#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 -3.25 1.12 3.14 -1.26 -4.86 118.33 113.22 1nho n VAL 2 Ca 0.00 0.00 -0.40 0.00 -2.96 0.00 0.00 64.34 60.98 1nho n VAL 2 Cb 0.00 -0.01 -0.08 0.00 -1.06 0.00 0.00 33.84 32.69 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 5.08 -0.12 1.55 1.01 -1.25 -4.92 120.40 121.75 1nho s VAL 3 Ca 0.00 0.82 -0.03 0.00 0.00 0.00 0.00 61.98 62.77 1nho s VAL 3 Cb 0.00 -3.82 0.05 0.00 0.00 0.00 0.00 36.38 32.60 1nho s VAL 3 CO 0.00 0.08 0.06 0.21 0.00 0.00 0.00 175.10 175.45 1nho s ASN 4 N 1.57 1.95 0.04 3.32 2.47 -1.22 0.18 114.94 123.24 1nho s ASN 4 Ca 0.20 -0.35 0.02 0.00 0.42 0.00 0.00 52.86 53.15 1nho s ASN 4 Cb -0.16 -0.29 -0.02 0.00 -1.45 0.00 0.00 41.25 39.33 1nho s ASN 4 CO 0.09 -0.29 -0.08 -0.63 -3.72 0.00 0.00 177.10 172.48 1nho s ILE 5 N 2.08 0.52 -0.23 -5.21 1.01 -1.15 -4.26 121.20 113.96 1nho s ILE 5 Ca 0.03 -1.04 -0.03 0.00 0.00 0.00 0.00 60.65 59.61 1nho s ILE 5 Cb -0.14 -0.58 0.08 0.00 0.01 0.00 0.00 42.46 41.82 1nho s ILE 5 CO -0.06 -0.37 0.07 -0.70 0.00 0.00 0.00 174.94 173.88 1nho s GLU 6 N -1.52 0.56 -0.52 2.79 2.12 -1.07 0.35 118.70 121.41 1nho s GLU 6 Ca -0.10 -0.57 -0.19 0.00 0.36 0.00 0.00 54.97 54.47 1nho s GLU 6 Cb -0.10 -1.92 0.07 0.00 0.26 0.00 0.00 34.13 32.44 1nho s GLU 6 CO 0.00 -0.78 0.61 0.14 -0.54 0.00 0.00 175.26 174.69 1nho s VAL 7 N 1.85 4.92 -0.61 3.70 -7.23 -0.67 0.12 120.40 122.48 1nho s VAL 7 Ca 0.03 -0.68 0.02 0.00 -1.81 0.00 0.00 61.98 59.54 1nho s VAL 7 Cb -0.17 -4.31 0.15 0.00 0.56 0.00 0.00 36.38 32.61 1nho s VAL 7 CO -0.17 -0.84 0.39 0.12 -0.31 0.00 0.00 175.10 174.29 1nho s PHE 8 N 2.50 3.35 0.08 2.82 5.36 -0.12 0.13 117.98 132.09 1nho s PHE 8 Ca 0.13 -3.06 0.00 0.00 -0.96 0.00 0.00 56.93 53.04 1nho s PHE 8 Cb -0.21 -2.95 0.00 0.00 -0.34 0.00 0.00 43.02 39.52 1nho s PHE 8 CO 0.10 -0.74 0.00 2.41 -1.46 0.00 0.00 175.22 175.53 1nho n THR 9 N 2.98 0.87 0.00 0.12 -1.04 -1.19 0.34 114.28 116.36 1nho n THR 9 Ca 0.09 0.29 0.00 0.00 -2.04 0.00 0.00 64.05 62.39 1nho n THR 9 Cb 0.34 -1.39 0.00 0.00 -1.82 0.00 0.00 70.33 67.46 1nho n THR 9 CO 0.00 0.00 0.00 -1.54 -0.64 0.00 0.00 175.07 172.89 1nho n SER 10 N -3.23 0.00 0.11 8.00 3.41 -1.26 -1.84 113.62 118.81 1nho n SER 10 Ca 0.00 0.00 0.05 0.00 -0.26 0.00 0.00 58.87 58.66 1nho n SER 10 Cb 0.00 0.00 0.01 0.00 -0.26 0.00 0.00 64.21 63.96 1nho n SER 10 CO 0.00 0.00 0.00 1.55 -0.16 0.00 0.00 175.04 176.43 1nho h PRO 11 N 0.00 0.00 -0.35 4.33 0.13 -1.90 -3.27 132.00 130.93 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 0.28 0.00 -2.37 -0.23 0.00 0.00 178.00 175.68 1nho n THR 12 N -3.01 0.00 -3.37 1.56 5.66 -1.26 -4.84 114.28 