#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 -3.09 3.17 3.14 -1.26 -4.80 118.33 115.49 1nho n VAL 2 Ca 0.00 0.00 -0.44 0.00 -2.96 0.00 0.00 64.34 60.94 1nho n VAL 2 Cb 0.00 0.00 -0.06 0.00 -1.06 0.00 0.00 33.84 32.72 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 0.70 4.78 -0.23 1.55 1.01 -1.25 -4.89 120.40 122.07 1nho s VAL 3 Ca 0.00 -0.33 -0.01 0.00 0.00 0.00 0.00 61.98 61.65 1nho s VAL 3 Cb 0.00 -4.34 0.06 0.00 0.00 0.00 0.00 36.38 32.10 1nho s VAL 3 CO 0.00 -0.86 -0.01 0.21 0.00 0.00 0.00 175.10 174.44 1nho s ASN 4 N 2.71 3.55 -0.04 3.32 2.47 -1.22 0.65 114.94 126.38 1nho s ASN 4 Ca 0.18 -1.11 0.05 0.00 0.42 0.00 0.00 52.86 52.41 1nho s ASN 4 Cb -0.18 -0.96 -0.01 0.00 -1.45 0.00 0.00 41.25 38.66 1nho s ASN 4 CO 0.13 -0.28 -0.20 -0.63 -3.72 0.00 0.00 177.10 172.40 1nho s ILE 5 N 1.57 1.65 -0.29 -5.21 -1.09 -1.16 -4.20 121.20 112.48 1nho s ILE 5 Ca -0.03 -0.86 0.02 0.00 -2.23 0.00 0.00 60.65 57.55 1nho s ILE 5 Cb -0.18 -1.40 0.08 0.00 -1.58 0.00 0.00 42.46 39.39 1nho s ILE 5 CO -0.08 0.47 0.02 -0.70 -1.23 0.00 0.00 174.94 173.41 1nho s GLU 6 N -0.20 1.37 -0.52 2.79 2.56 -1.04 0.44 118.70 124.10 1nho s GLU 6 Ca 0.00 -1.33 -0.19 0.00 0.00 0.00 0.00 54.97 53.45 1nho s GLU 6 Cb -0.11 -2.66 0.06 0.00 2.00 0.00 0.00 34.13 33.42 1nho s GLU 6 CO 0.01 -0.81 0.65 0.14 -0.56 0.00 0.00 175.26 174.70 1nho s VAL 7 N 1.27 4.84 -0.66 3.70 -7.23 -0.52 -0.55 120.40 121.25 1nho s VAL 7 Ca 0.04 -0.52 0.03 0.00 -1.81 0.00 0.00 61.98 59.71 1nho s VAL 7 Cb -0.19 -4.34 0.16 0.00 0.56 0.00 0.00 36.38 32.58 1nho s VAL 7 CO -0.12 -0.87 0.45 0.12 -0.31 0.00 0.00 175.10 174.38 1nho s PHE 8 N 2.71 3.47 0.03 2.82 5.36 0.05 0.19 117.98 132.61 1nho s PHE 8 Ca 0.15 -3.16 0.00 0.00 -0.96 0.00 0.00 56.93 52.96 1nho s PHE 8 Cb -0.20 -2.89 0.00 0.00 -0.34 0.00 0.00 43.02 39.60 1nho s PHE 8 CO 0.11 -0.68 0.00 2.41 -1.46 0.00 0.00 175.22 175.61 1nho n THR 9 N 2.60 0.40 0.00 0.12 -1.04 -1.18 0.39 114.28 115.57 1nho n THR 9 Ca 0.13 0.13 0.00 0.00 -2.04 0.00 0.00 64.05 62.28 1nho n THR 9 Cb 0.35 -1.52 0.00 0.00 -1.82 0.00 0.00 70.33 67.34 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 -3.16 0.00 0.03 8.00 3.41 -1.26 -2.47 113.62 118.17 1nho n SER 10 Ca 0.00 0.00 -0.07 0.00 -0.26 0.00 0.00 58.87 58.54 1nho n SER 10 Cb 0.33 0.00 -0.12 0.00 -0.26 0.00 0.00 64.21 64.17 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 0.00 4.33 0.13 -1.91 -3.29 132.00 131.26 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 0.73 0.00 1.79 -0.23 0.00 0.00 178.00 180.29 1nho h THR 12 N 0.00 0.00 -1.31 1.56 1.35 -2.02 -3.46 112.91 109.03 