00 36.38 32.62 1nho s VAL 3 CO 0.00 0.29 0.12 0.21 0.00 0.00 0.00 175.10 175.72 1nho s ASN 4 N 0.75 2.50 -0.02 3.32 2.47 -1.22 0.95 114.94 123.68 1nho s ASN 4 Ca 0.26 -0.73 0.01 0.00 0.42 0.00 0.00 52.86 52.83 1nho s ASN 4 Cb -0.15 -0.19 0.01 0.00 -1.45 0.00 0.00 41.25 39.46 1nho s ASN 4 CO 0.10 -0.37 -0.04 -0.63 -3.72 0.00 0.00 177.10 172.44 1nho s ILE 5 N 2.15 0.40 -0.31 -5.21 1.01 -1.15 -4.04 121.20 114.05 1nho s ILE 5 Ca 0.04 -0.15 0.03 0.00 0.00 0.00 0.00 60.65 60.57 1nho s ILE 5 Cb -0.16 -0.38 0.09 0.00 0.01 0.00 0.00 42.46 42.02 1nho s ILE 5 CO -0.16 0.14 0.02 -0.70 0.00 0.00 0.00 174.94 174.25 1nho s GLU 6 N 0.28 1.48 -0.48 2.79 2.56 -1.09 0.41 118.70 124.66 1nho s GLU 6 Ca -0.03 -1.58 -0.18 0.00 0.00 0.00 0.00 54.97 53.18 1nho s GLU 6 Cb -0.07 -2.90 0.06 0.00 2.00 0.00 0.00 34.13 33.21 1nho s GLU 6 CO -0.00 -0.86 0.53 0.14 -0.56 0.00 0.00 175.26 174.51 1nho s VAL 7 N 1.10 5.01 -0.34 3.70 -7.23 -0.35 -0.71 120.40 121.57 1nho s VAL 7 Ca 0.06 -0.61 0.02 0.00 -1.81 0.00 0.00 61.98 59.64 1nho s VAL 7 Cb -0.19 -4.20 0.09 0.00 0.56 0.00 0.00 36.38 32.64 1nho s VAL 7 CO -0.10 -0.67 0.06 0.12 -0.31 0.00 0.00 175.10 174.20 1nho s PHE 8 N 2.28 3.64 0.20 2.82 2.19 0.10 0.36 117.98 129.57 1nho s PHE 8 Ca 0.12 -2.73 0.00 0.00 0.33 0.00 0.00 56.93 54.65 1nho s PHE 8 Cb -0.20 -2.82 0.00 0.00 -1.31 0.00 0.00 43.02 38.69 1nho s PHE 8 CO 0.11 -0.94 0.00 2.41 1.83 0.00 0.00 175.22 178.63 1nho n THR 9 N 4.37 0.31 -3.63 0.12 -1.04 -1.19 0.32 114.28 113.54 1nho n THR 9 Ca -0.01 0.10 -0.05 0.00 -2.04 0.00 0.00 64.05 62.06 1nho n THR 9 Cb 0.42 -0.74 -0.06 0.00 -1.82 0.00 0.00 70.33 68.13 1nho n THR 9 CO 0.00 0.00 0.00 -0.55 -0.64 0.00 0.00 175.07 173.88 1nho s SER 10 N -5.14 -0.17 0.00 8.00 0.15 -1.26 -2.66 113.70 112.62 1nho s SER 10 Ca 0.00 0.27 0.24 0.00 0.70 0.00 0.00 55.95 57.17 1nho s SER 10 Cb 0.00 0.26 1.06 0.00 -1.71 0.00 0.00 66.02 65.63 1nho s SER 10 CO 0.00 -0.10 1.78 -0.81 1.20 0.00 0.00 173.24 175.31 1nho n PRO 11 N 1.24 0.05 0.00 5.44 -0.04 -1.26 -2.89 135.00 137.53 1nho n PRO 11 Ca -0.08 0.08 0.14 0.00 -0.04 0.00 0.00 63.50 63.60 1nho n PRO 11 Cb 0.57 -1.50 0.74 0.00 -0.04 0.00 0.00 33.50 33.28 1nho n PRO 11 CO 0.00 0.00 0.00 -2.37 -0.04 0.00 0.00 175.50 173.09 1nho n THR 12 N -1.47 0.05 -2.59 0.52 5.66 -1.26 -4.90 114.28 110.30 1nho n THR 12 Ca 0.07 0.01 0.00 0.00 -3.05 0.00 0.00 64.05 61.08 1nho n THR 12 Cb 0.27 -0.54 0.00 0.00 -1.55 0.00 0.00 70.33 68.52 1nho n THR 12 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1nho s PRO 14 N -0.69 4.05 0.00 0.00 0.04 -1.26 -4.72 135.00 132.42 1nho s PRO 14 Ca 0.00 0.82 