109.02 1nho n THR 12 Ca -0.02 0.00 -0.04 0.00 -3.05 0.00 0.00 64.05 60.95 1nho n THR 12 Cb 0.71 -0.19 0.01 0.00 -1.55 0.00 0.00 70.33 69.31 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 -2.04 3.70 0.00 0.00 0.04 -1.26 -4.76 135.00 130.67 1nho s PRO 14 Ca 0.07 0.39 0.00 0.00 0.04 0.00 0.00 61.00 61.51 1nho s PRO 14 Cb -0.02 -3.87 0.00 0.00 0.04 0.00 0.00 34.50 30.65 1nho s PRO 14 CO 0.05 -1.11 0.00 0.66 0.04 0.00 0.00 177.00 176.64 1nho n TYR 15 N 7.04 0.00 -2.70 0.56 4.01 -1.26 -4.86 117.16 119.95 1nho n TYR 15 Ca 0.07 0.00 -0.02 0.00 -0.16 0.00 0.00 57.90 57.80 1nho n TYR 15 Cb 0.48 0.00 0.11 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 -1.28 0.86 -0.04 0.00 -0.04 -1.26 -4.06 135.00 129.18 1nho n PRO 17 Ca -0.12 0.00 -0.03 0.00 -0.04 0.00 0.00 63.50 63.31 1nho n PRO 17 Cb 0.86 -1.28 -0.01 0.00 -0.04 0.00 0.00 33.50 33.02 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 -0.13 0.27 0.29 0.54 0.00 -1.26 -3.77 117.12 113.06 1nho n MET 18 Ca 0.00 0.32 0.17 0.00 -0.00 0.00 0.00 57.70 58.19 1nho n MET 18 Cb 0.14 -1.21 0.91 0.00 0.00 0.00 0.00 33.22 33.06 1nho n MET 18 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 1nho h ALA 19 N -1.43 1.11 -0.01 -5.12 0.00 -1.76 0.69 119.26 112.74 1nho h ALA 19 Ca 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 54.91 54.65 1nho h ALA 19 Cb 0.38 0.00 0.02 0.00 0.00 0.00 0.00 17.79 18.19 1nho h ALA 19 CO 0.00 -0.11 -1.02 -0.84 0.00 0.00 0.00 179.25 177.29 1nho h ILE 20 N 0.00 1.29 -0.97 0.00 -0.00 -1.75 -3.01 117.51 113.07 1nho h ILE 20 Ca 0.00 -2.24 0.26 0.00 -0.00 0.00 0.00 64.86 62.88 1nho h ILE 20 Cb 0.23 2.35 -0.06 0.00 -0.00 0.00 0.00 36.82 39.34 1nho h ILE 20 CO 0.00 0.69 0.67 -0.08 -0.00 0.00 0.00 178.15 179.43 1nho h GLU 21 N 0.39 0.20 -0.20 0.16 4.57 -0.94 0.87 114.58 119.63 1nho h GLU 21 Ca -0.12 -0.01 -0.09 0.00 -1.18 0.00 0.00 59.36 57.95 1nho h GLU 21 Cb 1.67 -0.04 -0.00 0.00 -0.16 0.00 0.00 28.75 30.21 1nho h GLU 21 CO 0.20 0.13 -0.24 0.28 -1.18 0.00 0.00 179.01 178.19 1nho h VAL 22 N 0.20 1.33 0.00 0.32 2.07 -1.57 0.94 116.25 119.55 1nho h VAL 22 Ca 0.50 -1.44 -0.08 0.00 0.82 0.00 0.00 66.70 66.50 1nho h VAL 22 Cb 1.60 1.80 -0.01 0.00 -1.52 0.00 0.00 31.29 33.16 1nho h VAL 22 CO -0.12 0.44 -0.37 1.62 0.02 0.00 0.00 177.57 179.16 1nho h VAL 23 N 0.18 1.08 0.01 2.57 3.04 -0.20 -2.67 116.25 120.26 1nho h VAL 23 Ca 0.03 -1.37 -0.24 0.00 -1.01 0.00 0.00 66.70 64.11 1nho h VAL 23 Cb 0.81 1.78 0.01 0.00 -2.01 0.00 0.00 31.29 31.87 1nho h VAL 23 CO 0.06 0.37 -0.98 -0.78 -1.01 0.00 0.00 177.57 175.22 1nho h ASP 24 N 0.00 0.62 -0.65 3.17 1.82 0.72 0.47 116.42 122.57 1nho h ASP 24 Ca -0.00 -0.50 0.01 0.00 -0.39 0.00 0.00 57.03 56.14 1nho h ASP 24 Cb 0.75 -0.19 -0.03 0.00 0.68 0.00 0.00 39.33 40.53 1nho h ASP 24 CO 0.05 1.31 0.43 -0.33 -1.61 0.00 0.00 179.24 179.08 1nho h GLU 25 N 0.26 0.84 0.25 0.28 4.39 -0.49 0.60 114.58 120.71 1nho h GLU 25 Ca -0.10 -0.05 -0.34 0.00 0.34 0.00 0.00 59.36 59.22 1nho h GLU 25 Cb 1.63 -0.19 0.04 0.00 -0.10 0.00 0.00 28.75 30.13 1nho h GLU 25 CO 0.18 0.56 -1.47 0.00 -1.16 0.00 0.00 179.01 177.11 1nho h ALA 26 N 1.25 -0.16 0.00 3.43 0.00 -1.48 -3.09 119.26 119.20 1nho h ALA 26 Ca 0.24 -0.85 -0.02 0.00 0.00 0.00 0.00 54.91 54.28 1nho h ALA 26 Cb -0.08 0.18 -0.00 0.00 0.00 0.00 0.00 17.79 17.89 1nho h ALA 26 CO -0.06 0.69 -0.10 0.87 0.00 0.00 0.00 179.25 180.64 1nho h LYS 27 N 0.15 0.00 -0.26 0.00 1.79 -0.70 -2.27 116.57 115.29 1nho h LYS 27 Ca -0.26 0.00 -0.11 0.00 -2.18 0.00 0.00 60.65 58.10 1nho h LYS 27 Cb 2.16 0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 32.81 1nho h LYS 27 CO 0.28 0.10 -0.27 0.87 -1.08 0.00 0.00 179.45 179.35 1nho h LYS 28 N 0.00 0.64 -1.01 3.15 1.57 0.19 1.05 116.57 122.17 1nho h LYS 28 Ca -0.00 -0.34 0.23 0.00 -1.87 0.00 0.00 60.65 58.66 1nho h LYS 28 Cb 0.54 0.02 -0.12 0.00 0.08 0.00 0.00 32.23 32.75 1nho h LYS 28 CO 0.01 0.95 0.61 1.05 -0.57 0.00 0.00 179.45 181.50 1nho h GLU 29 N 0.36 0.61 0.00 3.15 -0.00 -1.32 -1.31 114.58 116.06 1nho h GLU 29 Ca 0.04 -0.04 -0.07 0.00 -0.00 0.00 0.00 59.36 59.29 1nho h GLU 29 Cb 0.84 -0.14 -0.01 0.00 -0.00 0.00 0.00 28.75 29.44 1nho h GLU 29 CO 0.07 0.40 -0.70 0.35 -0.00 0.00 0.00 179.01 179.13 1nho h PHE 30 N 0.63 0.00 -3.03 2.06 3.57 -1.44 -3.41 116.94 115.32 1nho h PHE 30 Ca 0.62 0.00 -0.79 0.00 3.53 0.00 0.00 57.97 61.33 1nho h PHE 30 Cb 1.14 0.00 -0.25 0.00 2.79 0.00 0.00 35.95 39.63 1nho h PHE 30 CO -0.01 0.48 0.80 0.41 -2.23 0.00 0.00 178.31 177.77 1nho n GLY 31 N 1.57 4.22 0.38 2.40 0.00 0.36 -4.87 105.19 109.25 1nho n GLY 31 Ca -0.14 -2.45 0.24 0.00 0.00 0.00 0.00 46.02 43.66 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 3.16 0.00 -4.88 1.61 2.03 -0.52 -4.14 116.55 113.80 1nho n ASP 32 Ca 0.28 0.53 -0.29 0.00 0.52 0.00 0.00 54.79 55.83 1nho n ASP 32 Cb 0.39 -0.22 -0.02 0.00 -0.72 0.00 0.00 41.12 40.55 1nho n ASP 32 CO 0.00 0.00 0.00 -0.54 -1.92 0.00 0.00 177.20 174.74 1nho s LYS 33 N -3.78 3.68 0.16 -0.67 1.02 -1.26 -4.94 119.74 113.95 1nho s LYS 33 Ca -0.02 0.41 0.06 0.00 0.02 0.00 0.00 55.97 56.44 1nho s LYS 33 Cb 0.12 -2.35 -0.04 0.00 -0.52 0.00 0.00 37.83 35.03 1nho s LYS 33 CO 0.40 -0.15 -0.13 0.42 -0.92 0.00 0.00 175.35 174.97 1nho s ILE 34 N -2.57 1.43 -0.42 2.17 1.09 -1.26 -3.90 121.20 117.74 1nho s ILE 34 Ca 0.50 -1.99 0.08 0.00 -1.10 0.00 0.00 60.65 58.15 1nho s ILE 34 Cb -0.10 -1.80 0.31 0.00 -1.06 0.00 0.00 42.46 39.81 1nho s ILE 34 CO 0.38 -0.57 0.87 -0.67 -0.10 0.00 0.00 174.94 174.85 1nho n ASP 35 N 0.01 -0.95 -4.58 3.58 -0.08 0.47 -4.81 116.55 110.20 1nho n ASP 35 Ca -0.11 -3.28 -0.41 0.00 -1.51 0.00 0.00 54.79 49.47 1nho n ASP 35 Cb 0.59 0.67 -0.07 0.00 2.34 0.00 0.00 41.12 44.65 1nho n ASP 35 CO 0.00 0.00 0.00 -0.69 0.12 0.00 0.00 177.20 176.63 1nho s VAL 36 N -0.84 4.94 0.01 5.18 1.01 -1.19 -2.94 120.40 126.56 1nho s VAL 36 Ca 0.31 0.64 -0.06 0.00 0.00 0.00 0.00 61.98 62.88 1nho s VAL 36 Cb 0.29 -4.02 -0.05 0.00 0.00 0.00 0.00 36.38 32.61 1nho s VAL 36 CO -0.09 -0.22 0.25 -1.61 0.00 0.00 0.00 175.10 173.43 1nho s GLU 37 N 2.60 3.55 -0.04 2.72 0.41 1.07 -4.79 118.70 124.23 1nho s GLU 37 Ca 0.23 -0.12 -0.02 0.00 -0.41 0.00 0.00 54.97 54.65 1nho s GLU 37 Cb -0.15 -3.07 0.03 0.00 -1.78 0.00 0.00 34.13 29.16 1nho s GLU 37 CO 0.13 0.65 0.06 -1.59 -0.49 0.00 0.00 175.26 174.02 1nho s LYS 38 N -1.82 -0.07 0.42 1.61 0.00 -1.26 -1.66 119.74 116.95 1nho s LYS 38 Ca 0.28 0.35 0.04 0.00 0.00 0.00 0.00 55.97 56.64 1nho s LYS 38 Cb -0.13 -0.47 -0.02 0.00 0.00 0.00 0.00 37.83 37.20 1nho s LYS 38 CO 0.17 -0.31 0.12 0.96 0.00 0.00 0.00 175.35 176.29 1nho s ILE 39 N 2.01 0.65 0.35 3.79 -0.00 0.34 -4.83 121.20 123.51 1nho s ILE 39 Ca 0.03 -2.00 0.08 0.00 -0.00 0.00 0.00 60.65 58.76 1nho s ILE 39 Cb -0.12 -2.32 -0.05 0.00 -0.00 0.00 0.00 42.46 39.96 1nho s ILE 39 CO -0.03 0.00 0.09 1.51 -0.00 0.00 0.00 174.94 176.51 1nho s ASP 40 N -3.64 4.43 0.34 4.36 1.47 -1.26 -3.18 116.67 119.19 1nho s ASP 40 Ca 0.22 -0.91 0.11 0.00 1.18 0.00 0.00 52.55 53.15 1nho s ASP 40 Cb 0.02 -0.61 0.91 0.00 -0.34 0.00 0.00 42.92 42.90 1nho s ASP 40 CO 0.14 -0.30 1.76 -0.29 0.68 0.00 0.00 175.17 177.15 1nho h ILE 41 N 1.65 0.59 -0.01 2.11 2.10 -1.51 0.47 117.51 122.91 1nho h ILE 41 Ca -0.43 -0.20 0.00 0.00 1.08 0.00 0.00 64.86 65.31 1nho h ILE 41 Cb 1.25 -0.04 0.00 0.00 -1.09 0.00 0.00 36.82 36.94 1nho h ILE 41 CO 0.66 0.11 -0.12 1.15 -1.08 0.00 0.00 178.15 178.86 1nho n MET 42 N -4.77 0.95 -0.06 2.19 0.00 -1.26 -3.23 117.12 110.95 1nho n MET 42 Ca 0.25 -0.43 -0.10 0.00 0.00 0.00 0.00 57.70 57.42 1nho n MET 42 Cb 0.73 -1.49 -0.05 0.00 0.00 0.00 0.00 33.22 32.41 1nho n MET 42 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 175.97 177.30 1nho n VAL 43 N -0.64 0.67 -2.03 3.17 0.24 0.84 -4.70 118.33 115.86 1nho n VAL 43 Ca 0.16 -0.22 -0.30 0.00 -2.04 0.00 0.00 64.34 61.93 1nho n VAL 43 Cb 0.30 -1.22 0.03 0.00 -1.47 0.00 0.00 33.84 31.48 1nho n VAL 43 CO 0.00 0.00 0.00 -0.67 -2.14 0.00 0.00 176.83 