1nho h THR 12 Ca -0.12 -0.68 -0.64 0.00 -0.55 0.00 0.00 66.41 64.42 1nho h THR 12 Cb 1.83 1.68 -0.13 0.00 -1.73 0.00 0.00 68.15 69.79 1nho h THR 12 CO 0.10 0.00 -0.50 0.00 -0.25 0.00 0.00 175.52 174.88 1nho s PRO 14 N -3.78 3.69 0.00 0.00 0.04 -1.26 -4.59 135.00 129.09 1nho s PRO 14 Ca 0.10 0.41 0.00 0.00 0.04 0.00 0.00 61.00 61.55 1nho s PRO 14 Cb 0.01 -3.88 0.00 0.00 0.04 0.00 0.00 34.50 30.67 1nho s PRO 14 CO 0.07 -1.15 0.00 0.66 0.04 0.00 0.00 177.00 176.62 1nho n TYR 15 N 7.16 0.00 -2.71 0.56 4.01 -1.26 -4.83 117.16 120.09 1nho n TYR 15 Ca 0.08 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 -1.27 0.73 -0.06 0.00 -0.04 -1.26 -3.88 135.00 129.23 1nho n PRO 17 Ca -0.11 0.00 -0.02 0.00 -0.04 0.00 0.00 63.50 63.33 1nho n PRO 17 Cb 0.86 -1.23 -0.01 0.00 -0.04 0.00 0.00 33.50 33.09 1nho n PRO 17 CO 0.00 0.00 0.00 1.98 -0.04 0.00 0.00 175.50 177.44 1nho h MET 18 N 0.16 0.00 0.00 0.54 1.85 -1.92 -3.25 114.93 112.31 1nho h MET 18 Ca 0.00 0.00 0.00 0.00 -0.61 0.00 0.00 59.70 59.09 1nho h MET 18 Cb 0.23 0.00 0.00 0.00 0.43 0.00 0.00 31.60 32.26 1nho h MET 18 CO 0.00 0.00 0.17 0.00 -0.40 0.00 0.00 176.91 176.68 1nho h ALA 19 N -1.07 1.16 -0.13 0.39 0.00 -1.70 0.87 119.26 118.78 1nho h ALA 19 Ca 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 54.91 54.68 1nho h ALA 19 Cb 0.22 0.00 0.01 0.00 0.00 0.00 0.00 17.79 18.02 1nho h ALA 19 CO 0.00 -0.16 -0.81 -0.84 0.00 0.00 0.00 179.25 177.44 1nho h ILE 20 N 0.00 1.28 -0.86 0.00 -0.00 -1.75 -1.53 117.51 114.65 1nho h ILE 20 Ca 0.00 -2.01 0.16 0.00 -0.00 0.00 0.00 64.86 63.01 1nho h ILE 20 Cb 0.34 2.05 -0.07 0.00 -0.00 0.00 0.00 36.82 39.14 1nho h ILE 20 CO 0.00 0.63 0.56 -0.08 -0.00 0.00 0.00 178.15 179.26 1nho h GLU 21 N 0.51 0.56 0.00 0.16 4.22 -0.85 2.84 114.58 122.01 1nho h GLU 21 Ca -0.06 -0.03 -0.26 0.00 0.08 0.00 0.00 59.36 59.08 1nho h GLU 21 Cb 1.45 -0.13 0.02 0.00 0.50 0.00 0.00 28.75 30.59 1nho h GLU 21 CO 0.17 0.37 -1.04 0.28 -2.18 0.00 0.00 179.01 176.61 1nho h VAL 22 N 0.57 1.29 0.00 0.32 2.07 -1.51 -1.64 116.25 117.36 1nho h VAL 22 Ca 0.43 -2.28 -0.07 0.00 0.82 0.00 0.00 66.70 65.60 1nho h VAL 22 Cb 0.83 2.39 -0.01 0.00 -1.52 0.00 0.00 31.29 32.98 1nho h VAL 22 CO -0.18 0.70 -0.35 0.58 0.02 0.00 0.00 177.57 178.34 1nho h VAL 23 N 0.37 0.93 -0.06 2.57 2.07 0.36 -2.71 116.25 119.78 1nho h VAL 23 Ca -0.12 -1.38 -0.22 0.00 0.82 0.00 0.00 66.70 65.80 1nho h VAL 23 Cb 1.69 1.82 0.01 0.00 -1.52 0.00 0.00 31.29 33.28 1nho h VAL 23 CO 0.20 0.35 -0.86 -0.78 0.02 0.00 0.00 177.57 176.49 1nho h ASP 24 N 0.00 0.70 -0.53 0.57 1.82 0.50 0.28 116.42 119.77 