#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1h92 n SER 2 N 0.00 2.73 -4.78 1.61 7.64 -1.26 -4.87 113.62 114.69 1h92 n SER 2 Ca 0.00 -3.22 -0.41 0.00 1.01 0.00 0.00 58.87 56.26 1h92 n SER 2 Cb 0.00 -0.67 0.00 0.00 -1.01 0.00 0.00 64.21 62.54 1h92 n SER 2 CO 0.00 0.00 0.00 -0.81 -3.01 0.00 0.00 175.04 171.22 1h92 n PRO 3 N 1.15 2.62 0.01 1.43 -0.04 -1.26 -4.82 135.00 134.09 1h92 n PRO 3 Ca 0.27 0.92 -0.02 0.00 -0.04 0.00 0.00 63.50 64.64 1h92 n PRO 3 Cb 0.43 -2.68 0.26 0.00 -0.04 0.00 0.00 33.50 31.47 1h92 n PRO 3 CO 0.00 0.00 0.00 1.25 -0.04 0.00 0.00 175.50 176.71 1h92 h LEU 4 N 2.84 0.48 -1.17 1.53 5.85 -1.99 -1.75 115.31 121.10 1h92 h LEU 4 Ca -0.51 -0.12 -0.00 0.00 0.84 0.00 0.00 57.88 58.09 1h92 h LEU 4 Cb 1.25 -0.13 -0.04 0.00 0.37 0.00 0.00 40.66 42.11 1h92 h LEU 4 CO 0.63 0.63 0.46 1.56 -0.34 0.00 0.00 178.44 181.39 1h92 h GLN 5 N 0.46 1.02 -2.04 1.25 4.20 -2.00 -3.35 115.11 114.66 1h92 h GLN 5 Ca 0.09 -0.09 -0.54 0.00 0.06 0.00 0.00 58.65 58.17 1h92 h GLN 5 Cb 0.49 -0.22 -0.36 0.00 0.30 0.00 0.00 27.48 27.69 1h92 h GLN 5 CO 0.03 0.72 -0.99 -3.47 -0.67 0.00 0.00 178.83 174.45 1h92 n ASP 6 N -4.39 -0.49 -4.58 1.46 2.03 -1.02 -5.09 116.55 104.47 1h92 n ASP 6 Ca 0.08 -2.57 -0.43 0.00 0.52 0.00 0.00 54.79 52.40 1h92 n ASP 6 Cb 0.06 -0.36 -0.05 0.00 -0.72 0.00 0.00 41.12 40.06 1h92 n ASP 6 CO 0.00 0.00 0.00 0.21 -1.92 0.00 0.00 177.20 175.49 1h92 s ASN 7 N -0.48 6.56 0.12 1.67 3.84 -0.69 -4.37 114.94 121.59 1h92 s ASN 7 Ca 0.34 0.32 0.07 0.00 0.21 0.00 0.00 52.86 53.80 1h92 s ASN 7 Cb 0.10 -2.42 -0.04 0.00 -0.55 0.00 0.00 41.25 38.33 1h92 s ASN 7 CO -0.16 -0.85 -0.09 -0.76 -2.79 0.00 0.00 177.10 172.45 1h92 s LEU 8 N 3.35 3.06 0.19 3.21 1.02 -1.26 -1.90 118.68 126.34 1h92 s LEU 8 Ca 0.34 -0.41 -0.07 0.00 0.02 0.00 0.00 54.13 54.01 1h92 s LEU 8 Cb -0.12 -1.83 -0.02 0.00 0.02 0.00 0.00 46.19 44.24 1h92 s LEU 8 CO 0.20 0.16 0.27 0.68 0.02 0.00 0.00 176.35 177.68 1h92 s VAL 9 N -1.31 0.04 -0.05 -1.59 -7.23 -0.02 -2.87 120.40 107.37 1h92 s VAL 9 Ca 0.22 -1.60 0.03 0.00 -1.81 0.00 0.00 61.98 58.82 1h92 s VAL 9 Cb -0.11 -2.13 -0.03 0.00 0.56 0.00 0.00 36.38 34.68 1h92 s VAL 9 CO 0.14 -0.16 -0.13 -0.63 -0.31 0.00 0.00 175.10 174.02 1h92 s ILE 10 N -4.04 3.19 -0.47 -0.62 1.01 -1.26 -0.96 121.20 118.04 1h92 s ILE 