174.02 1nho n ASP 44 N -3.13 5.88 0.00 -1.34 -0.08 0.13 -4.74 116.55 113.28 1nho n ASP 44 Ca -0.22 -3.77 0.01 0.00 -1.51 0.00 0.00 54.79 49.30 1nho n ASP 44 Cb 0.70 -0.64 0.05 0.00 2.34 0.00 0.00 41.12 43.57 1nho n ASP 44 CO 0.00 0.00 0.00 -1.14 0.12 0.00 0.00 177.20 176.18 1nho n ARG 45 N -0.64 0.03 0.33 -0.67 0.63 -1.20 -1.92 116.66 113.23 1nho n ARG 45 Ca 0.48 0.22 0.17 0.00 -0.92 0.00 0.00 57.85 57.79 1nho n ARG 45 Cb 0.66 -1.50 0.90 0.00 0.45 0.00 0.00 32.46 32.97 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 -0.01 -0.14 4.39 -1.89 -2.64 114.58 114.28 1nho h GLU 46 Ca 0.00 0.00 0.03 0.00 0.34 0.00 0.00 59.36 59.73 1nho h GLU 46 Cb 0.01 0.00 -0.06 0.00 -0.10 0.00 0.00 28.75 28.61 1nho h GLU 46 CO 0.00 0.00 -0.50 -0.22 -1.16 0.00 0.00 179.01 177.13 1nho h LYS 47 N 0.00 -0.61 0.00 2.33 1.63 -1.77 0.46 116.57 118.60 1nho h LYS 47 Ca 0.00 0.04 0.00 0.00 -0.85 0.00 0.00 60.65 59.84 1nho h LYS 47 Cb 0.49 0.14 0.00 0.00 -0.60 0.00 0.00 32.23 32.26 1nho h LYS 47 CO 0.00 -0.41 0.00 0.00 -3.45 0.00 0.00 179.45 175.59 1nho n ALA 48 N -2.95 1.82 -0.35 5.00 0.00 -1.00 -3.60 120.51 119.44 1nho n ALA 48 Ca -0.07 -0.05 0.30 0.00 0.00 0.00 0.00 53.44 53.62 1nho n ALA 48 Cb 0.39 -1.14 0.52 0.00 0.00 0.00 0.00 19.45 19.22 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 -0.23 0.01 0.00 -6.64 0.16 0.60 119.36 112.26 1nho n ILE 49 Ca 0.06 1.46 -0.10 0.00 -1.77 0.00 0.00 62.75 62.41 1nho n ILE 49 Cb 0.03 -2.39 -0.03 0.00 -1.44 0.00 0.00 39.64 35.81 1nho n ILE 49 CO 0.00 0.00 0.00 -0.33 -1.77 0.00 0.00 176.55 174.45 1nho h GLU 50 N 0.00 -0.24 0.00 6.28 5.08 -1.78 -3.36 114.58 120.56 1nho h GLU 50 Ca 0.69 0.02 0.00 0.00 -1.00 0.00 0.00 59.36 59.06 1nho h GLU 50 Cb 2.14 0.05 0.00 0.00 0.50 0.00 0.00 28.75 31.44 1nho h GLU 50 CO -0.42 -0.16 -0.86 2.48 -1.00 0.00 0.00 179.01 179.05 1nho n TYR 51 N -5.33 0.00 -0.46 4.33 4.11 1.88 -4.97 117.16 116.73 1nho n TYR 51 Ca -0.03 0.00 -0.00 0.00 -0.00 0.00 0.00 57.90 57.87 1nho n TYR 51 Cb 0.24 0.00 -0.00 0.00 -0.00 0.00 0.00 39.34 39.58 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 2.57 0.03 0.04 -7.48 0.00 2.57 -4.61 105.19 98.31 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 -5.26 0.99 3.38 -1.93 -3.40 115.31 109.09 1nho h LEU 53 Ca -0.01 0.00 -0.72 0.00 0.09 0.00 0.00 57.88 57.24 1nho h LEU 53 Cb 0.04 0.00 -0.32 0.00 0.09 0.00 0.00 40.66 40.47 1nho h LEU 53 CO 0.01 0.47 0.47 0.23 0.09 0.00 0.00 178.44 179.71 1nho n MET 54 N -3.98 3.64 -3.43 1.13 2.81 -1.26 -4.99 117.12 111.04 1nho n MET 54 Ca -0.03 -4.19 -0.42 0.00 -1.81 0.00 0.00 57.70 51.24 1nho n MET 54 Cb 0.11 -2.31 -0.10 0.00 -0.71 0.00 0.00 33.22 