0.00 0.00 0.04 0.00 0.00 61.00 61.86 1nho s PRO 14 Cb 0.00 -3.71 0.00 0.00 0.04 0.00 0.00 34.50 30.83 1nho s PRO 14 CO 0.00 -0.69 0.31 0.66 0.04 0.00 0.00 177.00 177.31 1nho n TYR 15 N 6.32 0.00 -2.69 0.56 4.01 -1.26 -4.68 117.16 119.42 1nho n TYR 15 Ca 0.07 0.00 -0.02 0.00 -0.16 0.00 0.00 57.90 57.79 1nho n TYR 15 Cb 0.48 0.00 0.11 0.00 -0.31 0.00 0.00 39.34 39.61 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 -1.28 0.69 -0.02 0.00 -0.04 -1.26 -3.84 135.00 129.25 1nho n PRO 17 Ca -0.13 0.00 -0.04 0.00 -0.04 0.00 0.00 63.50 63.30 1nho n PRO 17 Cb 0.86 -1.16 -0.01 0.00 -0.04 0.00 0.00 33.50 33.15 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 0.69 0.21 0.34 0.54 1.56 -1.26 -4.32 117.12 114.88 1nho n MET 18 Ca 0.00 0.08 0.21 0.00 -0.27 0.00 0.00 57.70 57.72 1nho n MET 18 Cb 0.34 -0.82 1.11 0.00 2.15 0.00 0.00 33.22 36.00 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 -0.59 1.11 -0.02 -5.12 0.00 -1.74 -0.46 119.26 112.44 1nho h ALA 19 Ca 0.00 -0.00 -0.25 0.00 0.00 0.00 0.00 54.91 54.66 1nho h ALA 19 Cb 0.40 0.00 0.02 0.00 0.00 0.00 0.00 17.79 18.20 1nho h ALA 19 CO 0.00 -0.10 -0.99 -0.84 0.00 0.00 0.00 179.25 177.32 1nho h ILE 20 N 0.00 1.30 -1.03 0.00 3.07 -1.78 -2.83 117.51 116.25 1nho h ILE 20 Ca 0.00 -2.26 0.26 0.00 1.55 0.00 0.00 64.86 64.41 1nho h ILE 20 Cb 0.20 2.34 -0.09 0.00 -0.27 0.00 0.00 36.82 39.00 1nho h ILE 20 CO -0.00 0.69 0.66 -0.08 -1.05 0.00 0.00 178.15 178.38 1nho h GLU 21 N 0.38 0.38 -0.14 0.16 4.81 -1.26 2.84 114.58 121.74 1nho h GLU 21 Ca -0.11 -0.02 -0.15 0.00 -0.13 0.00 0.00 59.36 58.95 1nho h GLU 21 Cb 1.64 -0.09 0.00 0.00 0.63 0.00 0.00 28.75 30.94 1nho h GLU 21 CO 0.19 0.25 -0.49 0.28 -0.73 0.00 0.00 179.01 178.51 1nho h VAL 22 N 0.39 1.34 0.00 0.32 2.07 -1.57 0.09 116.25 118.89 1nho h VAL 22 Ca 0.58 -1.77 -0.08 0.00 0.82 0.00 0.00 66.70 66.25 1nho h VAL 22 Cb 1.47 2.05 -0.01 0.00 -1.52 0.00 0.00 31.29 33.29 1nho h VAL 22 CO -0.27 0.54 -0.39 1.62 0.02 0.00 0.00 177.57 179.09 1nho h VAL 23 N 0.23 1.08 -0.01 2.57 3.04 0.26 -2.74 116.25 120.69 1nho h VAL 23 Ca -0.02 -1.45 -0.23 0.00 -1.01 0.00 0.00 66.70 64.00 1nho h VAL 23 Cb 1.12 1.83 0.00 0.00 -2.01 0.00 0.00 31.29 32.23 1nho h VAL 23 CO 0.10 0.39 -0.94 -0.78 -1.01 0.00 0.00 177.57 175.33 1nho h ASP 24 N 0.00 0.56 -0.62 3.17 1.82 0.49 0.30 116.42 122.14 1nho h ASP 24 Ca -0.00 -0.44 0.03 0.00 -0.39 0.00 0.00 57.03 56.22 1nho h ASP 24 Cb 0.80 -0.17 -0.04 0.00 0.68 0.00 0.00 39.33 40.59 1nho h ASP 24 CO 0.05 1.24 0.38 -0.33 -1.61 0.00 0.00 179.24 178.97 1nho h GLU 25 N 0.25 0.72 0.20 0.28 5.08 -0.68 0.60 114.58 121.03 1nho h