#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1h92 s SER 2 N 0.00 4.29 0.60 1.61 0.01 -1.26 -4.90 113.70 114.05 1h92 s SER 2 Ca 0.00 -3.74 0.39 0.00 1.31 0.00 0.00 55.95 53.91 1h92 s SER 2 Cb 0.00 -1.45 2.13 0.00 0.21 0.00 0.00 66.02 66.92 1h92 s SER 2 CO 0.00 -0.10 2.20 1.55 0.41 0.00 0.00 173.24 177.31 1h92 h PRO 3 N 5.42 0.00 -0.91 12.44 0.13 -2.08 -2.09 132.00 144.92 1h92 h PRO 3 Ca 0.17 0.00 0.10 0.00 -0.87 0.00 0.00 66.00 65.39 1h92 h PRO 3 Cb 0.78 0.00 -0.07 0.00 0.13 0.00 0.00 31.00 31.84 1h92 h PRO 3 CO 0.66 0.00 0.59 1.25 -0.23 0.00 0.00 178.00 180.27 1h92 h LEU 4 N 0.00 0.83 -1.53 1.56 5.85 -2.01 -0.33 115.31 119.68 1h92 h LEU 4 Ca 0.00 0.02 -0.03 0.00 0.84 0.00 0.00 57.88 58.72 1h92 h LEU 4 Cb 0.05 -0.15 -0.01 0.00 0.37 0.00 0.00 40.66 40.91 1h92 h LEU 4 CO 0.00 0.49 0.04 1.56 -0.34 0.00 0.00 178.44 180.18 1h92 h GLN 5 N 0.92 0.34 0.00 1.25 4.20 -1.79 -1.59 115.11 118.44 1h92 h GLN 5 Ca 0.42 -0.05 -0.01 0.00 0.06 0.00 0.00 58.65 59.07 1h92 h GLN 5 Cb 0.39 -0.06 -0.00 0.00 0.30 0.00 0.00 27.48 28.11 1h92 h GLN 5 CO -0.18 0.34 -0.05 -0.44 -0.67 0.00 0.00 178.83 177.83 1h92 h ASP 6 N 0.34 0.00 0.39 1.46 3.32 -1.21 -0.16 116.42 120.56 1h92 h ASP 6 Ca 0.08 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.13 1h92 h ASP 6 Cb 0.17 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.72 1h92 h ASP 6 CO -0.00 0.05 -0.21 0.59 -1.72 0.00 0.00 179.24 177.95 1h92 n ASN 7 N -3.90 0.62 -4.80 6.45 5.03 -0.60 -4.85 115.26 113.21 1h92 n ASN 7 Ca -0.03 -0.55 -0.35 0.00 0.87 0.00 0.00 54.58 54.53 1h92 n ASN 7 Cb 0.14 0.01 -0.06 0.00 -1.02 0.00 0.00 39.78 38.85 1h92 n ASN 7 CO 0.00 0.00 0.00 -0.76 -1.83 0.00 0.00 177.26 174.67 1h92 s LEU 8 N -2.60 4.14 0.29 3.41 1.43 -0.07 -0.32 118.68 124.96 1h92 s LEU 8 Ca 0.23 1.82 -0.14 0.00 -1.03 0.00 0.00 54.13 55.01 1h92 s LEU 8 Cb 0.19 -4.26 0.01 0.00 0.03 0.00 0.00 46.19 42.16 1h92 s LEU 8 CO 0.53 -0.27 0.58 0.68 0.23 0.00 0.00 176.35 178.10 1h92 s VAL 9 N -1.85 0.00 -0.03 -1.59 -7.23 -0.16 -4.21 120.40 105.33 1h92 s VAL 9 Ca 0.56 -1.28 0.04 0.00 -1.81 0.00 0.00 61.98 59.50 1h92 s VAL 9 Cb -0.15 -2.33 -0.03 0.00 0.56 0.00 0.00 36.38 34.43 1h92 s VAL 9 CO 0.20 0.00 -0.13 -0.63 -0.31 0.00 0.00 175.10 174.23 1h92 s ILE 10 N -3.57 3.16 -0.43 -0.62 1.01 -1.26 -1.06 121.20 118.43 1h92 s ILE 10 Ca 0.20 -0.79 -0.29 