1nho h ASP 24 Ca -0.00 -0.51 0.02 0.00 -0.39 0.00 0.00 57.03 56.15 1nho h ASP 24 Cb 0.79 -0.21 -0.03 0.00 0.68 0.00 0.00 39.33 40.56 1nho h ASP 24 CO 0.05 1.29 0.32 -0.08 -1.61 0.00 0.00 179.24 179.21 1nho h GLU 25 N 0.36 0.63 0.20 0.28 4.22 -1.00 0.52 114.58 119.79 1nho h GLU 25 Ca -0.07 -0.04 -0.31 0.00 0.08 0.00 0.00 59.36 59.03 1nho h GLU 25 Cb 1.49 -0.14 0.03 0.00 0.50 0.00 0.00 28.75 30.63 1nho h GLU 25 CO 0.16 0.42 -1.33 0.00 -2.18 0.00 0.00 179.01 176.08 1nho h ALA 26 N 1.23 -0.11 0.00 2.92 0.00 -1.48 -3.00 119.26 118.82 1nho h ALA 26 Ca 0.21 -0.81 -0.03 0.00 0.00 0.00 0.00 54.91 54.28 1nho h ALA 26 Cb 0.00 0.15 -0.00 0.00 0.00 0.00 0.00 17.79 17.94 1nho h ALA 26 CO -0.08 0.65 -0.16 0.87 0.00 0.00 0.00 179.25 180.52 1nho h LYS 27 N 0.13 0.00 -0.15 0.00 1.79 -0.22 -1.90 116.57 116.22 1nho h LYS 27 Ca -0.22 0.00 -0.05 0.00 -2.18 0.00 0.00 60.65 58.20 1nho h LYS 27 Cb 2.03 0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 32.67 1nho h LYS 27 CO 0.25 0.16 -0.10 0.87 -1.08 0.00 0.00 179.45 179.56 1nho h LYS 28 N 0.00 0.33 -0.94 3.15 1.57 0.03 2.26 116.57 122.98 1nho h LYS 28 Ca -0.00 -0.16 0.27 0.00 -1.87 0.00 0.00 60.65 58.89 1nho h LYS 28 Cb 0.38 -0.00 -0.14 0.00 0.08 0.00 0.00 32.23 32.55 1nho h LYS 28 CO 0.02 0.68 0.42 1.05 -0.57 0.00 0.00 179.45 181.05 1nho h GLU 29 N -0.02 0.31 0.00 3.15 -0.00 -1.20 -0.78 114.58 116.05 1nho h GLU 29 Ca 0.03 -0.02 -0.10 0.00 -0.00 0.00 0.00 59.36 59.28 1nho h GLU 29 Cb 0.59 -0.07 -0.01 0.00 -0.00 0.00 0.00 28.75 29.26 1nho h GLU 29 CO 0.03 0.21 -0.83 0.34 -0.00 0.00 0.00 179.01 178.75 1nho n PHE 30 N -5.10 0.95 -3.15 2.06 7.35 -1.06 -4.58 117.46 113.93 1nho n PHE 30 Ca 0.26 0.41 -0.44 0.00 -0.76 0.00 0.00 57.45 56.92 1nho n PHE 30 Cb 0.80 -0.90 0.00 0.00 0.35 0.00 0.00 39.48 39.73 1nho n PHE 30 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1nho n GLY 31 N 1.54 4.01 0.28 7.13 0.00 0.76 -4.87 105.19 114.04 1nho n GLY 31 Ca -0.17 -2.38 0.00 0.00 0.00 0.00 0.00 46.02 43.47 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 3.64 0.00 -4.90 1.61 2.03 -0.34 -4.06 116.55 114.54 1nho n ASP 32 Ca 0.29 0.42 -0.28 0.00 0.52 0.00 0.00 54.79 55.74 1nho n ASP 32 Cb 0.40 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.80 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 -3.56 3.54 -0.06 -0.67 1.02 -1.26 -4.94 119.74 113.80 1nho s LYS 33 Ca 0.00 0.31 0.02 0.00 0.02 0.00 0.00 55.97 56.32 1nho s LYS 33 Cb 0.00 -2.31 0.02 0.00 -0.52 0.00 0.00 37.83 35.02 1nho s LYS 33 CO 0.00 -0.29 -0.10 0.42 -0.92 0.00 0.00 175.35 174.46 1nho s ILE 34 N -2.84 0.94 -0.44 2.17 -1.09 -1.26 -3.82 121.20 114.86 1nho s ILE 34 Ca 0.49 -0.36 0.06 0.00 -2.23 0.00 0.00 60.65 58.62 1nho s ILE 34 Cb -0.10 -0.89 0.22 0.00 -1.58 0.00 0.00 42.46 40.10 1nho s ILE 34 CO 0.47 0.31 0.47 -0.67 -1.23 0.00 0.00 174.94 174.30 1nho n ASP 35 N 3.95 0.44 -4.57 3.58 -0.08 0.21 -4.92 116.55 115.15 1nho n ASP 35 Ca -0.23 -2.68 -0.41 0.00 -1.51 0.00 0.00 54.79 49.96 1nho n ASP 35 Cb 0.51 -0.62 -0.07 0.00 2.34 0.00 0.00 41.12 43.28 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 -0.86 4.98 0.07 5.18 1.01 -1.21 -2.96 120.40 126.60 1nho s VAL 36 Ca 0.34 0.55 -0.04 0.00 0.00 0.00 0.00 61.98 62.83 1nho s VAL 36 Cb 0.11 -3.98 -0.05 0.00 0.00 0.00 0.00 36.38 32.46 1nho s VAL 36 CO -0.14 -0.19 0.29 -1.61 0.00 0.00 0.00 175.10 173.44 1nho s GLU 37 N 2.50 3.55 -0.04 2.72 2.02 1.50 -4.79 118.70 126.17 1nho s GLU 37 Ca 0.22 -0.19 -0.02 0.00 0.02 0.00 0.00 54.97 54.99 1nho s GLU 37 Cb -0.15 -2.99 0.03 0.00 0.10 0.00 0.00 34.13 31.12 1nho s GLU 37 CO 0.13 0.57 0.06 -1.59 0.02 0.00 0.00 175.26 174.45 1nho s LYS 38 N -2.31 -0.07 0.46 1.61 0.00 -1.25 -1.43 119.74 116.75 1nho s LYS 38 Ca 0.35 0.36 0.04 0.00 0.00 0.00 0.00 55.97 56.71 1nho s LYS 38 Cb -0.13 -0.49 -0.04 0.00 0.00 0.00 0.00 37.83 37.17 1nho s LYS 38 CO 0.23 -0.32 0.01 0.96 0.00 0.00 0.00 175.35 176.23 1nho s ILE 39 N 2.08 1.51 0.38 3.79 -4.36 0.51 -4.80 121.20 120.31 1nho s ILE 39 Ca 0.04 -2.00 0.08 0.00 -0.26 0.00 0.00 60.65 58.51 1nho s ILE 39 Cb -0.12 -2.54 -0.04 0.00 1.25 0.00 0.00 42.46 41.01 1nho s ILE 39 CO -0.03 0.00 0.18 1.51 0.24 0.00 0.00 174.94 176.84 1nho s ASP 40 N -3.79 4.61 0.24 4.36 1.47 -1.26 -3.11 116.67 119.19 1nho s ASP 40 Ca 0.19 -0.90 -0.01 0.00 1.18 0.00 0.00 52.55 53.01 1nho s ASP 40 Cb 0.05 -0.60 0.29 0.00 -0.34 0.00 0.00 42.92 42.32 1nho s ASP 40 CO 0.10 -0.44 1.67 -0.29 0.68 0.00 0.00 175.17 176.89 1nho h ILE 41 N 1.44 1.27 -0.00 2.11 -0.00 -1.63 0.13 117.51 120.83 1nho h ILE 41 Ca -0.43 -1.30 0.00 0.00 -0.00 0.00 0.00 64.86 63.13 1nho h ILE 41 Cb 1.25 1.26 0.00 0.00 -0.00 0.00 0.00 36.82 39.34 1nho h ILE 41 CO 0.65 0.42 -0.38 1.15 -0.00 0.00 0.00 178.15 180.00 1nho n MET 42 N -4.12 0.49 -0.05 2.19 0.00 -1.26 -3.55 117.12 110.82 1nho n MET 42 Ca -0.00 -0.29 -0.06 0.00 0.00 0.00 0.00 57.70 57.34 1nho n MET 42 Cb 0.42 -1.49 -0.06 0.00 0.00 0.00 0.00 33.22 32.08 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 -1.00 0.63 -2.12 3.17 3.14 -1.14 -4.68 118.33 116.33 1nho n VAL 43 Ca 0.09 -0.30 -0.29 0.00 -2.96 0.00 0.00 64.34 60.88 1nho n VAL 43 Cb 0.34 -0.84 0.02 0.00 -1.06 0.00 0.00 33.84 32.30 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 -2.61 5.50 0.00 6.55 2.03 0.43 -4.76 116.55 123.69 1nho n ASP 44 Ca -0.18 -3.75 0.00 0.00 0.52 0.00 0.00 54.79 51.38 1nho n ASP 44 Cb 0.75 -0.56 0.00 0.00 -0.72 0.00 0.00 41.12 40.59 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 -0.62 0.00 0.30 -0.67 0.63 -1.23 -1.88 116.66 113.20 1nho n ARG 45 Ca 0.45 0.27 0.17 0.00 -0.92 0.00 0.00 57.85 57.82 1nho n ARG 45 Cb 0.71 -1.51 0.84 0.00 0.45 0.00 0.00 32.46 32.95 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 -0.02 -0.14 4.39 -1.90 -2.30 114.58 114.61 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 0.02 0.00 -0.05 0.00 -0.10 0.00 0.00 28.75 28.62 1nho h GLU 46 CO 0.00 0.00 -0.37 -0.22 -1.16 0.00 0.00 179.01 177.26 1nho h LYS 47 N 0.00 -0.50 0.00 2.33 1.63 -1.77 0.42 116.57 118.67 1nho h LYS 47 Ca 0.03 0.03 0.00 0.00 -0.85 0.00 0.00 60.65 59.86 1nho h LYS 47 Cb 0.66 0.11 0.00 0.00 -0.60 0.00 0.00 32.23 32.40 1nho h LYS 47 CO -0.00 -0.33 0.00 0.00 -3.45 0.00 0.00 179.45 175.67 1nho n ALA 48 N -2.84 1.66 -0.31 5.00 0.00 -0.87 -3.61 120.51 119.55 1nho n ALA 48 Ca -0.05 -0.04 0.27 0.00 0.00 0.00 0.00 53.44 53.62 1nho n ALA 48 Cb 0.35 -1.12 0.47 0.00 0.00 0.00 0.00 19.45 19.15 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 -1.13 -0.22 0.03 0.00 -6.64 0.15 0.63 119.36 112.19 1nho n ILE 49 Ca 0.05 1.34 -0.10 0.00 -1.77 0.00 0.00 62.75 62.27 1nho n ILE 49 Cb 0.04 -2.19 -0.04 0.00 -1.44 0.00 0.00 39.64 36.00 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 0.62 0.02 0.00 0.00 -1.00 0.00 0.00 59.36 59.00 1nho h GLU 50 Cb 1.91 0.05 0.00 0.00 0.50 0.00 0.00 28.75 31.21 1nho h GLU 50 CO -0.40 -0.16 -0.90 2.48 -1.00 0.00 0.00 179.01 179.03 1nho n TYR 51 N -5.30 0.00 -0.33 4.33 4.11 1.87 -4.96 117.16 116.87 1nho n TYR 51 Ca -0.04 0.00 -0.00 0.00 -0.00 0.00 0.00 57.90 57.86 1nho n TYR 51 Cb 0.22 0.00 -0.00 0.00 -0.00 0.00 0.00 39.34 39.56 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 2.62 0.01 0.02 -7.48 0.00 2.76 -4.60 105.19 98.51 1nho n GLY 52 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.01 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 -5.65 0.99 3.38 -1.93 -3.40 115.31 108.70 1nho h LEU 53 Ca -0.00 0.00 -0.76 0.00 0.09 0.00 0.00 57.88 57.21 1nho h LEU 53 Cb 0.01 0.00 -0.30 0.00 0.09 0.00 0.00 40.66 40.46 1nho h LEU 53 CO 0.00 0.25 0.72 0.23 0.09 0.00 0.00 178.44 179.73 1nho n MET 54 N -3.15 4.26 -3.36 1.13 2.81 -1.26 -4.98 117.12 112.57 1nho n MET 54 Ca -0.01 -4.35 -0.44 0.00 -1.81 0.00 0.00 57.70 51.08 1nho n MET 54 Cb 0.05 -2.37 -0.08 0.00 -0.71 0.00 0.00 33.22 30.12 