#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 4.65 0.44 1.61 0.01 -1.26 -4.93 113.70 114.22 1h92 s SER 2 Ca 0.00 2.22 -0.26 0.00 1.31 0.00 0.00 55.95 59.22 1h92 s SER 2 Cb 0.00 -2.58 -0.09 0.00 0.21 0.00 0.00 66.02 63.57 1h92 s SER 2 CO 0.00 -1.95 1.46 -0.81 0.41 0.00 0.00 173.24 172.35 1h92 n PRO 3 N -2.47 2.38 -0.19 12.44 -0.04 -1.26 -4.89 135.00 140.96 1h92 n PRO 3 Ca 0.12 0.84 -0.02 0.00 -0.04 0.00 0.00 63.50 64.40 1h92 n PRO 3 Cb 0.51 -2.66 0.18 0.00 -0.04 0.00 0.00 33.50 31.49 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 2.46 0.87 -1.95 1.53 7.12 -2.08 -1.99 115.31 121.27 1h92 h LEU 4 Ca -0.51 -0.11 0.05 0.00 0.13 0.00 0.00 57.88 57.44 1h92 h LEU 4 Cb 1.26 -0.22 -0.01 0.00 -0.53 0.00 0.00 40.66 41.16 1h92 h LEU 4 CO 0.62 0.76 0.15 1.56 -0.13 0.00 0.00 178.44 181.40 1h92 h GLN 5 N 0.94 0.06 -6.18 1.25 4.20 -2.03 -3.45 115.11 109.89 1h92 h GLN 5 Ca 0.22 -0.00 -0.45 0.00 0.06 0.00 0.00 58.65 58.48 1h92 h GLN 5 Cb 0.15 -0.01 0.01 0.00 0.30 0.00 0.00 27.48 27.94 1h92 h GLN 5 CO -0.02 0.04 -0.78 -0.25 -0.67 0.00 0.00 178.83 177.14 1h92 n ASP 6 N -4.48 -3.36 -0.15 1.46 8.00 -0.75 -4.83 116.55 112.44 1h92 n ASP 6 Ca 0.02 -0.78 0.08 0.00 0.71 0.00 0.00 54.79 54.82 1h92 n ASP 6 Cb 0.25 -4.04 0.43 0.00 -0.02 0.00 0.00 41.12 37.74 1h92 n ASP 6 CO 0.00 0.00 0.00 -3.20 -0.39 0.00 0.00 177.20 173.61 1h92 n ASN 7 N -2.94 0.44 -4.89 -2.24 2.85 -1.26 -4.82 115.26 102.40 1h92 n ASN 7 Ca -0.11 -1.58 -0.29 0.00 -0.11 0.00 0.00 54.58 52.49 1h92 n ASN 7 Cb 0.59 -0.03 -0.03 0.00 1.24 0.00 0.00 39.78 41.55 1h92 n ASN 7 CO 0.00 0.00 0.00 -0.76 -2.11 0.00 0.00 177.26 174.39 1h92 s LEU 8 N -1.48 3.96 0.22 1.20 1.02 -1.26 -1.59 118.68 120.75 1h92 s LEU 8 Ca 0.25 0.86 -0.09 0.00 0.02 0.00 0.00 54.13 55.17 1h92 s LEU 8 Cb 0.12 -3.71 -0.01 0.00 0.02 0.00 0.00 46.19 42.61 1h92 s LEU 8 CO 0.20 -0.28 0.36 0.68 0.02 0.00 0.00 176.35 177.32 1h92 s VAL 9 N -2.21 0.01 0.05 -1.59 -7.23 0.12 -4.08 120.40 105.47 1h92 s VAL 9 Ca 0.47 -1.52 0.05 0.00 -1.81 0.00 0.00 61.98 59.16 1h92 s VAL 9 Cb -0.11 -2.18 -0.04 0.00 0.56 0.00 0.00 36.38 34.62 1h92 s VAL 9 CO 0.31 -0.07 -0.10 -0.63 -0.31 0.00 0.00 175.10 174.30 1h92 s ILE 