30.21 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 -3.96 3.47 0.06 3.04 0.00 -1.26 -4.80 121.76 118.32 1nho s ALA 55 Ca 0.47 -1.58 0.00 0.00 0.00 0.00 0.00 51.96 50.85 1nho s ALA 55 Cb 0.35 -2.90 0.00 0.00 0.00 0.00 0.00 23.12 20.57 1nho s ALA 55 CO -0.26 -1.40 0.00 1.33 0.00 0.00 0.00 175.76 175.43 1nho n VAL 56 N 5.23 0.00 -3.21 0.00 0.24 -1.26 -4.94 118.33 114.38 1nho n VAL 56 Ca -0.10 0.00 -0.44 0.00 -2.04 0.00 0.00 64.34 61.76 1nho n VAL 56 Cb 0.48 -0.05 -0.06 0.00 -1.47 0.00 0.00 33.84 32.73 1nho n VAL 56 CO 0.00 0.00 0.00 -2.16 -2.14 0.00 0.00 176.83 172.53 1nho s PRO 57 N -1.16 3.06 0.34 7.34 0.04 -1.25 -3.95 135.00 139.41 1nho s PRO 57 Ca 0.00 -1.16 -0.16 0.00 0.04 0.00 0.00 61.00 59.73 1nho s PRO 57 Cb 0.00 -4.16 0.03 0.00 0.04 0.00 0.00 34.50 30.41 1nho s PRO 57 CO 0.00 -1.25 0.71 0.00 0.04 0.00 0.00 177.00 176.50 1nho s ALA 58 N 2.33 -0.71 -0.01 8.56 0.00 0.15 0.11 121.76 132.19 1nho s ALA 58 Ca 0.11 -0.69 0.01 0.00 0.00 0.00 0.00 51.96 51.38 1nho s ALA 58 Cb -0.22 0.81 0.01 0.00 0.00 0.00 0.00 23.12 23.72 1nho s ALA 58 CO 0.09 -0.97 -0.01 0.42 0.00 0.00 0.00 175.76 175.29 1nho s ILE 59 N -3.05 0.14 0.20 0.00 1.09 -1.03 -0.95 121.20 117.61 1nho s ILE 59 Ca 0.16 0.00 -0.28 0.00 -1.10 0.00 0.00 60.65 59.43 1nho s ILE 59 Cb -0.05 -0.18 -0.08 0.00 -1.06 0.00 0.00 42.46 41.09 1nho s ILE 59 CO 0.11 0.08 0.88 0.00 -0.10 0.00 0.00 174.94 175.91 1nho s ALA 60 N 0.42 3.37 -1.13 9.38 0.00 0.12 -0.87 121.76 133.06 1nho s ALA 60 Ca -0.04 0.52 -0.16 0.00 0.00 0.00 0.00 51.96 52.28 1nho s ALA 60 Cb -0.06 -3.12 0.15 0.00 0.00 0.00 0.00 23.12 20.08 1nho s ALA 60 CO -0.01 0.22 1.37 0.42 0.00 0.00 0.00 175.76 177.76 1nho s ILE 61 N -1.08 4.83 -0.38 0.00 1.01 1.11 -3.34 121.20 123.35 1nho s ILE 61 Ca 0.39 -2.21 -0.06 0.00 0.00 0.00 0.00 60.65 58.78 1nho s ILE 61 Cb -0.25 -4.90 -0.11 0.00 0.01 0.00 0.00 42.46 37.21 1nho s ILE 61 CO 0.30 -1.63 1.45 0.59 0.00 0.00 0.00 174.94 175.64 1nho n ASN 62 N 6.23 -1.35 0.00 3.58 4.13 -1.26 0.83 115.26 127.43 1nho n ASN 62 Ca 0.34 -1.34 0.00 0.00 1.68 0.00 0.00 54.58 55.26 1nho n ASN 62 Cb 0.45 -0.76 0.00 0.00 -1.54 0.00 0.00 39.78 37.93 1nho n ASN 62 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1nho n GLY 63 N 5.01 1.47 1.32 7.41 0.00 -1.26 -4.11 105.19 115.03 1nho n GLY 63 Ca 0.22 -0.08 0.00 0.00 0.00 0.00 0.00 46.02 46.16 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 0.87 0.00 1.61 0.24 0.24 -4.81 118.33 116.48 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 -1.27 0.00 0.00 -1.47 0.00 0.00 33.84 31.10 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 -3.49 0.00 -3.58 3.34 0.31 -1.12 -4.93 