0.00 0.00 0.00 0.00 60.65 59.77 1h92 s ILE 10 Cb -0.03 -2.28 0.03 0.00 0.01 0.00 0.00 42.46 40.19 1h92 s ILE 10 CO 0.11 0.52 1.10 0.00 0.00 0.00 0.00 174.94 176.67 1h92 s ALA 11 N -0.81 3.26 0.37 9.38 0.00 0.16 -3.94 121.76 130.18 1h92 s ALA 11 Ca 0.13 -0.38 0.18 0.00 0.00 0.00 0.00 51.96 51.89 1h92 s ALA 11 Cb -0.11 -3.81 1.00 0.00 0.00 0.00 0.00 23.12 20.21 1h92 s ALA 11 CO 0.02 -2.02 1.93 1.25 0.00 0.00 0.00 175.76 176.94 1h92 h LEU 12 N 10.85 0.00 -7.52 0.00 5.85 -0.85 1.29 115.31 124.92 1h92 h LEU 12 Ca -0.22 0.00 -0.09 0.00 0.84 0.00 0.00 57.88 58.41 1h92 h LEU 12 Cb 1.06 0.00 -0.16 0.00 0.37 0.00 0.00 40.66 41.93 1h92 h LEU 12 CO 1.09 0.25 -0.21 -1.00 -0.34 0.00 0.00 178.44 178.24 1h92 s HIS 13 N -4.21 -0.13 0.42 1.25 3.76 -1.25 -4.61 115.29 110.52 1h92 s HIS 13 Ca -0.03 -0.02 -0.25 0.00 -0.15 0.00 0.00 55.06 54.61 1h92 s HIS 13 Cb 0.14 0.13 -0.08 0.00 1.11 0.00 0.00 32.58 33.88 1h92 s HIS 13 CO 0.67 -0.54 1.22 -1.54 -0.85 0.00 0.00 174.74 173.70 1h92 s SER 14 N -2.18 6.29 0.23 1.40 1.04 -1.26 -4.33 113.70 114.89 1h92 s SER 14 Ca -0.04 2.46 -0.03 0.00 0.48 0.00 0.00 55.95 58.82 1h92 s SER 14 Cb -0.00 -2.62 -0.05 0.00 0.10 0.00 0.00 66.02 63.45 1h92 s SER 14 CO -0.05 -0.85 0.46 -0.47 0.98 0.00 0.00 173.24 173.32 1h92 s TYR 15 N -1.38 3.48 -0.89 5.02 5.04 -0.53 -4.93 117.35 123.15 1h92 s TYR 15 Ca 0.59 0.52 -0.01 0.00 -2.44 0.00 0.00 57.07 55.74 1h92 s TYR 15 Cb -0.33 -2.00 0.23 0.00 0.35 0.00 0.00 41.96 40.21 1h92 s TYR 15 CO 0.42 0.30 0.86 -1.91 -1.34 0.00 0.00 175.55 173.87 1h92 n GLU 16 N -0.64 2.84 -1.50 4.97 4.07 -1.26 -4.39 120.64 124.72 1h92 n GLU 16 Ca -0.03 -4.51 -0.39 0.00 -0.06 0.00 0.00 57.16 52.17 1h92 n GLU 16 Cb 0.53 -2.41 -0.15 0.00 -0.06 0.00 0.00 31.44 29.36 1h92 n GLU 16 CO 0.00 0.00 0.00 -0.35 -0.06 0.00 0.00 177.13 176.72 1h92 n PRO 17 N 2.02 0.08 -0.04 5.31 -0.04 -1.26 -4.69 135.00 136.37 1h92 n PRO 17 Ca 0.23 -0.01 0.02 0.00 -0.04 0.00 0.00 63.50 63.71 1h92 n PRO 17 Cb 0.37 -1.60 0.10 0.00 -0.04 0.00 0.00 33.50 32.32 1h92 n PRO 17 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 1h92 n SER 18 N 10.47 0.45 -3.92 3.54 3.41 -1.26 -4.84 113.62 121.49 1h92 n SER 18 Ca 0.64 -1.94 -0.09 0.00 -0.26 0.00 0.00 58.87 57.22 1h92 n SER 18 Cb 0.08 -0.05 -0.07 0.00 -0.26 0.00 0.00 64.21 63.91 1h92 n SER 18 CO 0.00 0.00 0.00 -1.00 -0.16 0.00 0.00 175.04 173.88 1h92 s HIS 19 N -1.89 0.30 -0.26 7.33 3.76 -1.26 -5.12 115.29 118.15 1h92 s HIS 19 Ca 0.09 -0.67 -0.28 0.00 -0.15 0.00 0.00 55.06 54.04 1h92 s HIS 19 Cb 0.04 -0.01 0.01 0.00 1.11 0.00 0.00 32.58 33.73 1h92 s HIS 19 CO 0.06 -0.71 1.01 -0.51 -0.85 0.00 0.00 174.74 173.75 1h92 s ASP 20 N -2.94 7.00 0.00 1.40 1.01 -1.26 -3.62 116.67 118.27 1h92 s ASP 20 Ca 0.14 1.22 0.00 0.00 0.71 0.00 0.00 52.55 54.62 1h92 s ASP 20 Cb 0.03 -2.52 0.00 0.00 1.01 0.00 0.00 42.92 41.44 1h92 s ASP 20 CO -0.02 -0.70 0.00 0.61 0.21 0.00 0.00 175.17 175.26 1h92 n GLY 21 N 3.56 1.67 3.77 0.21 0.00 -1.26 -5.13 105.19 108.01 1h92 n GLY 21 Ca 0.11 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.90 1h92 n GLY 21 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1h92 s ASP 22 N -2.00 4.67 -0.30 1.61 1.01 -1.24 -3.90 116.67 116.53 1h92 s ASP 22 Ca 0.00 -0.90 -0.05 0.00 0.71 0.00 0.00 52.55 52.31 1h92 s ASP 22 Cb 0.00 -0.58 0.02 0.00 1.01 0.00 0.00 42.92 43.37 1h92 s ASP 22 CO 0.00 -0.50 0.06 -0.22 0.21 0.00 0.00 175.17 174.72 1h92 s LEU 23 N -3.95 3.85 -0.84 1.23 2.96 -1.10 -4.57 118.68 116.26 1h92 s LEU 23 Ca 0.42 -0.88 -0.03 0.00 -0.22 0.00 0.00 54.13 53.42 1h92 s LEU 23 Cb 0.00 -1.83 0.24 0.00 0.50 0.00 0.00 46.19 45.10 1h92 s LEU 23 CO 0.24 -0.22 2.22 0.61 -1.32 0.00 0.00 176.35 177.89 1h92 n GLY 24 N 4.80 5.31 3.21 7.98 0.00 -1.26 -4.64 105.19 120.59 1h92 n GLY 24 Ca -0.14 -2.30 -0.27 0.00 0.00 0.00 0.00 46.02 43.31 1h92 n GLY 24 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 1h92 n PHE 25 N 0.19 -2.18 -3.84 1.61 1.16 -1.26 -4.27 117.46 108.88 1h92 n PHE 25 Ca 0.52 -0.15 -0.25 0.00 -1.87 0.00 0.00 57.45 55.70 1h92 n PHE 25 Cb 0.32 -1.48 -0.01 0.00 -1.61 0.00 0.00 39.48 36.70 1h92 n PHE 25 CO 0.00 0.00 0.00 -1.21 -1.87 0.00 0.00 176.76 173.68 1h92 s GLU 26 N -3.91 2.28 0.32 3.97 2.02 -1.26 -1.46 118.70 120.66 1h92 s GLU 26 Ca 0.54 -1.95 -0.29 0.00 0.02 0.00 0.00 54.97 53.30 1h92 s GLU 26 Cb -0.12 -2.14 -0.10 0.00 0.10 0.00 0.00 34.13 31.87 1h92 s GLU 26 CO 0.54 -0.56 1.31 0.21 0.02 0.00 0.00 175.26 176.79 1h92 s LYS 27 N -4.26 4.35 0.00 1.61 2.20 -1.26 -2.13 119.74 120.26 1h92 s LYS 27 Ca 0.37 2.21 0.00 0.00 -0.36 0.00 0.00 55.97 58.19 1h92 s LYS 27 Cb -0.02 -3.08 0.00 0.00 -1.51 0.00 0.00 37.83 33.22 1h92 s LYS 27 CO 0.22 -0.20 0.00 0.41 -0.36 0.00 0.00 175.35 175.43 1h92 n GLY 28 N 0.91 2.45 3.69 5.54 0.00 0.44 -4.94 105.19 113.29 1h92 n GLY 28 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 1h92 n GLY 28 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1h92 s GLU 29 N -0.35 4.23 0.18 1.61 2.02 -0.91 -4.52 118.70 120.97 1h92 s GLU 29 Ca 0.00 2.22 -0.30 0.00 0.02 0.00 0.00 54.97 56.91 1h92 s GLU 29 Cb 0.00 -3.50 -0.07 0.00 0.10 0.00 0.00 34.13 30.65 1h92 s GLU 29 CO 0.00 -0.65 0.96 -1.14 0.02 0.00 0.00 175.26 174.45 1h92 s GLN 30 N 2.25 4.77 0.07 1.61 0.74 -1.26 -0.67 119.66 127.17 1h92 s GLN 30 Ca 0.70 1.49 0.01 0.00 0.05 0.00 0.00 55.36 57.61 1h92 s GLN 30 Cb -0.38 -3.32 -0.04 0.00 1.10 0.00 0.00 33.01 30.37 1h92 s GLN 30 CO 0.30 0.35 -0.06 -0.51 -0.55 0.00 0.00 175.29 174.83 1h92 s LEU 31 N -0.60 2.43 -0.16 3.68 1.02 -0.22 -4.17 118.68 120.65 1h92 s LEU 31 Ca 0.44 -0.86 -0.05 0.00 0.02 0.00 0.00 54.13 53.68 1h92 s LEU 31 Cb -0.25 -0.03 -0.03 0.00 0.02 0.00 0.00 46.19 45.89 1h92 s LEU 31 CO 0.31 -0.42 0.01 -0.60 0.02 0.00 0.00 176.35 175.68 1h92 s ARG 32 N -3.16 3.70 -0.79 1.70 3.52 0.27 -0.98 118.95 123.20 1h92 s ARG 32 Ca 0.04 -0.42 -0.19 0.00 -0.13 0.00 0.00 55.73 55.03 1h92 s ARG 32 Cb 0.01 -3.03 0.12 0.00 -1.56 0.00 0.00 34.95 30.49 1h92 s ARG 32 CO -0.04 0.34 0.99 0.42 -0.81 0.00 0.00 175.30 176.19 1h92 s ILE 33 N 0.15 4.70 0.10 4.11 1.01 0.57 -0.46 121.20 131.37 1h92 s ILE 33 Ca 0.02 -1.22 0.01 0.00 0.00 0.00 0.00 60.65 59.45 1h92 s ILE 33 Cb -0.13 -4.68 -0.25 0.00 0.01 0.00 0.00 42.46 37.41 1h92 s ILE 33 CO 0.02 -1.39 1.21 -0.07 0.00 0.00 0.00 174.94 174.70 1h92 h LEU 34 N 10.39 0.23 -8.04 2.97 4.07 -1.22 -3.45 115.31 120.26 1h92 h LEU 34 Ca -0.04 -0.25 -0.46 0.00 0.08 0.00 0.00 57.88 57.21 1h92 h LEU 34 Cb 1.05 -0.08 -0.31 0.00 1.08 0.00 0.00 40.66 42.40 1h92 h LEU 34 CO 1.10 1.19 -0.80 -0.70 -1.08 0.00 0.00 178.44 178.15 1h92 s GLU 35 N -2.70 1.19 -0.42 1.13 2.12 -0.30 -4.94 118.70 114.77 1h92 s GLU 35 Ca -0.02 -0.38 0.10 0.00 0.36 0.00 0.00 54.97 55.04 1h92 s GLU 35 Cb 0.08 -1.08 0.39 0.00 0.26 0.00 0.00 34.13 33.79 1h92 s GLU 35 CO 0.85 0.14 0.91 0.94 -0.54 0.00 0.00 175.26 177.56 1h92 n GLN 36 N 3.28 2.02 -4.78 4.30 7.27 -1.26 -1.25 117.38 126.95 1h92 n GLN 36 Ca -0.18 -3.92 -0.29 0.00 0.07 0.00 0.00 57.00 52.67 1h92 n GLN 36 Cb 0.54 -1.82 -0.14 0.00 2.41 0.00 