10 N -4.04 3.39 -0.42 -0.62 -1.09 -1.25 -0.20 121.20 116.97 1h92 s ILE 10 Ca 0.25 -1.03 -0.29 0.00 -2.23 0.00 0.00 60.65 57.35 1h92 s ILE 10 Cb 0.02 -2.51 0.03 0.00 -1.58 0.00 0.00 42.46 38.42 1h92 s ILE 10 CO 0.08 0.28 1.11 0.00 -1.23 0.00 0.00 174.94 175.18 1h92 s ALA 11 N -1.06 3.28 -0.08 9.38 0.00 0.14 -3.58 121.76 129.83 1h92 s ALA 11 Ca 0.18 -0.34 0.24 0.00 0.00 0.00 0.00 51.96 52.04 1h92 s ALA 11 Cb -0.11 -3.81 0.67 0.00 0.00 0.00 0.00 23.12 19.87 1h92 s ALA 11 CO 0.09 -1.98 1.72 1.25 0.00 0.00 0.00 175.76 176.84 1h92 h LEU 12 N 10.81 0.00 -7.39 0.00 5.85 -0.21 1.31 115.31 125.67 1h92 h LEU 12 Ca -0.22 0.00 -0.10 0.00 0.84 0.00 0.00 57.88 58.39 1h92 h LEU 12 Cb 1.06 0.00 -0.20 0.00 0.37 0.00 0.00 40.66 41.89 1h92 h LEU 12 CO 1.09 0.19 -0.17 -1.00 -0.34 0.00 0.00 178.44 178.21 1h92 s HIS 13 N -3.39 -0.30 0.37 1.25 3.76 -1.25 -4.73 115.29 111.00 1h92 s HIS 13 Ca 0.03 0.48 -0.27 0.00 -0.15 0.00 0.00 55.06 55.15 1h92 s HIS 13 Cb 0.08 0.17 -0.09 0.00 1.11 0.00 0.00 32.58 33.85 1h92 s HIS 13 CO 0.65 -0.44 1.25 0.45 -0.85 0.00 0.00 174.74 175.80 1h92 s SER 14 N -1.26 6.62 0.26 1.40 0.15 -1.26 -4.37 113.70 115.24 1h92 s SER 14 Ca -0.13 2.54 0.04 0.00 0.70 0.00 0.00 55.95 59.10 1h92 s SER 14 Cb -0.04 -2.63 -0.03 0.00 -1.71 0.00 0.00 66.02 61.61 1h92 s SER 14 CO 0.05 -0.62 0.40 -0.47 1.20 0.00 0.00 173.24 173.80 1h92 s TYR 15 N -1.25 3.46 -0.15 3.44 5.04 0.80 -4.93 117.35 123.75 1h92 s TYR 15 Ca 0.53 0.05 -0.02 0.00 -2.44 0.00 0.00 57.07 55.20 1h92 s TYR 15 Cb -0.36 -1.64 -0.02 0.00 0.35 0.00 0.00 41.96 40.29 1h92 s TYR 15 CO 0.47 0.37 -0.09 -2.00 -1.34 0.00 0.00 175.55 172.95 1h92 s GLU 16 N -4.05 3.47 -1.21 4.97 -6.30 -1.26 -4.15 118.70 110.16 1h92 s GLU 16 Ca 0.35 -0.63 -0.18 0.00 -2.50 0.00 0.00 54.97 52.02 1h92 s GLU 16 Cb -0.09 -2.76 0.10 0.00 0.00 0.00 0.00 34.13 31.37 1h92 s GLU 16 CO 0.30 0.16 1.57 -1.25 0.02 0.00 0.00 175.26 176.07 1h92 s PRO 17 N 0.51 3.93 0.00 4.30 0.04 -1.26 -4.74 135.00 137.78 1h92 s PRO 17 Ca -0.07 -2.01 0.31 0.00 0.04 0.00 0.00 61.00 59.27 1h92 s PRO 17 Cb -0.15 -5.33 1.78 0.00 0.04 0.00 0.00 34.50 30.83 1h92 s PRO 17 CO 0.04 -2.08 2.16 -1.13 0.04 0.00 0.00 177.00 176.03 