118.33 108.86 1nho n VAL 65 Ca 0.00 0.00 -0.08 0.00 -0.01 0.00 0.00 64.34 64.25 1nho n VAL 65 Cb 0.01 0.00 -0.02 0.00 -0.91 0.00 0.00 33.84 32.92 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 1.76 1.12 0.31 5.55 3.52 -1.26 0.36 118.95 130.30 1nho s ARG 66 Ca 0.00 -0.50 -0.00 0.00 -0.13 0.00 0.00 55.73 55.10 1nho s ARG 66 Cb 0.00 0.46 -0.01 0.00 -1.56 0.00 0.00 34.95 33.83 1nho s ARG 66 CO 0.00 -0.50 0.37 -0.59 -0.81 0.00 0.00 175.30 173.77 1nho s PHE 67 N -3.38 1.24 -0.33 5.12 -0.71 -0.05 -4.73 117.98 115.13 1nho s PHE 67 Ca 0.07 -1.38 -0.22 0.00 -1.04 0.00 0.00 56.93 54.36 1nho s PHE 67 Cb -0.02 -0.32 0.00 0.00 -1.21 0.00 0.00 43.02 41.47 1nho s PHE 67 CO -0.05 -0.98 0.70 0.08 -1.34 0.00 0.00 175.22 173.63 1nho s VAL 68 N -3.40 4.85 -0.29 -2.49 1.01 -1.26 -2.46 120.40 116.36 1nho s VAL 68 Ca 0.34 0.84 -0.14 0.00 0.00 0.00 0.00 61.98 63.02 1nho s VAL 68 Cb 0.01 -4.10 0.12 0.00 0.00 0.00 0.00 36.38 32.42 1nho s VAL 68 CO 0.21 -0.28 0.78 -0.83 0.00 0.00 0.00 175.10 174.98 1nho s GLY 69 N 1.73 -0.47 0.00 4.51 0.00 0.30 -4.90 107.32 108.50 1nho s GLY 69 Ca 0.28 2.65 0.00 0.00 0.00 0.00 0.00 44.72 47.65 1nho s GLY 69 CO 0.14 2.82 0.00 0.00 0.00 0.00 0.00 173.10 176.06 1nho n ALA 70 N 4.71 0.00 0.89 3.20 0.00 -1.13 -0.05 120.51 128.13 1nho n ALA 70 Ca -0.15 -0.01 -0.00 0.00 0.00 0.00 0.00 53.44 53.28 1nho n ALA 70 Cb 0.54 0.00 0.01 0.00 0.00 0.00 0.00 19.45 20.01 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 -1.18 1.13 -3.41 0.00 -0.04 -1.26 -4.59 135.00 125.64 1nho n PRO 71 Ca 0.00 -0.16 -0.43 0.00 -0.04 0.00 0.00 63.50 62.87 1nho n PRO 71 Cb 0.00 -1.29 -0.02 0.00 -0.04 0.00 0.00 33.50 32.15 1nho n PRO 71 CO 0.00 0.00 0.00 -1.12 -0.04 0.00 0.00 175.50 174.34 1nho s SER 72 N 0.45 6.85 0.10 3.54 0.01 -1.26 -4.79 113.70 118.59 1nho s SER 72 Ca 0.03 -3.40 -0.05 0.00 1.31 0.00 0.00 55.95 53.84 1nho s SER 72 Cb 0.02 -2.13 -0.19 0.00 0.21 0.00 0.00 66.02 63.92 1nho s SER 72 CO 0.01 -0.33 1.21 0.03 0.41 0.00 0.00 173.24 174.57 1nho h ARG 73 N 6.79 0.36 -1.38 12.44 -0.00 -1.86 -3.20 114.38 127.53 1nho h ARG 73 Ca 0.15 -0.49 0.40 0.00 -0.50 0.00 0.00 59.98 59.54 1nho h ARG 73 Cb 0.90 0.16 -0.06 0.00 0.00 0.00 0.00 29.97 30.98 1nho h ARG 73 CO 0.91 1.18 1.00 1.49 0.00 0.00 0.00 179.97 184.55 1nho h GLU 74 N 0.16 0.01 -0.86 0.04 4.81 -1.87 0.43 114.58 117.29 1nho h GLU 74 Ca -0.12 -0.00 0.17 0.00 -0.13 0.00 0.00 59.36 59.28 1nho h GLU 74 Cb 1.79 -0.00 -0.10 0.00 0.63 0.00 0.00 28.75 31.06 1nho h GLU 74 CO 0.19 0.00 0.42 0.93 -0.73 0.00 0.00 179.01 179.82 1nho h GLU 75 N 0.01 0.53 -0.35 1.92 4.39 -1.93 0.28 114.58 119.42 1nho h GLU 75 Ca 0.66 -0.03 -0.02 