10 Ca 0.25 -0.68 -0.29 0.00 0.00 0.00 0.00 60.65 59.93 1h92 s ILE 10 Cb 0.04 -2.26 0.03 0.00 0.01 0.00 0.00 42.46 40.27 1h92 s ILE 10 CO 0.06 0.59 1.11 0.00 0.00 0.00 0.00 174.94 176.69 1h92 s ALA 11 N -0.75 3.17 0.29 9.38 0.00 -0.22 -3.50 121.76 130.12 1h92 s ALA 11 Ca 0.12 -0.51 0.30 0.00 0.00 0.00 0.00 51.96 51.87 1h92 s ALA 11 Cb -0.11 -3.86 1.38 0.00 0.00 0.00 0.00 23.12 20.53 1h92 s ALA 11 CO 0.01 -2.22 2.01 -0.07 0.00 0.00 0.00 175.76 175.49 1h92 h LEU 12 N 11.12 0.00 -7.12 0.00 3.38 0.23 1.82 115.31 124.74 1h92 h LEU 12 Ca -0.23 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.67 1h92 h LEU 12 Cb 1.06 0.00 -0.20 0.00 0.09 0.00 0.00 40.66 41.61 1h92 h LEU 12 CO 1.11 0.11 0.05 -1.00 0.09 0.00 0.00 178.44 178.81 1h92 s HIS 13 N -3.91 -0.59 0.54 1.13 3.76 -1.24 -4.60 115.29 110.37 1h92 s HIS 13 Ca -0.01 1.16 -0.22 0.00 -0.15 0.00 0.00 55.06 55.84 1h92 s HIS 13 Cb 0.11 0.30 -0.05 0.00 1.11 0.00 0.00 32.58 34.05 1h92 s HIS 13 CO 0.57 -0.48 1.34 -1.54 -0.85 0.00 0.00 174.74 173.78 1h92 s SER 14 N -0.72 5.35 0.26 1.40 1.04 -1.26 -4.52 113.70 115.26 1h92 s SER 14 Ca -0.08 2.72 -0.00 0.00 0.48 0.00 0.00 55.95 59.07 1h92 s SER 14 Cb -0.02 -2.63 -0.04 0.00 0.10 0.00 0.00 66.02 63.43 1h92 s SER 14 CO 0.06 -1.51 0.46 -0.47 0.98 0.00 0.00 173.24 172.76 1h92 s TYR 15 N -1.33 3.48 -0.79 5.02 5.04 -0.70 -4.91 117.35 123.17 1h92 s TYR 15 Ca 0.71 0.34 0.02 0.00 -2.44 0.00 0.00 57.07 55.70 1h92 s TYR 15 Cb -0.39 -1.87 0.24 0.00 0.35 0.00 0.00 41.96 40.29 1h92 s TYR 15 CO 0.47 0.27 0.86 0.39 -1.34 0.00 0.00 175.55 176.20 1h92 n GLU 16 N -1.15 2.82 -1.28 4.97 1.02 -1.26 -4.41 120.64 121.36 1h92 n GLU 16 Ca -0.05 -4.58 -0.60 0.00 -0.02 0.00 0.00 57.16 51.91 1h92 n GLU 16 Cb 0.55 -2.35 -0.12 0.00 -0.02 0.00 0.00 31.44 29.51 1h92 n GLU 16 CO 0.00 0.00 0.00 -0.35 1.18 0.00 0.00 177.13 177.96 1h92 n PRO 17 N 1.43 0.06 -0.11 3.49 -0.04 -1.26 -4.74 135.00 133.82 1h92 n PRO 17 Ca 0.26 0.02 0.06 0.00 -0.04 0.00 0.00 63.50 63.80 1h92 n PRO 17 Cb 0.38 -1.55 0.21 0.00 -0.04 0.00 0.00 33.50 32.50 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 7.50 1.38 -4.06 3.54 3.41 -1.26 -4.88 113.62 119.26 1h92 n SER 18 Ca 0.53 -1.89 -0.11 0.00 -0.26 0.00 0.00 58.87 57.15 1h92 n SER 18 Cb -0.03 -0.15 -0.08 0.00 -0.26 0.00 0.00 64.21 63.70 