GLU 25 Ca -0.08 -0.04 -0.30 0.00 -1.00 0.00 0.00 59.36 57.94 1nho h GLU 25 Cb 1.57 -0.16 0.03 0.00 0.50 0.00 0.00 28.75 30.69 1nho h GLU 25 CO 0.16 0.48 -1.29 0.00 -1.00 0.00 0.00 179.01 177.36 1nho h ALA 26 N 1.27 -0.12 0.00 3.43 0.00 -1.50 -3.07 119.26 119.27 1nho h ALA 26 Ca 0.25 -0.80 -0.03 0.00 0.00 0.00 0.00 54.91 54.33 1nho h ALA 26 Cb 0.02 0.15 -0.00 0.00 0.00 0.00 0.00 17.79 17.96 1nho h ALA 26 CO -0.10 0.62 -0.13 0.87 0.00 0.00 0.00 179.25 180.50 1nho h LYS 27 N 0.07 0.00 -0.15 0.00 1.79 -0.70 -2.19 116.57 115.38 1nho h LYS 27 Ca -0.22 0.00 -0.06 0.00 -2.18 0.00 0.00 60.65 58.20 1nho h LYS 27 Cb 2.00 0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 32.65 1nho h LYS 27 CO 0.24 0.13 -0.12 0.87 -1.08 0.00 0.00 179.45 179.49 1nho h LYS 28 N 0.00 0.35 -0.98 3.15 1.57 0.19 1.57 116.57 122.42 1nho h LYS 28 Ca -0.00 -0.17 0.25 0.00 -1.87 0.00 0.00 60.65 58.86 1nho h LYS 28 Cb 0.48 0.00 -0.13 0.00 0.08 0.00 0.00 32.23 32.67 1nho h LYS 28 CO 0.02 0.71 0.54 1.05 -0.57 0.00 0.00 179.45 181.20 1nho h GLU 29 N -0.01 0.48 0.00 3.15 -0.00 -1.30 -1.32 114.58 115.58 1nho h GLU 29 Ca 0.03 -0.03 -0.05 0.00 -0.00 0.00 0.00 59.36 59.31 1nho h GLU 29 Cb 0.64 -0.11 -0.01 0.00 -0.00 0.00 0.00 28.75 29.27 1nho h GLU 29 CO 0.03 0.32 -0.64 0.35 -0.00 0.00 0.00 179.01 179.06 1nho h PHE 30 N 0.49 0.00 -2.96 2.06 3.57 -1.37 -3.41 116.94 115.32 1nho h PHE 30 Ca 0.64 0.00 -0.78 0.00 3.53 0.00 0.00 57.97 61.36 1nho h PHE 30 Cb 1.27 0.00 -0.24 0.00 2.79 0.00 0.00 35.95 39.76 1nho h PHE 30 CO -0.04 0.29 0.85 0.41 -2.23 0.00 0.00 178.31 177.59 1nho n GLY 31 N 1.59 4.19 0.40 2.40 0.00 0.53 -4.87 105.19 109.43 1nho n GLY 31 Ca -0.12 -2.42 0.26 0.00 0.00 0.00 0.00 46.02 43.74 1nho n GLY 31 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1nho n ASP 32 N 3.31 0.00 -4.91 1.61 -0.08 -0.52 -4.14 116.55 111.82 1nho n ASP 32 Ca 0.29 0.56 -0.28 0.00 -1.51 0.00 0.00 54.79 53.85 1nho n ASP 32 Cb 0.39 -0.24 -0.01 0.00 2.34 0.00 0.00 41.12 43.60 1nho n ASP 32 CO 0.00 0.00 0.00 -0.54 0.12 0.00 0.00 177.20 176.78 1nho s LYS 33 N -3.87 3.59 0.09 -0.67 1.02 -1.26 -4.91 119.74 113.72 1nho s LYS 33 Ca -0.02 0.15 0.06 0.00 0.02 0.00 0.00 55.97 56.17 1nho s LYS 33 Cb 0.13 -2.45 -0.03 0.00 -0.52 0.00 0.00 37.83 34.96 1nho s LYS 33 CO 0.43 -0.07 -0.15 0.42 -0.92 0.00 0.00 175.35 175.05 1nho s ILE 34 N -2.53 1.25 -0.39 2.17 1.09 -1.26 -3.90 121.20 117.63 1nho s ILE 34 Ca 0.47 -1.42 0.11 0.00 -1.10 0.00 0.00 60.65 58.71 1nho s ILE 34 Cb -0.10 -1.23 0.33 0.00 -1.06 0.00 0.00 42.46 40.40 1nho s ILE 34 CO 0.39 -0.23 0.71 0.47 -0.10 0.00 0.00 174.94 176.18 1nho