0.00 0.34 0.00 0.00 59.36 60.31 1nho h GLU 75 Cb 2.64 -0.12 -0.02 0.00 -0.10 0.00 0.00 28.75 31.15 1nho h GLU 75 CO -0.01 0.35 0.13 -0.07 -1.16 0.00 0.00 179.01 178.25 1nho h LEU 76 N 0.55 0.49 -1.09 1.33 -0.00 -0.37 0.64 115.31 116.86 1nho h LEU 76 Ca 0.49 -0.18 -0.01 0.00 -0.00 0.00 0.00 57.88 58.18 1nho h LEU 76 Cb 0.77 -0.13 -0.04 0.00 -0.00 0.00 0.00 40.66 41.27 1nho h LEU 76 CO -0.41 0.54 0.48 0.15 -0.00 0.00 0.00 178.44 179.20 1nho h PHE 77 N 0.42 1.08 0.00 1.13 3.57 -0.83 -1.10 116.94 121.21 1nho h PHE 77 Ca 0.12 -0.00 -0.04 0.00 3.53 0.00 0.00 57.97 61.57 1nho h PHE 77 Cb 0.21 -0.35 -0.01 0.00 2.79 0.00 0.00 35.95 38.59 1nho h PHE 77 CO 0.00 0.72 -0.21 1.49 -2.23 0.00 0.00 178.31 178.08 1nho h GLU 78 N 1.12 0.00 0.13 1.11 4.81 -0.23 -3.23 114.58 118.29 1nho h GLU 78 Ca 0.29 0.00 -0.30 0.00 -0.13 0.00 0.00 59.36 59.22 1nho h GLU 78 Cb -0.03 0.00 0.03 0.00 0.63 0.00 0.00 28.75 29.38 1nho h GLU 78 CO -0.05 0.19 -1.26 0.00 -0.73 0.00 0.00 179.01 177.15 1nho h ALA 79 N 1.81 -0.01 -0.63 2.92 0.00 0.13 0.68 119.26 124.16 1nho h ALA 79 Ca -0.00 -0.78 -0.09 0.00 0.00 0.00 0.00 54.91 54.04 1nho h ALA 79 Cb 1.15 0.11 -0.02 0.00 0.00 0.00 0.00 17.79 19.03 1nho h ALA 79 CO 0.02 0.70 0.04 0.82 0.00 0.00 0.00 179.25 180.83 1nho h ILE 80 N 0.27 1.26 -0.00 0.00 5.03 -1.34 1.42 117.51 124.16 1nho h ILE 80 Ca -0.19 -1.10 -0.18 0.00 -0.12 0.00 0.00 64.86 63.26 1nho h ILE 80 Cb 1.93 0.73 -0.01 0.00 -3.03 0.00 0.00 36.82 36.44 1nho h ILE 80 CO 0.24 0.41 -0.82 -1.13 -0.68 0.00 0.00 178.15 176.16 1nho h ASN 81 N 0.99 0.19 0.46 1.72 -0.73 -1.61 -0.58 115.58 116.01 1nho h ASN 81 Ca 0.18 -0.15 0.00 0.00 1.87 0.00 0.00 56.30 58.21 1nho h ASN 81 Cb 0.51 -0.06 0.00 0.00 0.27 0.00 0.00 38.32 39.04 1nho h ASN 81 CO 0.02 0.93 -0.38 -0.67 -0.37 0.00 0.00 177.43 176.96 1nho n ASP 82 N -3.67 0.60 -0.02 1.15 2.03 0.23 -0.42 116.55 116.45 1nho n ASP 82 Ca -0.03 -0.38 -0.01 0.00 0.52 0.00 0.00 54.79 54.89 1nho n ASP 82 Cb 0.77 0.15 -0.01 0.00 -0.72 0.00 0.00 41.12 41.32 1nho n ASP 82 CO 0.00 0.00 0.00 -0.08 -1.92 0.00 0.00 177.20 175.20 1nho h GLU 83 N 0.34 -0.07 0.00 -0.67 4.57 0.22 -3.27 114.58 115.70 1nho h GLU 83 Ca 0.00 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.18 1nho h GLU 83 Cb 0.49 0.02 0.00 0.00 -0.16 0.00 0.00 28.75 29.10 1nho h GLU 83 CO 0.00 -0.04 0.00 0.00 -1.18 0.00 0.00 179.01 177.79 1nho n MET 84 N -4.63 0.05 0.00 1.92 0.00 -0.25 -4.91 117.12 109.30 1nho n MET 84 Ca -0.01 0.19 0.00 0.00 0.00 0.00 0.00 57.70 57.88 1nho n MET 84 Cb 0.03 -1.50 0.00 0.00 0.00 0.00 0.00 33.22 31.75 1nho n MET 84 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 175.97 174.06