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 -1.70 0.82 -0.13 7.33 3.76 -1.26 -5.13 115.29 118.98 1h92 s HIS 19 Ca 0.22 -1.10 -0.23 0.00 -0.15 0.00 0.00 55.06 53.81 1h92 s HIS 19 Cb 0.12 -0.22 -0.03 0.00 1.11 0.00 0.00 32.58 33.56 1h92 s HIS 19 CO 0.16 -0.82 0.69 -0.51 -0.85 0.00 0.00 174.74 173.41 1h92 s ASP 20 N -3.11 6.87 0.00 1.40 1.01 -1.26 -3.79 116.67 117.80 1h92 s ASP 20 Ca 0.31 1.06 0.00 0.00 0.71 0.00 0.00 52.55 54.63 1h92 s ASP 20 Cb 0.03 -2.39 0.00 0.00 1.01 0.00 0.00 42.92 41.57 1h92 s ASP 20 CO 0.11 -0.21 0.00 0.61 0.21 0.00 0.00 175.17 175.90 1h92 n GLY 21 N 3.38 1.74 3.95 0.21 0.00 -1.26 -5.10 105.19 108.11 1h92 n GLY 21 Ca -0.01 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.76 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 -1.95 4.25 -0.14 1.61 1.01 -1.25 -4.03 116.67 116.18 1h92 s ASP 22 Ca 0.00 0.10 0.02 0.00 0.71 0.00 0.00 52.55 53.39 1h92 s ASP 22 Cb 0.00 -0.52 0.01 0.00 1.01 0.00 0.00 42.92 43.42 1h92 s ASP 22 CO 0.00 -1.95 -0.21 -0.22 0.21 0.00 0.00 175.17 173.00 1h92 s LEU 23 N -5.35 2.06 -0.89 1.23 2.96 -1.03 -4.54 118.68 113.12 1h92 s LEU 23 Ca 0.66 -0.59 0.00 0.00 -0.22 0.00 0.00 54.13 53.98 1h92 s LEU 23 Cb -0.07 -1.41 0.33 0.00 0.50 0.00 0.00 46.19 45.55 1h92 s LEU 23 CO 0.46 0.07 1.70 0.61 -1.32 0.00 0.00 176.35 177.86 1h92 n GLY 24 N 4.13 5.94 3.16 7.98 0.00 -1.26 -4.64 105.19 120.50 1h92 n GLY 24 Ca -0.20 -2.60 -0.35 0.00 0.00 0.00 0.00 46.02 42.87 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 -0.21 -1.45 -2.97 1.61 1.16 -1.26 -4.14 117.46 110.21 1h92 n PHE 25 Ca 0.45 0.35 -0.20 0.00 -1.87 0.00 0.00 57.45 56.18 1h92 n PHE 25 Cb 0.29 -1.49 0.06 0.00 -1.61 0.00 0.00 39.48 36.74 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 -2.85 2.28 -0.12 3.97 2.02 -1.26 -1.72 118.70 121.02 1h92 s GLU 26 Ca 0.48 -1.52 -0.29 0.00 0.02 0.00 0.00 54.97 53.65 1h92 s GLU 26 Cb -0.03 -2.62 -0.03 0.00 0.10 0.00 0.00 34.13 31.55 1h92 s GLU 26 CO 0.66 -0.88 1.44 0.21 0.02 0.00 0.00 175.26 176.72 1h92 s LYS 27 N -4.70 4.20 0.00 1.61 2.20 -1.26 -2.22 119.74 119.57 1h92 s LYS 27 Ca 0.62 1.89 0.00 0.00 -0.36 0.00 0.00 55.97 58.12 1h92 s LYS 27 Cb -0.06 -3.87 0.00 0.00 -1.51 0.00 0.00 37.83 32.39 1h92 s LYS 27 CO 0.39 -0.78 0.00 0.41 -0.36 0.00 0.00 175.35 175.01 1h92 n GLY 28 N 