n ASP 35 N 1.11 0.97 -4.58 3.58 8.00 0.27 -4.81 116.55 121.09 1nho n ASP 35 Ca -0.20 -3.01 -0.41 0.00 0.71 0.00 0.00 54.79 51.88 1nho n ASP 35 Cb 0.55 -0.62 -0.07 0.00 -0.02 0.00 0.00 41.12 40.95 1nho n ASP 35 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1nho s VAL 36 N -2.38 4.95 -0.09 2.53 1.01 -1.21 -2.92 120.40 122.30 1nho s VAL 36 Ca 0.40 0.59 -0.08 0.00 0.00 0.00 0.00 61.98 62.88 1nho s VAL 36 Cb 0.32 -4.00 -0.04 0.00 0.00 0.00 0.00 36.38 32.65 1nho s VAL 36 CO -0.09 -0.21 0.20 -1.61 0.00 0.00 0.00 175.10 173.39 1nho s GLU 37 N 2.56 3.54 -0.02 2.72 2.02 1.38 -4.79 118.70 126.10 1nho s GLU 37 Ca 0.22 -0.03 0.00 0.00 0.02 0.00 0.00 54.97 55.19 1nho s GLU 37 Cb -0.15 -3.19 0.03 0.00 0.10 0.00 0.00 34.13 30.92 1nho s GLU 37 CO 0.13 0.75 0.01 -1.59 0.02 0.00 0.00 175.26 174.58 1nho s LYS 38 N -1.11 0.20 0.26 1.61 0.00 -1.26 -1.21 119.74 118.23 1nho s LYS 38 Ca 0.18 0.09 0.02 0.00 0.00 0.00 0.00 55.97 56.26 1nho s LYS 38 Cb -0.13 -0.39 -0.04 0.00 0.00 0.00 0.00 37.83 37.27 1nho s LYS 38 CO 0.07 -0.13 0.16 0.96 0.00 0.00 0.00 175.35 176.41 1nho s ILE 39 N 0.94 0.16 0.41 3.79 -4.36 0.16 -4.86 121.20 117.44 1nho s ILE 39 Ca -0.09 -2.00 0.08 0.00 -0.26 0.00 0.00 60.65 58.38 1nho s ILE 39 Cb -0.12 -2.52 -0.01 0.00 1.25 0.00 0.00 42.46 41.05 1nho s ILE 39 CO -0.02 0.00 0.42 1.51 0.24 0.00 0.00 174.94 177.09 1nho s ASP 40 N -3.27 5.19 0.40 4.36 1.47 -1.26 -3.18 116.67 120.37 1nho s ASP 40 Ca 0.38 -0.67 0.28 0.00 1.18 0.00 0.00 52.55 53.72 1nho s ASP 40 Cb 0.06 -0.60 0.97 0.00 -0.34 0.00 0.00 42.92 43.00 1nho s ASP 40 CO 0.16 -0.67 1.81 -0.29 0.68 0.00 0.00 175.17 176.86 1nho h ILE 41 N 0.95 0.00 0.00 2.11 2.10 -1.73 0.36 117.51 121.30 1nho h ILE 41 Ca -0.41 -0.54 0.00 0.00 1.08 0.00 0.00 64.86 64.99 1nho h ILE 41 Cb 1.27 1.48 0.00 0.00 -1.09 0.00 0.00 36.82 38.48 1nho h ILE 41 CO 0.55 0.00 -1.00 1.15 -1.08 0.00 0.00 178.15 177.76 1nho n MET 42 N -2.76 0.35 -0.04 2.19 0.00 -1.26 -3.81 117.12 111.78 1nho n MET 42 Ca 0.02 0.02 -0.05 0.00 0.00 0.00 0.00 57.70 57.70 1nho n MET 42 Cb 0.35 -1.63 -0.07 0.00 0.00 0.00 0.00 33.22 31.87 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 -2.09 0.61 -2.27 3.17 3.14 -1.13 -4.69 118.33 115.07 1nho n VAL 43 Ca 0.02 -0.37 -0.30 0.00 -2.96 0.00 0.00 64.34 60.72 1nho n VAL 43 Cb 0.46 -0.77 0.01 0.00 -1.06 0.00 0.00 33.84 32.48 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 -2.36 5.51 0.00 6.55 2.03 0.13 -4.77 116.55 123.64 1nho n ASP 44 Ca -0.15 -3.75 0.00 0.00 0.52 0.00 0.00 54.79 51.41 1nho n ASP 44 Cb 0.79 -0.62 0.00 0.00 -0.72 0.00 0.00 41.12 40.57 1nho n ASP 44 CO 0.00 