0.00 30.24 31.22 1h92 n GLN 36 CO 0.00 0.00 0.00 -1.12 0.07 0.00 0.00 177.06 176.01 1h92 s SER 37 N -3.06 3.10 0.21 1.69 0.01 -1.26 -5.03 113.70 109.36 1h92 s SER 37 Ca 0.40 -0.61 0.00 0.00 1.31 0.00 0.00 55.95 57.05 1h92 s SER 37 Cb 0.37 -0.26 0.00 0.00 0.21 0.00 0.00 66.02 66.33 1h92 s SER 37 CO -0.09 0.23 0.00 0.61 0.41 0.00 0.00 173.24 174.41 1h92 n GLY 38 N 1.63 -1.94 0.15 3.44 0.00 -1.26 -4.15 105.19 103.06 1h92 n GLY 38 Ca -0.17 -1.35 -0.02 0.00 0.00 0.00 0.00 46.02 44.48 1h92 n GLY 38 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1h92 h GLU 39 N 0.00 0.06 -5.83 1.61 5.08 -2.01 -3.43 114.58 110.06 1h92 h GLU 39 Ca 0.00 -0.04 -0.64 0.00 -1.00 0.00 0.00 59.36 57.69 1h92 h GLU 39 Cb 0.19 0.01 -0.05 0.00 0.50 0.00 0.00 28.75 29.39 1h92 h GLU 39 CO 0.00 0.63 -0.47 -1.58 -1.00 0.00 0.00 179.01 176.60 1h92 s TRP 40 N -3.70 3.56 0.22 4.33 0.52 -1.26 -3.97 118.94 118.63 1h92 s TRP 40 Ca -0.02 0.41 0.11 0.00 0.02 0.00 0.00 56.10 56.62 1h92 s TRP 40 Cb 0.13 -1.87 -0.05 0.00 -1.15 0.00 0.00 33.47 30.53 1h92 s TRP 40 CO 0.77 0.64 -0.21 -1.58 0.02 0.00 0.00 176.95 176.59 1h92 s TRP 41 N -1.32 2.18 -0.12 -1.98 0.51 -0.83 -4.23 118.94 113.15 1h92 s TRP 41 Ca 0.27 -0.38 -0.06 0.00 -2.12 0.00 0.00 56.10 53.81 1h92 s TRP 41 Cb -0.13 -1.02 -0.04 0.00 -0.81 0.00 0.00 33.47 31.47 1h92 s TRP 41 CO 0.18 0.55 0.11 0.21 -0.51 0.00 0.00 176.95 177.49 1h92 s LYS 42 N -3.09 3.45 0.34 4.98 2.20 -0.38 -1.13 119.74 126.11 1h92 s LYS 42 Ca 0.24 -0.20 -0.05 0.00 -0.36 0.00 0.00 55.97 55.60 1h92 s LYS 42 Cb -0.06 -3.14 0.01 0.00 -1.51 0.00 0.00 37.83 33.13 1h92 s LYS 42 CO 0.11 0.70 0.51 0.00 -0.36 0.00 0.00 175.35 176.32 1h92 s ALA 43 N -0.82 0.46 0.02 3.13 0.00 -0.86 -0.68 121.76 123.00 1h92 s ALA 43 Ca 0.14 -1.35 -0.00 0.00 0.00 0.00 0.00 51.96 50.75 1h92 s ALA 43 Cb -0.12 1.09 -0.02 0.00 0.00 0.00 0.00 23.12 24.07 1h92 s ALA 43 CO 0.03 -0.82 -0.02 -1.14 0.00 0.00 0.00 175.76 173.81 1h92 s GLN 44 N -3.08 0.27 -0.40 0.00 0.74 0.39 -1.18 119.66 116.39 1h92 s GLN 44 Ca 0.28 -0.51 -0.17 0.00 0.05 0.00 0.00 55.36 55.01 1h92 s GLN 44 Cb -0.01 0.10 0.01 0.00 1.10 0.00 0.00 33.01 34.21 1h92 s GLN 44 CO 0.18 -0.04 0.44 0.45 -0.55 0.00 0.00 175.29 175.76 1h92 s SER 45 N -1.23 6.21 0.00 6.67 0.15 0.17 0.98 113.70 126.64 1h92 s SER 45 Ca -0.13 -0.54 0.17 0.00 0.70 0.00 0.00 55.95 