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 -4.10 3.54 0.16 3.04 0.00 -1.26 -4.75 121.76 118.39 1nho s ALA 55 Ca 0.45 -2.05 0.00 0.00 0.00 0.00 0.00 51.96 50.36 1nho s ALA 55 Cb 0.29 -3.10 0.00 0.00 0.00 0.00 0.00 23.12 20.30 1nho s ALA 55 CO -0.22 -1.76 0.00 0.28 0.00 0.00 0.00 175.76 174.06 1nho n VAL 56 N 5.26 0.00 -3.25 0.00 0.31 -1.26 -4.90 118.33 114.48 1nho n VAL 56 Ca -0.12 0.00 -0.45 0.00 -0.01 0.00 0.00 64.34 63.77 1nho n VAL 56 Cb 0.44 -0.15 -0.06 0.00 -0.91 0.00 0.00 33.84 33.16 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 -1.45 3.03 0.33 5.55 0.04 -1.26 -4.03 135.00 137.21 1nho s PRO 57 Ca 0.00 -1.32 -0.09 0.00 0.04 0.00 0.00 61.00 59.63 1nho s PRO 57 Cb 0.00 -4.20 0.04 0.00 0.04 0.00 0.00 34.50 30.38 1nho s PRO 57 CO 0.00 -1.28 0.59 0.00 0.04 0.00 0.00 177.00 176.36 1nho n ALA 58 N 5.72 -1.11 -3.04 8.56 0.00 0.16 -0.14 120.51 130.67 1nho n ALA 58 Ca -0.11 -1.20 -0.12 0.00 0.00 0.00 0.00 53.44 52.01 1nho n ALA 58 Cb 0.43 0.96 -0.12 0.00 0.00 0.00 0.00 19.45 20.72 1nho n ALA 58 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 177.50 176.00 1nho s ILE 59 N -2.41 0.01 0.06 0.00 -1.16 -0.91 -0.77 121.20 116.01 1nho s ILE 59 Ca 0.18 -0.05 -0.28 0.00 -0.51 0.00 0.00 60.65 59.98 1nho s ILE 59 Cb -0.03 -0.24 -0.05 0.00 0.61 0.00 0.00 42.46 42.75 1nho s ILE 59 CO 0.13 -0.03 0.90 0.00 -2.81 0.00 0.00 174.94 173.13 1nho s ALA 60 N -0.03 3.27 -1.22 1.50 0.00 0.28 0.08 121.76 125.64 1nho s ALA 60 Ca -0.01 0.46 -0.16 0.00 0.00 0.00 0.00 51.96 52.25 1nho s ALA 60 Cb -0.02 -3.19 0.12 0.00 0.00 0.00 0.00 23.12 20.03 1nho s ALA 60 CO 0.00 -0.05 1.54 0.42 0.00 0.00 0.00 175.76 177.67 1nho s ILE 61 N 0.23 4.60 -0.66 0.00 1.01 1.37 -3.34 121.20 124.42 1nho s ILE 61 Ca 0.45 -2.19 -0.10 0.00 0.00 0.00 0.00 60.65 58.81 1nho s ILE 61 Cb -0.22 -5.02 -0.20 0.00 0.01 0.00 0.00 42.46 37.03 1nho s ILE 61 CO 0.27 -1.79 1.81 0.59 0.00 0.00 0.00 174.94 175.82 1nho n ASN 62 N 6.95 -0.98 0.00 3.58 3.02 -1.26 0.82 115.26 127.39 1nho n ASN 62 Ca 0.40 -1.12 0.00 0.00 -0.03 0.00 0.00 54.58 53.83 1nho n ASN 62 Cb 0.45 -0.80 0.00 0.00 -0.61 0.00 0.00 39.78 38.81 1nho n ASN 62 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1nho n GLY 63 N 5.40 1.47 1.46 7.41 0.00 -1.26 -4.51 105.19 115.16 1nho n GLY 63 Ca 0.41 -0.09 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 0.63 0.00 1.61 0.24 0.24 -4.92 118.33 116.13 1nho n VAL 64 Ca 0.00 0.21 0.00 0.00 -2.04 0.00 0.00 64.34 62.51 1nho n VAL 64 Cb 0.00 -1.06 0.00 0.00 -1.47 0.00 0.00 33.84 31.31 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 -3.40 0.00 -3.79 3.34 0.31 -1.13 -4.93 118.33 108.73 1nho n VAL 65 Ca 0.00 0.00 -0.10 0.00 -0.01 0.00 0.00 64.34 64.23 1nho n VAL 65 Cb 0.00 0.00 -0.05 0.00 -0.91 0.00 0.00 33.84 32.88 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 1.36 1.28 0.33 5.55 3.52 -1.26 0.41 118.95 130.15 1nho s ARG 66 Ca 0.00 -0.93 0.00 0.00 -0.13 0.00 0.00 55.73 54.68 1nho s ARG 66 Cb 0.00 0.48 -0.01 0.00 -1.56 0.00 0.00 34.95 33.86 1nho s ARG 66 CO 0.00 -0.52 0.40 -0.59 -0.81 0.00 0.00 175.30 173.78 1nho s PHE 67 N -3.89 1.26 -0.22 5.12 -0.71 0.11 -4.66 117.98 114.99 1nho s PHE 67 Ca 0.10 -1.40 -0.21 0.00 -1.04 0.00 0.00 56.93 54.39 1nho s PHE 67 Cb 0.00 -0.28 -0.02 0.00 -1.21 0.00 0.00 43.02 41.51 1nho s PHE 67 CO -0.03 -1.04 0.63 0.08 -1.34 0.00 0.00 175.22 173.52 1nho s VAL 68 N -3.23 5.01 -0.29 -2.49 1.01 -1.26 -2.14 120.40 117.00 1nho s VAL 68 Ca 0.34 1.16 0.04 0.00 0.00 0.00 0.00 61.98 63.51 1nho s VAL 68 Cb 0.01 -3.94 0.20 0.00 0.00 0.00 0.00 36.38 32.65 1nho s VAL 68 CO 0.22 0.08 0.62 -0.83 0.00 0.00 0.00 175.10 175.19 1nho s GLY 69 N 1.31 -1.19 0.00 4.51 0.00 0.80 -4.86 107.32 107.89 1nho s GLY 69 Ca 0.27 1.27 0.00 0.00 0.00 0.00 0.00 44.72 46.27 1nho s GLY 69 CO 0.09 3.66 0.00 0.00 0.00 0.00 0.00 173.10 176.86 1nho n ALA 70 N 5.41 0.00 1.21 3.20 0.00 -1.16 -2.55 120.51 126.62 1nho n ALA 70 Ca 0.04 0.00 0.01 0.00 0.00 0.00 0.00 53.44 53.49 1nho n ALA 70 Cb 0.54 0.00 0.05 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 -0.62 1.37 -3.00 0.00 -0.04 -1.26 -4.41 135.00 127.04 1nho n PRO 71 Ca 0.00 -0.38 -0.43 0.00 -0.04 0.00 0.00 63.50 62.66 1nho n PRO 71 Cb 0.00 -1.35 0.01 0.00 -0.04 0.00 0.00 33.50 32.12 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 -0.06 6.42 0.01 3.54 3.41 -1.26 -4.76 113.62 120.93 1nho n SER 72 Ca 0.03 -3.42 -0.19 0.00 -0.26 0.00 0.00 58.87 55.03 1nho n SER 72 Cb 0.23 -1.26 -0.09 0.00 -0.26 0.00 0.00 64.21 62.83 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 5.40 0.72 -1.15 4.33 0.11 -1.86 -3.09 114.38 118.84 1nho h ARG 73 Ca 0.20 -0.69 0.34 0.00 0.10 0.00 0.00 59.98 59.93 1nho h ARG 73 Cb 0.61 0.18 -0.11 0.00 1.11 0.00 0.00 29.97 31.75 1nho h ARG 73 CO 1.33 1.28 0.73 1.49 0.10 0.00 0.00 179.97 184.91 1nho h GLU 74 N 0.41 0.26 -0.94 0.08 4.57 -1.88 0.96 114.58 118.03 1nho h GLU 74 Ca -0.09 -0.02 0.23 0.00 -1.18 0.00 0.00 59.36 58.30 1nho h GLU 74 Cb 1.54 -0.06 -0.12 0.00 -0.16 0.00 0.00 28.75 29.95 1nho h GLU 74 CO 0.18 0.17 0.48 0.93 -1.18 0.00 0.00 179.01 179.58 1nho h GLU 75 N 0.26 0.47 -1.00 1.92 4.39 -1.93 1.05 114.58 119.74 1nho h GLU 75 Ca 0.69 -0.03 0.08 0.00 0.34 0.00 0.00 59.36 60.44 1nho h GLU 75 