0.00 0.00 -1.14 -1.92 0.00 0.00 177.20 174.14 1nho n ARG 45 N -0.53 0.00 0.24 -0.67 0.63 -1.25 -0.52 116.66 114.57 1nho n ARG 45 Ca 0.44 0.44 0.15 0.00 -0.92 0.00 0.00 57.85 57.96 1nho n ARG 45 Cb 0.58 -1.50 0.80 0.00 0.45 0.00 0.00 32.46 32.79 1nho n ARG 45 CO 0.00 0.00 0.00 0.93 -2.51 0.00 0.00 177.63 176.05 1nho h GLU 46 N 0.00 0.00 -0.08 -0.14 4.39 -1.92 -3.02 114.58 113.81 1nho h GLU 46 Ca 0.00 0.00 0.02 0.00 0.34 0.00 0.00 59.36 59.72 1nho h GLU 46 Cb 0.00 0.00 -0.05 0.00 -0.10 0.00 0.00 28.75 28.60 1nho h GLU 46 CO 0.00 0.00 -0.47 -0.22 -1.16 0.00 0.00 179.01 177.16 1nho h LYS 47 N 0.00 -0.51 0.00 2.33 1.63 -1.19 0.63 116.57 119.45 1nho h LYS 47 Ca 0.00 0.03 0.00 0.00 -0.85 0.00 0.00 60.65 59.83 1nho h LYS 47 Cb 0.14 0.12 0.00 0.00 -0.60 0.00 0.00 32.23 31.89 1nho h LYS 47 CO 0.00 -0.34 0.00 0.00 -3.45 0.00 0.00 179.45 175.66 1nho n ALA 48 N -2.93 1.62 -0.28 5.00 0.00 -1.14 -3.53 120.51 119.25 1nho n ALA 48 Ca -0.06 -0.02 0.26 0.00 0.00 0.00 0.00 53.44 53.62 1nho n ALA 48 Cb 0.33 -1.05 0.47 0.00 0.00 0.00 0.00 19.45 19.20 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 -1.00 -0.28 -0.09 0.00 -5.35 0.22 0.60 119.36 113.46 1nho n ILE 49 Ca 0.02 1.49 -0.06 0.00 -0.27 0.00 0.00 62.75 63.93 1nho n ILE 49 Cb 0.01 -2.42 0.00 0.00 -1.74 0.00 0.00 39.64 35.49 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 0.07 0.00 6.28 5.08 -1.77 -3.36 114.58 120.88 1nho h GLU 50 Ca 0.65 -0.00 0.00 0.00 -1.00 0.00 0.00 59.36 59.01 1nho h GLU 50 Cb 1.84 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 31.07 1nho h GLU 50 CO -0.52 0.05 -0.75 2.48 -1.00 0.00 0.00 179.01 179.27 1nho n TYR 51 N -5.18 0.00 -0.17 4.33 4.11 2.02 -4.97 117.16 117.30 1nho n TYR 51 Ca 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 57.90 57.90 1nho n TYR 51 Cb 0.17 0.00 -0.00 0.00 -0.00 0.00 0.00 39.34 39.51 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 2.30 0.01 0.05 -7.48 0.00 2.53 -4.58 105.19 98.03 1nho n GLY 52 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.00 1nho n GLY 52 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1nho h LEU 53 N 0.00 0.00 -5.99 0.99 3.38 -1.93 -3.40 115.31 108.36 1nho h LEU 53 Ca -0.00 0.00 -0.70 0.00 0.09 0.00 0.00 57.88 57.27 1nho h LEU 53 Cb 0.06 0.00 -0.35 0.00 0.09 0.00 0.00 40.66 40.46 1nho h LEU 53 CO 0.00 0.53 0.15 0.23 0.09 0.00 0.00 178.44 179.45 1nho n MET 54 N -4.31 4.09 -3.36 1.13 2.81 -1.26 -5.02 117.12 111.20 1nho n MET 54 Ca -0.03 -4.73 -0.44 0.00 -1.81 0.00 0.00 57.70 50.70 1nho n MET 54 Cb 0.11 -2.36 -0.08 0.00 -0.71 0.00 0.00 33.22 30.17 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 -3.54 3.48 0.12 3.04 0.00 -1.26 -4.76 121.76 118.84 1nho s ALA 55 Ca 0.42 -1.80 0.00 0.00 0.00 0.00 0.00 51.96 50.57 1nho s ALA 55 Cb 0.20 -3.06 0.00 0.00 0.00 0.00 0.00 23.12 20.26 1nho s ALA 55 CO -0.08 -1.66 0.00 0.28 0.00 0.00 0.00 175.76 174.30 1nho n VAL 56 N 5.31 0.00 -3.53 0.00 0.31 -1.26 -4.92 118.33 114.24 1nho n VAL 56 Ca -0.10 0.00 -0.42 0.00 -0.01 0.00 0.00 64.34 63.82 1nho n VAL 56 Cb 0.46 -0.10 -0.07 0.00 -0.91 0.00 0.00 33.84 33.22 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 -1.32 2.85 0.36 5.55 0.04 -1.26 -3.83 135.00 137.39 1nho s PRO 57 Ca 0.00 -2.20 -0.07 0.00 0.04 0.00 0.00 61.00 58.77 1nho s PRO 57 Cb 0.00 -4.03 0.02 0.00 0.04 0.00 0.00 34.50 30.53 1nho s PRO 57 CO 0.00 -1.22 0.58 0.00 0.04 0.00 0.00 177.00 176.40 1nho s ALA 58 N 0.60 0.26 -0.05 8.56 0.00 0.15 0.18 121.76 131.46 1nho s ALA 58 Ca 0.12 -1.26 -0.15 0.00 0.00 0.00 0.00 51.96 50.68 1nho s ALA 58 Cb -0.20 0.99 0.03 0.00 0.00 0.00 0.00 23.12 23.94 1nho s ALA 58 CO -0.04 -0.86 0.33 0.42 0.00 0.00 0.00 175.76 175.62 1nho s ILE 59 N -2.79 0.04 0.17 0.00 1.09 -1.00 -0.72 121.20 117.99 1nho s ILE 59 Ca 0.25 -0.34 -0.28 0.00 -1.10 0.00 0.00 60.65 59.18 1nho s ILE 59 Cb -0.02 -0.59 -0.08 0.00 -1.06 0.00 0.00 42.46 40.71 1nho s ILE 59 CO 0.17 -0.19 0.88 0.00 -0.10 0.00 0.00 174.94 175.71 1nho s ALA 60 N -0.93 3.35 -1.20 9.38 0.00 0.11 -0.71 121.76 131.76 1nho s ALA 60 Ca -0.10 0.51 -0.15 0.00 0.00 0.00 0.00 51.96 52.22 1nho s ALA 60 Cb -0.04 -3.14 0.15 0.00 0.00 0.00 0.00 23.12 20.09 1nho s ALA 60 CO 0.03 0.16 1.46 0.42 0.00 0.00 0.00 175.76 177.83 1nho s ILE 61 N -0.75 4.84 -0.55 0.00 1.01 1.06 -3.11 121.20 123.70 1nho s ILE 61 Ca 0.41 -2.41 -0.07 0.00 0.00 0.00 0.00 60.65 58.58 1nho s ILE 61 Cb -0.24 -4.95 -0.17 0.00 0.01 0.00 0.00 42.46 37.11 1nho s ILE 61 CO 0.29 -1.68 1.66 0.59 0.00 0.00 0.00 174.94 175.79 1nho n ASN 62 N 6.22 -1.30 0.00 3.58 5.03 -1.26 0.10 115.26 127.64 1nho n ASN 62 Ca 0.38 -1.13 0.00 0.00 0.87 0.00 0.00 54.58 54.70 1nho n ASN 62 Cb 0.44 -0.72 0.00 0.00 -1.02 0.00 0.00 39.78 38.48 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 5.19 1.32 1.26 7.41 0.00 -1.26 -4.40 105.19 114.71 1nho n GLY 63 Ca 0.35 -0.04 0.00 0.00 0.00 0.00 0.00 46.02 46.33 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 0.89 0.00 1.61 0.24 0.29 -4.80 118.33 116.56 1nho n VAL 64 Ca 0.00 0.29 0.00 0.00 -2.04 0.00 0.00 64.34 62.59 1nho n VAL 64 Cb 0.00 -1.30 0.00 0.00 -1.47 0.00 0.00 33.84 31.07 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 -1.11 -4.92 118.33 108.94 1nho n VAL 65 Ca 0.00 0.00 -0.14 0.00 -0.01 0.00 0.00 64.34 64.19 1nho n VAL 65 Cb 0.00 0.00 -0.06 0.00 -0.91 0.00 0.00 33.84 32.87 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 1.73 1.00 0.20 5.55 3.52 -1.26 0.34 118.95 130.04 1nho s ARG 66 Ca 0.00 -0.16 0.01 0.00 -0.13 0.00 0.00 55.73 55.44 1nho s ARG 66 Cb 0.00 0.46 -0.00 0.00 -1.56 0.00 0.00 34.95 33.85 1nho s ARG 66 CO 0.00 -0.35 0.25 1.97 -0.81 0.00 0.00 175.30 176.36 1nho n PHE 67 N 0.56 -0.86 -3.41 5.12 -1.74 0.11 -4.75 117.46 112.49 1nho n PHE 67 Ca -0.19 -1.46 -0.38 0.00 -0.56 0.00 0.00 57.45 54.86 1nho n PHE 67 Cb 0.59 0.28 -0.08 0.00 1.52 0.00 0.00 39.48 41.79 1nho n PHE 67 CO 0.00 0.00 0.00 0.08 -0.56 0.00 0.00 176.76 176.28 1nho s VAL 68 N -2.70 5.20 -0.30 1.97 1.01 -1.26 -2.38 120.40 121.95 1nho s VAL 68 Ca 0.19 0.61 0.01 0.00 0.00 0.00 0.00 61.98 62.78 1nho s VAL 68 Cb -0.00 -3.70 0.19 0.00 0.00 0.00 0.00 36.38 32.88 1nho s VAL 68 CO 0.14 0.22 0.64 -0.83 0.00 0.00 0.00 175.10 175.26 1nho s GLY 69 N 1.27 -1.08 0.00 4.51 0.00 0.47 -4.87 107.32 107.62 1nho s GLY 69 Ca 0.16 1.57 0.00 0.00 0.00 0.00 0.00 44.72 46.46 1nho s GLY 69 CO 0.08 3.56 0.00 0.00 0.00 0.00 0.00 173.10 176.74 1nho n ALA 70 N 5.42 0.00 1.16 3.20 0.00 -0.98 -2.65 120.51 126.65 1nho n ALA 70 Ca 0.02 0.00 0.01 0.00 0.00 0.00 0.00 53.44 53.47 1nho n ALA 70 Cb 0.53 0.00 0.06 0.00 0.00 0.00 0.00 19.45 20.03 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 -0.75 1.43 -2.78 0.00 -0.04 -1.26 -4.37 135.00 127.23 1nho n PRO 71 Ca 0.00 -0.44 -0.42 0.00 -0.04 0.00 0.00 63.50 62.60 1nho n PRO 71 Cb 0.00 -1.36 0.02 0.00 -0.04 0.00 0.00 33.50 32.11 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 -0.03 6.97 0.10 3.54 3.41 -1.26 -4.71 113.62 121.63 1nho n SER 72 Ca 0.04 -3.56 -0.05 0.00 -0.26 0.00 0.00 58.87 55.04 1nho n SER 72 Cb 0.25 -1.22 0.11 0.00 -0.26 0.00 0.00 64.21 63.10 1nho n SER 72 CO 0.00 0.00 0.00 0.08 -0.16 0.00 0.00 175.04 174.96 1nho h ARG 73 N 4.74 0.18 -0.94 4.33 -0.00 -1.88 -3.04 114.38 117.76 1nho h ARG 73 Ca 0.40 -0.13 0.18 0.00 -0.00 0.00 0.00 59.98 60.42 1nho h ARG 73 Cb 0.44 0.02 -0.10 0.00 -0.00 0.00 0.00 29.97 30.33 1nho h ARG 73 CO 1.26 0.76 0.53 1.49 -0.00 0.00 0.00 179.97 184.01 1nho h GLU 74 N 0.13 0.66 -1.29 0.08 4.57 -1.88 0.52 114.58 117.37 1nho h GLU 74 Ca -0.01 -0.04 0.37 0.00 -1.18 0.00 0.00 59.36 58.50 1nho h GLU 74 Cb 1.16 -0.15 -0.05 0.00 -0.16 0.00 0.00 28.75 29.55 1nho h GLU 74 CO 0.10 0.44 0.97 0.93 -1.18 0.00 0.00 179.01 180.27 1nho h GLU 75 N 0.68 0.00 -0.20 1.92 4.39 -1.92 1.33 114.58 120.78 1nho h GLU 75 Ca 0.54 0.00 -0.19 0.00 0.34 0.00 0.00 59.36 60.05 1nho h GLU 75 Cb 0.83 