1h92 n SER 18 N 7.57 0.11 -3.19 6.66 3.41 -1.26 -4.86 113.62 122.06 1h92 n SER 18 Ca 0.41 -0.90 -0.17 0.00 -0.26 0.00 0.00 58.87 57.96 1h92 n SER 18 Cb 0.46 -0.04 -0.05 0.00 -0.26 0.00 0.00 64.21 64.32 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 -2.10 1.32 -0.14 7.33 3.76 -1.26 -5.12 115.29 119.08 1h92 s HIS 19 Ca 0.44 -1.44 -0.20 0.00 -0.15 0.00 0.00 55.06 53.71 1h92 s HIS 19 Cb 0.22 -0.28 -0.04 0.00 1.11 0.00 0.00 32.58 33.59 1h92 s HIS 19 CO 0.38 -1.09 0.55 0.34 -0.85 0.00 0.00 174.74 174.08 1h92 s ASP 20 N -3.30 6.72 0.00 1.40 2.15 -1.26 -3.80 116.67 118.59 1h92 s ASP 20 Ca 0.34 0.86 0.00 0.00 0.43 0.00 0.00 52.55 54.18 1h92 s ASP 20 Cb 0.00 -2.32 0.00 0.00 -0.30 0.00 0.00 42.92 40.30 1h92 s ASP 20 CO 0.24 -0.10 0.00 0.61 -0.17 0.00 0.00 175.17 175.75 1h92 n GLY 21 N 3.43 0.54 3.89 2.66 0.00 -1.26 -5.08 105.19 109.37 1h92 n GLY 21 Ca -0.05 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.68 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 -2.20 6.48 -0.29 1.61 1.01 -1.25 -2.62 116.67 119.41 1h92 s ASP 22 Ca 0.00 0.87 -0.06 0.00 0.71 0.00 0.00 52.55 54.07 1h92 s ASP 22 Cb 0.00 -2.21 0.01 0.00 1.01 0.00 0.00 42.92 41.73 1h92 s ASP 22 CO 0.00 -0.27 0.06 -0.22 0.21 0.00 0.00 175.17 174.95 1h92 s LEU 23 N -3.65 3.76 -0.65 1.23 2.96 -1.11 -4.75 118.68 116.47 1h92 s LEU 23 Ca 0.47 -0.76 -0.02 0.00 -0.22 0.00 0.00 54.13 53.59 1h92 s LEU 23 Cb -0.11 -1.84 0.27 0.00 0.50 0.00 0.00 46.19 45.01 1h92 s LEU 23 CO 0.30 -0.19 2.26 0.61 -1.32 0.00 0.00 176.35 178.01 1h92 n GLY 24 N 4.83 5.09 3.13 7.98 0.00 -1.26 -4.57 105.19 120.38 1h92 n GLY 24 Ca -0.15 -2.14 -0.26 0.00 0.00 0.00 0.00 46.02 43.47 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 -0.09 -1.93 -3.94 1.61 -1.74 -1.26 -3.94 117.46 106.16 1h92 n PHE 25 Ca 0.52 0.07 -0.26 0.00 -0.56 0.00 0.00 57.45 57.21 1h92 n PHE 25 Cb 0.43 -1.45 -0.01 0.00 1.52 0.00 0.00 39.48 39.96 1h92 n PHE 25 CO 0.00 0.00 0.00 -1.21 -0.56 0.00 0.00 176.76 174.99 1h92 s GLU 26 N -3.41 2.26 0.30 3.97 2.02 -1.26 -0.14 118.70 122.44 1h92 s GLU 26 Ca 0.45 -2.02 -0.29 0.00 0.02 0.00 0.00 54.97 53.13 1h92 s GLU 26 Cb -0.07 -2.06 -0.10 0.00 0.10 0.00 0.00 34.13 31.99 