3.86 0.17 3.70 5.54 0.00 0.62 -4.91 105.19 114.17 1h92 n GLY 28 Ca 0.15 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.75 1h92 n GLY 28 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1h92 s GLU 29 N -0.99 4.37 0.30 1.61 2.12 -0.94 -4.50 118.70 120.66 1h92 s GLU 29 Ca 0.00 1.79 -0.28 0.00 0.36 0.00 0.00 54.97 56.84 1h92 s GLU 29 Cb 0.00 -3.46 -0.09 0.00 0.26 0.00 0.00 34.13 30.84 1h92 s GLU 29 CO 0.00 -0.39 0.96 -0.65 -0.54 0.00 0.00 175.26 174.64 1h92 s GLN 30 N 1.72 4.65 0.11 4.30 -0.21 -1.26 -1.06 119.66 127.91 1h92 s GLN 30 Ca 0.59 1.43 -0.02 0.00 0.02 0.00 0.00 55.36 57.38 1h92 s GLN 30 Cb -0.28 -2.97 -0.03 0.00 1.00 0.00 0.00 33.01 30.72 1h92 s GLN 30 CO 0.26 0.33 0.07 -0.51 -2.12 0.00 0.00 175.29 173.32 1h92 s LEU 31 N -1.75 1.81 -0.14 2.90 1.43 -0.14 -4.52 118.68 118.26 1h92 s LEU 31 Ca 0.47 -1.09 -0.05 0.00 -1.03 0.00 0.00 54.13 52.44 1h92 s LEU 31 Cb -0.22 0.43 -0.03 0.00 0.03 0.00 0.00 46.19 46.39 1h92 s LEU 31 CO 0.28 -0.72 0.02 -0.60 0.23 0.00 0.00 176.35 175.56 1h92 s ARG 32 N -4.00 3.59 -0.75 1.70 3.52 0.11 -0.84 118.95 122.29 1h92 s ARG 32 Ca 0.18 -0.40 -0.16 0.00 -0.13 0.00 0.00 55.73 55.22 1h92 s ARG 32 Cb 0.07 -3.01 0.16 0.00 -1.56 0.00 0.00 34.95 30.61 1h92 s ARG 32 CO -0.02 0.41 0.79 0.42 -0.81 0.00 0.00 175.30 176.10 1h92 s ILE 33 N -0.06 5.18 -0.18 4.11 -1.09 -0.80 -1.11 121.20 127.26 1h92 s ILE 33 Ca 0.04 -1.80 0.16 0.00 -2.23 0.00 0.00 60.65 56.82 1h92 s ILE 33 Cb -0.13 -4.52 0.09 0.00 -1.58 0.00 0.00 42.46 36.33 1h92 s ILE 33 CO 0.02 -1.13 1.47 -0.07 -1.23 0.00 0.00 174.94 173.99 1h92 h LEU 34 N 9.01 0.00 -7.92 2.97 3.38 -1.23 -3.44 115.31 118.07 1h92 h LEU 34 Ca -0.03 0.00 -0.32 0.00 0.09 0.00 0.00 57.88 57.62 1h92 h LEU 34 Cb 1.06 0.00 -0.28 0.00 0.09 0.00 0.00 40.66 41.53 1h92 h LEU 34 CO 0.95 0.45 -0.75 -0.70 0.09 0.00 0.00 178.44 178.48 1h92 s GLU 35 N -3.00 0.41 -0.39 1.13 2.12 -0.65 -4.94 118.70 113.40 1h92 s GLU 35 Ca 0.04 -0.23 0.13 0.00 0.36 0.00 0.00 54.97 55.27 1h92 s GLU 35 Cb 0.07 -0.38 0.40 0.00 0.26 0.00 0.00 34.13 34.48 1h92 s GLU 35 CO 0.74 0.10 0.88 1.04 -0.54 0.00 0.00 175.26 177.48 1h92 n GLN 36 N 2.83 1.59 -5.07 4.30 6.02 -1.26 -1.86 117.38 123.93 1h92 n GLN 36 Ca -0.14 -3.64 -0.31 0.00 -0.01 0.00 0.00 57.00 52.90 1h92 n GLN 36 Cb 0.58 -1.66 -0.15 0.00 1.02 