56.15 1h92 s SER 45 Cb -0.08 -2.23 0.96 0.00 -1.71 0.00 0.00 66.02 62.96 1h92 s SER 45 CO -0.01 -0.54 1.48 0.18 1.20 0.00 0.00 173.24 175.56 1h92 n LEU 46 N 5.60 0.00 0.03 3.45 4.77 -1.26 -0.08 117.00 129.51 1h92 n LEU 46 Ca -0.07 0.14 -0.11 0.00 -0.03 0.00 0.00 56.01 55.94 1h92 n LEU 46 Cb 0.48 -0.14 -0.14 0.00 -2.33 0.00 0.00 43.42 41.29 1h92 n LEU 46 CO 0.45 -0.06 -0.30 0.71 -1.33 0.00 0.00 177.39 176.86 1h92 h THR 47 N 0.00 1.17 0.00 -5.08 1.35 -1.91 -3.37 112.91 105.06 1h92 h THR 47 Ca 0.00 -2.91 0.00 0.00 -0.55 0.00 0.00 66.41 62.95 1h92 h THR 47 Cb 0.08 2.65 0.00 0.00 -1.73 0.00 0.00 68.15 69.15 1h92 h THR 47 CO 0.00 0.75 0.00 0.35 -0.25 0.00 0.00 175.52 176.37 1h92 n THR 48 N -3.28 0.00 -2.98 6.82 -2.24 -1.07 -5.02 114.28 106.52 1h92 n THR 48 Ca -0.13 -0.48 -0.12 0.00 -2.27 0.00 0.00 64.05 61.05 1h92 n THR 48 Cb 1.02 1.03 0.06 0.00 -2.10 0.00 0.00 70.33 70.33 1h92 n THR 48 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1h92 n GLY 49 N 0.36 -0.07 3.25 3.38 0.00 0.89 -5.03 105.19 107.97 1h92 n GLY 49 Ca 0.00 -0.10 -0.18 0.00 0.00 0.00 0.00 46.02 45.75 1h92 n GLY 49 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1h92 s GLN 50 N -5.07 1.05 0.29 1.61 -0.21 -1.11 -4.95 119.66 111.27 1h92 s GLN 50 Ca 0.07 -1.29 0.11 0.00 0.02 0.00 0.00 55.36 54.28 1h92 s GLN 50 Cb -0.03 -0.89 -0.05 0.00 1.00 0.00 0.00 33.01 33.04 1h92 s GLN 50 CO 0.47 0.16 -0.17 -1.21 -2.12 0.00 0.00 175.29 172.42 1h92 s GLU 51 N -2.87 1.74 0.00 2.91 2.02 -1.26 0.43 118.70 121.67 1h92 s GLU 51 Ca 0.11 -1.77 0.00 0.00 0.02 0.00 0.00 54.97 53.32 1h92 s GLU 51 Cb -0.04 -1.78 0.00 0.00 0.10 0.00 0.00 34.13 32.41 1h92 s GLU 51 CO 0.03 0.30 0.00 0.41 0.02 0.00 0.00 175.26 176.02 1h92 n GLY 52 N -0.66 0.96 3.26 -1.39 0.00 -0.33 -4.72 105.19 102.30 1h92 n GLY 52 Ca -0.05 -0.53 -0.31 0.00 0.00 0.00 0.00 46.02 45.14 1h92 n GLY 52 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1h92 s PHE 53 N -1.83 2.32 0.07 1.61 0.08 -1.25 -2.03 117.98 116.95 1h92 s PHE 53 Ca 0.00 -0.65 0.05 0.00 0.12 0.00 0.00 56.93 56.45 1h92 s PHE 53 Cb 0.00 -1.52 -0.03 0.00 -0.57 0.00 0.00 43.02 40.90 1h92 s PHE 53 CO 0.00 -0.18 -0.14 0.96 -0.10 0.00 0.00 175.22 175.76 1h92 s ILE 54 N -0.21 1.08 0.32 0.64 -4.36 -0.28 -2.70 121.20 115.68 1h92 s ILE 54 Ca -0.01 -1.27 -0.27 0.00 -0.26 0.00 0.00 60.65 58.83 1h92 