1h92 s GLU 26 CO 0.50 -0.56 1.25 0.15 0.02 0.00 0.00 175.26 176.62 1h92 s LYS 27 N -4.23 4.44 0.00 1.61 1.02 -1.26 -2.30 119.74 119.02 1h92 s LYS 27 Ca 0.33 2.09 0.00 0.00 0.02 0.00 0.00 55.97 58.41 1h92 s LYS 27 Cb -0.02 -3.12 0.00 0.00 -0.52 0.00 0.00 37.83 34.18 1h92 s LYS 27 CO 0.20 -0.09 0.00 0.41 -0.92 0.00 0.00 175.35 174.95 1h92 n GLY 28 N 1.07 2.71 3.69 -3.33 0.00 0.45 -4.93 105.19 104.85 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 -0.36 4.22 0.19 1.61 0.41 -0.97 -4.43 118.70 119.38 1h92 s GLU 29 Ca 0.00 2.23 -0.30 0.00 -0.41 0.00 0.00 54.97 56.49 1h92 s GLU 29 Cb 0.00 -3.55 -0.08 0.00 -1.78 0.00 0.00 34.13 28.72 1h92 s GLU 29 CO 0.00 -0.67 0.96 -1.14 -0.49 0.00 0.00 175.26 173.92 1h92 s GLN 30 N 2.42 4.78 0.07 1.61 0.74 -1.26 0.24 119.66 128.26 1h92 s GLN 30 Ca 0.71 1.50 0.00 0.00 0.05 0.00 0.00 55.36 57.63 1h92 s GLN 30 Cb -0.38 -3.31 -0.04 0.00 1.10 0.00 0.00 33.01 30.38 1h92 s GLN 30 CO 0.31 0.37 -0.05 -0.51 -0.55 0.00 0.00 175.29 174.85 1h92 s LEU 31 N -0.71 2.50 -0.11 3.68 1.43 0.72 -4.26 118.68 121.93 1h92 s LEU 31 Ca 0.44 -1.00 -0.02 0.00 -1.03 0.00 0.00 54.13 52.52 1h92 s LEU 31 Cb -0.25 0.06 -0.03 0.00 0.03 0.00 0.00 46.19 45.99 1h92 s LEU 31 CO 0.32 -0.53 -0.03 -0.60 0.23 0.00 0.00 176.35 175.74 1h92 s ARG 32 N -3.84 3.23 -0.79 1.70 3.52 0.17 0.12 118.95 123.05 1h92 s ARG 32 Ca 0.09 -0.48 -0.16 0.00 -0.13 0.00 0.00 55.73 55.05 1h92 s ARG 32 Cb 0.06 -2.81 0.17 0.00 -1.56 0.00 0.00 34.95 30.82 1h92 s ARG 32 CO -0.07 0.50 0.83 0.42 -0.81 0.00 0.00 175.30 176.17 1h92 s ILE 33 N -0.34 5.20 -0.14 4.11 -1.09 -0.62 -0.86 121.20 127.45 1h92 s ILE 33 Ca 0.06 -1.88 0.16 0.00 -2.23 0.00 0.00 60.65 56.75 1h92 s ILE 33 Cb -0.12 -4.55 0.08 0.00 -1.58 0.00 0.00 42.46 36.29 1h92 s ILE 33 CO 0.02 -1.17 1.47 -0.07 -1.23 0.00 0.00 174.94 173.97 1h92 h LEU 34 N 8.98 0.00 -7.78 2.97 3.38 -1.45 -3.45 115.31 117.96 1h92 h LEU 34 Ca 0.02 0.00 -0.35 0.00 0.09 0.00 0.00 57.88 57.64 1h92 h LEU 34 Cb 1.05 0.00 -0.31 0.00 0.09 0.00 0.00 40.66 41.49 1h92 h LEU 34 CO 0.93 0.48 -0.76 -0.70 0.09 0.00 0.00 178.44 178.49 1h92 s GLU 35 N -3.01 0.48 -0.43 1.13 2.56 -0.75 -4.95 118.70 113.73 1h92 s GLU 35 Ca 