0.00 0.00 30.24 30.03 1h92 n GLN 36 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.06 176.50 1h92 s SER 37 N -2.94 3.23 0.18 1.08 0.15 -1.26 -5.03 113.70 109.11 1h92 s SER 37 Ca 0.37 -0.49 0.00 0.00 0.70 0.00 0.00 55.95 56.53 1h92 s SER 37 Cb 0.39 -0.38 0.00 0.00 -1.71 0.00 0.00 66.02 64.32 1h92 s SER 37 CO -0.06 0.29 0.00 0.61 1.20 0.00 0.00 173.24 175.29 1h92 n GLY 38 N 2.10 -1.91 0.17 9.45 0.00 -1.26 -4.22 105.19 109.51 1h92 n GLY 38 Ca -0.16 -1.36 -0.10 0.00 0.00 0.00 0.00 46.02 44.40 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 0.37 -5.97 1.61 5.08 -2.01 -3.44 114.58 110.22 1h92 h GLU 39 Ca 0.00 -0.33 -0.61 0.00 -1.00 0.00 0.00 59.36 57.42 1h92 h GLU 39 Cb 0.03 0.08 -0.05 0.00 0.50 0.00 0.00 28.75 29.31 1h92 h GLU 39 CO 0.00 0.98 -0.33 -1.58 -1.00 0.00 0.00 179.01 177.08 1h92 s TRP 40 N -3.51 3.59 0.22 4.33 0.52 -1.26 -3.51 118.94 119.32 1h92 s TRP 40 Ca -0.05 0.66 0.11 0.00 0.02 0.00 0.00 56.10 56.84 1h92 s TRP 40 Cb 0.10 -2.06 -0.05 0.00 -1.15 0.00 0.00 33.47 30.32 1h92 s TRP 40 CO 0.84 0.59 -0.20 -1.58 0.02 0.00 0.00 176.95 176.62 1h92 s TRP 41 N -1.32 2.37 -0.08 -1.98 0.51 -0.82 -4.28 118.94 113.34 1h92 s TRP 41 Ca 0.29 -0.32 -0.12 0.00 -2.12 0.00 0.00 56.10 53.82 1h92 s TRP 41 Cb -0.14 -1.12 -0.05 0.00 -0.81 0.00 0.00 33.47 31.35 1h92 s TRP 41 CO 0.16 0.57 0.29 0.21 -0.51 0.00 0.00 176.95 177.67 1h92 s LYS 42 N -2.97 3.84 0.34 4.98 2.20 -0.78 -0.95 119.74 126.40 1h92 s LYS 42 Ca 0.24 0.16 -0.09 0.00 -0.36 0.00 0.00 55.97 55.92 1h92 s LYS 42 Cb -0.07 -3.26 0.02 0.00 -1.51 0.00 0.00 37.83 33.01 1h92 s LYS 42 CO 0.12 0.61 0.58 0.00 -0.36 0.00 0.00 175.35 176.30 1h92 s ALA 43 N -0.68 0.05 0.06 3.13 0.00 -0.81 -0.71 121.76 122.80 1h92 s ALA 43 Ca 0.19 -1.12 -0.11 0.00 0.00 0.00 0.00 51.96 50.92 1h92 s ALA 43 Cb -0.14 0.98 0.01 0.00 0.00 0.00 0.00 23.12 23.97 1h92 s ALA 43 CO 0.08 -0.87 0.24 1.14 0.00 0.00 0.00 175.76 176.35 1h92 s GLN 44 N -3.04 0.80 -0.32 0.00 -2.07 -0.26 -0.19 119.66 114.57 1h92 s GLN 44 Ca 0.24 -0.69 -0.13 0.00 -1.82 0.00 0.00 55.36 52.95 1h92 s GLN 44 Cb -0.02 0.33 -0.03 0.00 -1.09 0.00 0.00 33.01 32.21 1h92 s GLN 44 CO 0.15 -0.25 0.29 0.45 -1.32 0.00 0.00 175.29 174.60 1h92 s SER 45 N -2.35 6.11 0.00 12.60 0.15 0.86 0.08 113.70 131.15 1h92 s SER 45 Ca -0.02 -0.19 0.23 0.00 