s ILE 54 Cb -0.13 -1.04 -0.09 0.00 1.25 0.00 0.00 42.46 42.44 1h92 s ILE 54 CO 0.03 -0.22 0.99 -2.16 0.24 0.00 0.00 174.94 173.82 1h92 s PRO 55 N -1.69 4.56 0.00 0.37 0.04 -1.26 -1.97 135.00 135.04 1h92 s PRO 55 Ca -0.02 1.47 0.10 0.00 0.04 0.00 0.00 61.00 62.59 1h92 s PRO 55 Cb -0.10 -2.90 0.45 0.00 0.04 0.00 0.00 34.50 31.99 1h92 s PRO 55 CO 0.02 0.23 1.30 1.97 0.04 0.00 0.00 177.00 180.55 1h92 n PHE 56 N 0.70 0.00 0.02 0.56 -1.74 -1.25 -2.32 117.46 113.43 1h92 n PHE 56 Ca 0.01 0.00 -0.01 0.00 -0.56 0.00 0.00 57.45 56.89 1h92 n PHE 56 Cb 0.49 -0.45 -0.09 0.00 1.52 0.00 0.00 39.48 40.95 1h92 n PHE 56 CO 0.00 0.00 0.00 -1.71 -0.56 0.00 0.00 176.76 174.49 1h92 n ASN 57 N -1.45 0.81 -0.26 5.98 2.85 -1.26 -3.85 115.26 118.07 1h92 n ASN 57 Ca 0.03 0.36 0.07 0.00 -0.11 0.00 0.00 54.58 54.92 1h92 n ASN 57 Cb 0.11 0.22 0.30 0.00 1.24 0.00 0.00 39.78 41.65 1h92 n ASN 57 CO 0.00 0.00 0.00 0.49 -2.11 0.00 0.00 177.26 175.64 1h92 n PHE 58 N -2.88 0.14 -4.06 1.20 3.01 -0.98 -4.83 117.46 109.06 1h92 n PHE 58 Ca -0.11 -0.07 -0.10 0.00 1.01 0.00 0.00 57.45 58.18 1h92 n PHE 58 Cb 0.86 0.00 -0.07 0.00 -0.01 0.00 0.00 39.48 40.26 1h92 n PHE 58 CO 0.00 0.00 0.00 0.08 1.01 0.00 0.00 176.76 177.85 1h92 s VAL 59 N -1.86 0.01 0.23 -4.37 1.01 -1.25 -0.13 120.40 114.04 1h92 s VAL 59 Ca 0.22 -1.59 -0.21 0.00 0.00 0.00 0.00 61.98 60.40 1h92 s VAL 59 Cb 0.11 -2.23 0.04 0.00 0.00 0.00 0.00 36.38 34.30 1h92 s VAL 59 CO 0.17 -0.06 0.64 0.00 0.00 0.00 0.00 175.10 175.85 1h92 s ALA 60 N -4.05 -1.26 -0.15 5.51 0.00 -1.25 -4.91 121.76 115.65 1h92 s ALA 60 Ca 0.27 -0.07 -0.29 0.00 0.00 0.00 0.00 51.96 51.87 1h92 s ALA 60 Cb 0.02 0.87 -0.01 0.00 0.00 0.00 0.00 23.12 24.00 1h92 s ALA 60 CO 0.08 -0.91 1.19 0.15 0.00 0.00 0.00 175.76 176.27 1h92 s LYS 61 N -3.86 4.27 0.44 0.00 1.02 -1.26 -4.19 119.74 116.16 1h92 s LYS 61 Ca 0.08 1.59 0.22 0.00 0.02 0.00 0.00 55.97 57.87 1h92 s LYS 61 Cb -0.03 -3.69 1.19 0.00 -0.52 0.00 0.00 37.83 34.78 1h92 s LYS 61 CO -0.01 -0.62 1.82 0.00 -0.92 0.00 0.00 175.35 175.63 1h92 h ALA 62 N 7.84 2.39 -0.03 5.17 0.00 -1.89 -3.50 119.26 129.24 1h92 h ALA 62 Ca -0.27 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.66 1h92 h ALA 62 Cb 1.11 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.92 1h92 h ALA 62 CO 0.95 -0.73 0.00 -1.71 0.00 0.00 0.00 179.25 177.76