0.04 -0.09 0.10 0.00 0.00 0.00 0.00 54.97 55.02 1h92 s GLU 35 Cb 0.08 -0.52 0.39 0.00 2.00 0.00 0.00 34.13 36.08 1h92 s GLU 35 CO 0.74 -0.01 0.94 1.04 -0.56 0.00 0.00 175.26 177.42 1h92 n GLN 36 N 3.55 2.27 -4.30 4.30 6.02 -1.26 -1.64 117.38 126.32 1h92 n GLN 36 Ca -0.20 -4.04 -0.27 0.00 -0.01 0.00 0.00 57.00 52.48 1h92 n GLN 36 Cb 0.54 -1.88 -0.10 0.00 1.02 0.00 0.00 30.24 29.83 1h92 n GLN 36 CO 0.00 0.00 0.00 -1.12 -1.01 0.00 0.00 177.06 174.93 1h92 s SER 37 N -3.17 4.18 0.70 1.08 0.01 -1.26 -5.02 113.70 110.22 1h92 s SER 37 Ca 0.41 -0.59 0.00 0.00 1.31 0.00 0.00 55.95 57.08 1h92 s SER 37 Cb 0.37 -0.68 0.00 0.00 0.21 0.00 0.00 66.02 65.92 1h92 s SER 37 CO -0.10 0.11 0.00 0.61 0.41 0.00 0.00 173.24 174.27 1h92 n GLY 38 N 0.12 -1.34 0.16 3.44 0.00 -1.26 -3.94 105.19 102.36 1h92 n GLY 38 Ca -0.11 -1.09 -0.04 0.00 0.00 0.00 0.00 46.02 44.78 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 0.16 -5.85 1.61 5.08 -2.01 -3.43 114.58 110.14 1h92 h GLU 39 Ca 0.01 -0.12 -0.63 0.00 -1.00 0.00 0.00 59.36 57.62 1h92 h GLU 39 Cb 0.39 0.02 -0.06 0.00 0.50 0.00 0.00 28.75 29.60 1h92 h GLU 39 CO 0.00 0.73 -0.39 -1.58 -1.00 0.00 0.00 179.01 176.77 1h92 s TRP 40 N -3.70 3.60 0.21 4.33 0.52 -1.25 -3.90 118.94 118.75 1h92 s TRP 40 Ca -0.03 0.60 0.11 0.00 0.02 0.00 0.00 56.10 56.80 1h92 s TRP 40 Cb 0.12 -2.00 -0.05 0.00 -1.15 0.00 0.00 33.47 30.39 1h92 s TRP 40 CO 0.79 0.65 -0.23 -1.58 0.02 0.00 0.00 176.95 176.60 1h92 s TRP 41 N -1.21 2.29 -0.03 -1.98 0.51 -0.68 -4.23 118.94 113.60 1h92 s TRP 41 Ca 0.24 -0.36 -0.10 0.00 -2.12 0.00 0.00 56.10 53.76 1h92 s TRP 41 Cb -0.13 -1.10 -0.05 0.00 -0.81 0.00 0.00 33.47 31.37 1h92 s TRP 41 CO 0.13 0.54 0.29 0.21 -0.51 0.00 0.00 176.95 177.61 1h92 s LYS 42 N -2.84 3.67 0.30 4.98 2.20 -0.65 0.23 119.74 127.62 1h92 s LYS 42 Ca 0.22 0.11 -0.08 0.00 -0.36 0.00 0.00 55.97 55.87 1h92 s LYS 42 Cb -0.07 -3.16 0.00 0.00 -1.51 0.00 0.00 37.83 33.09 1h92 s LYS 42 CO 0.11 0.70 0.48 0.00 -0.36 0.00 0.00 175.35 176.28 1h92 s ALA 43 N -1.13 0.27 0.01 3.13 0.00 -0.82 -1.15 121.76 122.07 1h92 s ALA 43 Ca 0.22 -1.22 -0.02 0.00 0.00 0.00 0.00 51.96 50.95 1h92 s ALA 43 Cb -0.14 1.10 -0.01 0.00 0.00 