0.70 0.00 0.00 55.95 56.68 1h92 s SER 45 Cb 0.01 -2.16 1.35 0.00 -1.71 0.00 0.00 66.02 63.50 1h92 s SER 45 CO -0.06 -0.22 1.75 0.18 1.20 0.00 0.00 173.24 176.08 1h92 n LEU 46 N 5.21 0.00 -0.03 3.45 4.77 -1.26 -0.81 117.00 128.34 1h92 n LEU 46 Ca -0.11 0.04 -0.04 0.00 -0.03 0.00 0.00 56.01 55.87 1h92 n LEU 46 Cb 0.50 -0.04 -0.13 0.00 -2.33 0.00 0.00 43.42 41.42 1h92 n LEU 46 CO 0.37 -0.01 -0.68 0.35 -1.33 0.00 0.00 177.39 176.09 1h92 n THR 47 N -1.04 1.18 0.20 -5.08 -2.24 -1.26 -4.40 114.28 101.64 1h92 n THR 47 Ca 0.16 -0.74 0.03 0.00 -2.27 0.00 0.00 64.05 61.23 1h92 n THR 47 Cb 0.09 -0.61 -0.04 0.00 -2.10 0.00 0.00 70.33 67.67 1h92 n THR 47 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1h92 n THR 48 N -2.79 0.00 -2.82 4.28 -2.24 -1.11 -5.01 114.28 104.58 1h92 n THR 48 Ca -0.18 -0.29 -0.08 0.00 -2.27 0.00 0.00 64.05 61.23 1h92 n THR 48 Cb 0.95 0.81 0.02 0.00 -2.10 0.00 0.00 70.33 70.01 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 1.45 0.44 3.27 3.38 0.00 0.01 -5.04 105.19 108.70 1h92 n GLY 49 Ca 0.00 -0.38 -0.19 0.00 0.00 0.00 0.00 46.02 45.45 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 -5.38 1.11 0.14 1.61 -0.21 -1.18 -4.97 119.66 110.79 1h92 s GLN 50 Ca 0.18 -1.32 0.09 0.00 0.02 0.00 0.00 55.36 54.33 1h92 s GLN 50 Cb -0.08 -1.01 -0.04 0.00 1.00 0.00 0.00 33.01 32.88 1h92 s GLN 50 CO 0.23 0.19 -0.21 -1.21 -2.12 0.00 0.00 175.29 172.17 1h92 s GLU 51 N -2.84 1.27 0.00 2.91 2.02 -1.26 -0.10 118.70 120.69 1h92 s GLU 51 Ca 0.12 -1.33 0.00 0.00 0.02 0.00 0.00 54.97 53.78 1h92 s GLU 51 Cb -0.04 -1.49 0.00 0.00 0.10 0.00 0.00 34.13 32.70 1h92 s GLU 51 CO 0.04 0.33 0.00 0.41 0.02 0.00 0.00 175.26 176.06 1h92 n GLY 52 N 0.65 2.66 3.17 -1.39 0.00 0.73 -4.79 105.19 106.23 1h92 n GLY 52 Ca -0.16 -0.39 -0.23 0.00 0.00 0.00 0.00 46.02 45.24 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 -0.99 1.46 -0.02 1.61 0.08 -1.26 -1.93 117.98 116.95 1h92 s PHE 53 Ca 0.00 -0.33 -0.01 0.00 0.12 0.00 0.00 56.93 56.71 1h92 s PHE 53 Cb 0.00 -0.89 0.01 0.00 -0.57 0.00 0.00 43.02 41.57 1h92 s PHE 53 CO 0.00 0.03 0.04 0.96 -0.10 0.00 0.00 175.22 176.15 1h92 s ILE 54 N -0.68 -0.00 0.84 0.64 -5.25 -0.13 -2.48 121.20 114.14 1h92 s ILE 54 Ca 0.05 0.02 -0.13 0.00 -0.99 0.00 0.00 60.65 59.60 1h92 s ILE 54 Cb -0.08 -0.07 