Cb 1.94 -0.11 -0.07 0.00 -0.10 0.00 0.00 28.75 30.41 1nho h GLU 75 CO -0.36 0.31 0.64 -0.07 -1.16 0.00 0.00 179.01 178.38 1nho h LEU 76 N 0.49 1.02 -0.73 1.33 4.07 0.80 0.56 115.31 122.85 1nho h LEU 76 Ca 0.59 0.02 -0.00 0.00 0.08 0.00 0.00 57.88 58.56 1nho h LEU 76 Cb 1.10 -0.20 -0.04 0.00 1.08 0.00 0.00 40.66 42.61 1nho h LEU 76 CO -0.50 0.63 0.45 0.15 -1.08 0.00 0.00 178.44 178.09 1nho h PHE 77 N 1.14 0.95 0.00 1.13 3.57 0.11 -0.08 116.94 123.76 1nho h PHE 77 Ca 0.45 0.00 -0.05 0.00 3.53 0.00 0.00 57.97 61.90 1nho h PHE 77 Cb 0.23 -0.31 -0.01 0.00 2.79 0.00 0.00 35.95 38.65 1nho h PHE 77 CO -0.00 0.63 -0.25 1.49 -2.23 0.00 0.00 178.31 177.95 1nho h GLU 78 N 0.99 0.00 0.20 1.11 4.81 -0.53 -3.19 114.58 117.97 1nho h GLU 78 Ca 0.26 0.00 -0.32 0.00 -0.13 0.00 0.00 59.36 59.17 1nho h GLU 78 Cb -0.05 0.00 0.03 0.00 0.63 0.00 0.00 28.75 29.36 1nho h GLU 78 CO -0.05 0.25 -1.39 0.00 -0.73 0.00 0.00 179.01 177.08 1nho h ALA 79 N 1.75 -0.09 -0.13 2.92 0.00 0.93 -1.18 119.26 123.46 1nho h ALA 79 Ca -0.00 -0.83 -0.07 0.00 0.00 0.00 0.00 54.91 54.00 1nho h ALA 79 Cb 1.09 0.14 -0.01 0.00 0.00 0.00 0.00 17.79 19.01 1nho h ALA 79 CO 0.03 0.71 -0.24 0.82 0.00 0.00 0.00 179.25 180.58 1nho h ILE 80 N 0.19 1.23 0.00 0.00 5.03 -1.12 0.81 117.51 123.64 1nho h ILE 80 Ca -0.23 -1.06 -0.18 0.00 -0.12 0.00 0.00 64.86 63.27 1nho h ILE 80 Cb 2.08 1.39 -0.03 0.00 -3.03 0.00 0.00 36.82 37.23 1nho h ILE 80 CO 0.26 0.32 -0.83 -1.13 -0.68 0.00 0.00 178.15 176.09 1nho h ASN 81 N 0.21 0.00 0.23 1.72 -1.24 -1.58 -2.14 115.58 112.79 1nho h ASN 81 Ca 0.04 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.05 1nho h ASN 81 Cb 0.54 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.59 1nho h ASN 81 CO 0.04 0.83 -0.48 -0.67 -1.29 0.00 0.00 177.43 175.86 1nho n ASP 82 N -3.41 1.04 0.02 1.15 -0.08 -0.45 -0.44 116.55 114.38 1nho n ASP 82 Ca 0.00 -0.83 -0.10 0.00 -1.51 0.00 0.00 54.79 52.36 1nho n ASP 82 Cb 0.84 0.36 -0.07 0.00 2.34 0.00 0.00 41.12 44.59 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 0.88 -0.15 0.00 -0.67 4.57 0.72 -3.11 114.58 116.80 1nho h GLU 83 Ca 0.00 0.01 -0.04 0.00 -1.18 0.00 0.00 59.36 58.15 1nho h GLU 83 Cb 0.55 0.03 -0.01 0.00 -0.16 0.00 0.00 28.75 29.17 1nho h GLU 83 CO 0.00 0.30 -0.18 1.98 -1.18 0.00 0.00 179.01 179.93 1nho h MET 84 N -0.91 0.00 0.00 1.92 4.05 -1.43 -3.44 114.93 115.12 1nho h MET 84 Ca -0.02 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.40 1nho h MET 84 Cb 0.52 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.32 1nho h MET 84 CO 0.03 0.18 0.00 -1.91 0.23 0.00 0.00 176.91 175.44