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 29.49 1nho h GLU 75 CO -0.39 0.00 -0.62 -0.07 -1.16 0.00 0.00 179.01 176.77 1nho h LEU 76 N 0.00 0.89 -1.27 1.33 3.38 -0.14 -1.14 115.31 118.36 1nho h LEU 76 Ca 0.61 -0.59 0.06 0.00 0.09 0.00 0.00 57.88 58.05 1nho h LEU 76 Cb 2.55 -0.26 -0.05 0.00 0.09 0.00 0.00 40.66 42.99 1nho h LEU 76 CO -0.01 1.32 0.52 0.15 0.09 0.00 0.00 178.44 180.52 1nho h PHE 77 N 0.51 0.90 0.00 1.13 3.57 0.17 -0.28 116.94 122.94 1nho h PHE 77 Ca -0.02 0.02 -0.13 0.00 3.53 0.00 0.00 57.97 61.37 1nho h PHE 77 Cb 1.24 -0.30 -0.02 0.00 2.79 0.00 0.00 35.95 39.67 1nho h PHE 77 CO 0.09 0.49 -0.63 1.49 -2.23 0.00 0.00 178.31 177.51 1nho h GLU 78 N 0.90 0.00 -0.09 1.11 4.81 -1.27 -3.22 114.58 116.82 1nho h GLU 78 Ca 0.34 0.00 -0.22 0.00 -0.13 0.00 0.00 59.36 59.35 1nho h GLU 78 Cb 0.18 0.00 0.01 0.00 0.63 0.00 0.00 28.75 29.57 1nho h GLU 78 CO -0.11 0.63 -0.83 0.00 -0.73 0.00 0.00 179.01 177.96 1nho h ALA 79 N 1.37 0.37 -0.57 2.92 0.00 0.20 -0.83 119.26 122.72 1nho h ALA 79 Ca -0.01 -0.63 -0.05 0.00 0.00 0.00 0.00 54.91 54.22 1nho h ALA 79 Cb 1.41 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 19.16 1nho h ALA 79 CO 0.08 0.73 0.15 0.82 0.00 0.00 0.00 179.25 181.03 1nho h ILE 80 N 0.40 1.23 -0.05 0.00 5.03 -1.25 1.59 117.51 124.47 1nho h ILE 80 Ca -0.06 -0.82 -0.16 0.00 -0.12 0.00 0.00 64.86 63.70 1nho h ILE 80 Cb 1.45 0.63 -0.01 0.00 -3.03 0.00 0.00 36.82 35.86 1nho h ILE 80 CO 0.16 0.31 -0.69 -1.13 -0.68 0.00 0.00 178.15 176.11 1nho h ASN 81 N 0.84 0.27 0.26 1.72 -1.24 -1.55 0.90 115.58 116.78 1nho h ASN 81 Ca 0.19 -0.17 0.00 0.00 0.71 0.00 0.00 56.30 57.02 1nho h ASN 81 Cb 0.29 -0.08 0.00 0.00 0.73 0.00 0.00 38.32 39.26 1nho h ASN 81 CO -0.00 0.88 -0.39 -0.67 -1.29 0.00 0.00 177.43 175.96 1nho n ASP 82 N -3.80 1.00 -0.06 1.15 -0.08 -0.32 -1.50 116.55 112.93 1nho n ASP 82 Ca -0.03 -0.80 -0.07 0.00 -1.51 0.00 0.00 54.79 52.38 1nho n ASP 82 Cb 0.68 0.25 -0.06 0.00 2.34 0.00 0.00 41.12 44.33 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 0.96 -0.01 0.00 -0.67 4.22 0.26 -3.26 114.58 116.08 1nho h GLU 83 Ca 0.00 0.00 -0.03 0.00 0.08 0.00 0.00 59.36 59.41 1nho h GLU 83 Cb 0.53 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.78 1nho h GLU 83 CO 0.00 0.49 -0.13 1.98 -2.18 0.00 0.00 179.01 179.17 1nho h MET 84 N -1.00 0.00 0.00 1.92 4.05 -0.88 -3.46 114.93 115.56 1nho h MET 84 Ca -0.00 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.42 1nho h MET 84 Cb 0.50 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.30 1nho h MET 84 CO 0.00 0.13 0.00 -1.91 0.23 0.00 0.00 176.91 175.36