0.09 0.00 2.95 0.00 0.00 42.46 45.36 1h92 s ILE 54 CO 0.01 0.01 1.14 -0.81 -1.79 0.00 0.00 174.94 173.50 1h92 n PRO 55 N 3.15 0.01 0.00 0.37 -0.04 -1.26 -1.94 135.00 135.29 1h92 n PRO 55 Ca -0.13 0.08 0.15 0.00 -0.04 0.00 0.00 63.50 63.56 1h92 n PRO 55 Cb 0.59 -2.39 0.69 0.00 -0.04 0.00 0.00 33.50 32.35 1h92 n PRO 55 CO 0.00 0.00 0.00 1.97 -0.04 0.00 0.00 175.50 177.43 1h92 n PHE 56 N -3.52 0.00 -0.51 0.54 -1.74 -1.23 -3.52 117.46 107.48 1h92 n PHE 56 Ca 0.13 0.00 0.09 0.00 -0.56 0.00 0.00 57.45 57.11 1h92 n PHE 56 Cb 0.51 -0.09 0.30 0.00 1.52 0.00 0.00 39.48 41.72 1h92 n PHE 56 CO 0.00 0.00 0.00 0.09 -0.56 0.00 0.00 176.76 176.29 1h92 n ASN 57 N -0.70 4.13 -0.15 5.98 5.03 -1.26 -4.24 115.26 124.04 1h92 n ASN 57 Ca 0.18 -2.31 0.05 0.00 0.87 0.00 0.00 54.58 53.37 1h92 n ASN 57 Cb 0.25 -0.48 -0.02 0.00 -1.02 0.00 0.00 39.78 38.51 1h92 n ASN 57 CO 0.00 0.00 0.00 0.49 -1.83 0.00 0.00 177.26 175.92 1h92 n PHE 58 N 0.96 0.00 -4.00 3.10 3.01 -1.23 -4.91 117.46 114.39 1h92 n PHE 58 Ca 0.22 0.00 -0.12 0.00 1.01 0.00 0.00 57.45 58.56 1h92 n PHE 58 Cb 0.74 0.00 -0.13 0.00 -0.01 0.00 0.00 39.48 40.08 1h92 n PHE 58 CO 0.00 0.00 0.00 0.14 1.01 0.00 0.00 176.76 177.91 1h92 s VAL 59 N -1.51 0.22 0.00 -4.37 -7.23 -1.26 0.22 120.40 106.47 1h92 s VAL 59 Ca 0.07 -0.57 0.00 0.00 -1.81 0.00 0.00 61.98 59.66 1h92 s VAL 59 Cb 0.08 -0.28 0.00 0.00 0.56 0.00 0.00 36.38 36.74 1h92 s VAL 59 CO 0.29 -0.23 0.00 0.00 -0.31 0.00 0.00 175.10 174.85 1h92 n ALA 60 N 2.22 0.00 -0.55 1.32 0.00 -1.23 -4.90 120.51 117.37 1h92 n ALA 60 Ca -0.18 0.00 0.46 0.00 0.00 0.00 0.00 53.44 53.71 1h92 n ALA 60 Cb 0.57 0.00 0.75 0.00 0.00 0.00 0.00 19.45 20.77 1h92 n ALA 60 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 1h92 h LYS 61 N 0.00 0.00 -2.85 0.00 1.57 -1.94 -3.43 116.57 109.92 1h92 h LYS 61 Ca 0.00 0.00 -0.19 0.00 -1.87 0.00 0.00 60.65 58.59 1h92 h LYS 61 Cb 0.00 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 32.27 1h92 h LYS 61 CO 0.00 0.00 -0.21 0.00 -0.57 0.00 0.00 179.45 178.67 1h92 n ALA 62 N -2.78 -0.50 0.76 3.86 0.00 -1.25 -4.84 120.51 115.76 1h92 n ALA 62 Ca 0.37 0.12 0.09 0.00 0.00 0.00 0.00 53.44 54.02 1h92 n ALA 62 Cb 1.77 -1.19 0.08 0.00 0.00 0.00 0.00 19.45 20.11 1h92 n ALA 62 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79