0.00 0.00 23.12 24.06 1h92 s ALA 43 CO 0.11 -0.82 0.01 -1.14 0.00 0.00 0.00 175.76 173.92 1h92 s GLN 44 N -3.45 0.34 -0.40 0.00 0.74 -0.04 -0.98 119.66 115.88 1h92 s GLN 44 Ca 0.27 -0.53 -0.18 0.00 0.05 0.00 0.00 55.36 54.97 1h92 s GLN 44 Cb -0.00 0.13 0.01 0.00 1.10 0.00 0.00 33.01 34.24 1h92 s GLN 44 CO 0.15 -0.06 0.47 0.45 -0.55 0.00 0.00 175.29 175.74 1h92 s SER 45 N -1.38 6.23 0.00 6.67 0.15 0.29 0.44 113.70 126.10 1h92 s SER 45 Ca -0.15 -0.42 0.19 0.00 0.70 0.00 0.00 55.95 56.26 1h92 s SER 45 Cb -0.09 -2.24 1.06 0.00 -1.71 0.00 0.00 66.02 63.04 1h92 s SER 45 CO -0.00 -0.55 1.53 -0.11 1.20 0.00 0.00 173.24 175.31 1h92 n LEU 46 N 5.69 0.00 0.00 3.45 7.94 -1.26 0.40 117.00 133.22 1h92 n LEU 46 Ca -0.06 0.09 -0.06 0.00 -1.11 0.00 0.00 56.01 54.86 1h92 n LEU 46 Cb 0.48 -0.09 -0.12 0.00 0.53 0.00 0.00 43.42 44.22 1h92 n LEU 46 CO 0.46 -0.04 -0.37 0.74 -1.11 0.00 0.00 177.39 177.08 1h92 h THR 47 N 0.00 0.89 0.00 1.96 2.02 -1.91 -3.39 112.91 112.49 1h92 h THR 47 Ca 0.00 -2.65 0.00 0.00 0.77 0.00 0.00 66.41 64.53 1h92 h THR 47 Cb 0.05 2.40 0.00 0.00 -1.74 0.00 0.00 68.15 68.87 1h92 h THR 47 CO 0.00 0.51 0.00 0.35 0.37 0.00 0.00 175.52 176.75 1h92 n THR 48 N -3.06 0.00 -2.67 3.16 -2.24 -1.07 -5.01 114.28 103.39 1h92 n THR 48 Ca -0.13 -0.33 -0.09 0.00 -2.27 0.00 0.00 64.05 61.23 1h92 n THR 48 Cb 0.99 1.13 0.02 0.00 -2.10 0.00 0.00 70.33 70.37 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 0.41 0.26 3.63 3.38 0.00 0.16 -5.03 105.19 108.01 1h92 n GLY 49 Ca 0.00 -0.39 -0.32 0.00 0.00 0.00 0.00 46.02 45.31 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 -5.14 2.63 -0.04 1.61 -0.21 -1.12 -4.89 119.66 112.50 1h92 s GLN 50 Ca 0.15 -0.70 0.06 0.00 0.02 0.00 0.00 55.36 54.90 1h92 s GLN 50 Cb -0.07 -2.56 -0.02 0.00 1.00 0.00 0.00 33.01 31.36 1h92 s GLN 50 CO 0.19 0.60 -0.23 -2.00 -2.12 0.00 0.00 175.29 171.73 1h92 s GLU 51 N -1.56 2.31 -0.02 2.91 2.12 -1.26 0.10 118.70 123.30 1h92 s GLU 51 Ca 0.19 -0.87 -0.29 0.00 0.36 0.00 0.00 54.97 54.36 1h92 s GLU 51 Cb -0.11 -2.15 0.10 0.00 0.26 0.00 0.00 34.13 32.23 1h92 s GLU 51 CO 0.09 0.53 0.88 0.20 -0.54 0.00 0.00 175.26 176.43 1h92 s GLY 52 N -0.53 -0.45 0.38 -1.50 0.00 -0.15 -4.85 107.32 100.22 1h92 s GLY 52 Ca 0.07 1.15 -0.26 0.00 0.00 0.00 0.00 44.72 45.69 1h92 s GLY 52 CO 0.00 0.45 1.12 -1.36 0.00 0.00 0.00 173.10 173.32 1h92 s PHE 53 N -2.78 3.22 0.02 1.90 0.08 -1.08 -1.94 117.98 117.40 1h92 s PHE 53 Ca 0.03 1.61 0.01 0.00 0.12 0.00 0.00 56.93 58.70 1h92 s PHE 53 Cb -0.01 -3.30 -0.01 0.00 -0.57 0.00 0.00 43.02 39.13 1h92 s PHE 53 CO -0.07 -0.98 -0.05 0.96 -0.10 0.00 0.00 175.22 174.98 1h92 s ILE 54 N -1.43 0.33 0.53 0.64 -4.36 0.14 -2.73 121.20 114.30 1h92 s ILE 54 Ca 0.55 -0.62 -0.20 0.00 -0.26 0.00 0.00 60.65 60.11 1h92 s ILE 54 Cb -0.28 -0.36 -0.06 0.00 1.25 0.00 0.00 42.46 43.00 1h92 s ILE 54 CO 0.36 -0.20 1.14 -2.16 0.24 0.00 0.00 174.94 174.32 1h92 s PRO 55 N -0.88 3.43 0.00 0.37 0.04 -1.26 -1.69 135.00 135.02 1h92 s PRO 55 Ca -0.06 1.66 0.23 0.00 0.04 0.00 0.00 61.00 62.87 1h92 s PRO 55 Cb -0.06 -2.10 1.19 0.00 0.04 0.00 0.00 34.50 33.57 1h92 s PRO 55 CO -0.00 -0.79 1.75 1.97 0.04 0.00 0.00 177.00 179.96 1h92 n PHE 56 N -1.12 0.00 -0.02 0.56 -1.74 -1.25 -3.10 117.46 110.79 1h92 n PHE 56 Ca 0.11 0.00 0.00 0.00 -0.56 0.00 0.00 57.45 57.00 1h92 n PHE 56 Cb 0.50 -0.24 -0.13 0.00 1.52 0.00 0.00 39.48 41.13 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 -1.24 0.33 -0.12 5.98 2.85 -1.26 -4.08 115.26 117.72 1h92 n ASN 57 Ca 0.12 0.15 0.15 0.00 -0.11 0.00 0.00 54.58 54.88 1h92 n ASN 57 Cb 0.16 0.97 0.75 0.00 1.24 0.00 0.00 39.78 42.90 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 -2.66 0.00 -4.10 1.20 3.01 -1.18 -4.80 117.46 108.93 1h92 n PHE 58 Ca -0.15 0.00 -0.14 0.00 1.01 0.00 0.00 57.45 58.16 1h92 n PHE 58 Cb 0.86 -0.09 -0.13 0.00 -0.01 0.00 0.00 39.48 40.11 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 -2.22 0.43 0.05 -4.37 -7.23 -1.25 0.54 120.40 106.36 1h92 s VAL 59 Ca 0.38 -0.56 0.03 0.00 -1.81 0.00 0.00 61.98 60.02 1h92 s VAL 59 Cb 0.21 -0.43 -0.03 0.00 0.56 0.00 0.00 36.38 36.70 1h92 s VAL 59 CO 0.41 -0.10 -0.08 0.00 -0.31 0.00 0.00 175.10 175.02 1h92 s ALA 60 N -0.63 0.72 0.15 1.32 0.00 -1.23 -4.88 121.76 117.20 1h92 s ALA 60 Ca -0.03 -0.89 -0.31 0.00 0.00 0.00 0.00 51.96 50.73 1h92 s ALA 60 Cb -0.05 0.04 -0.10 0.00 0.00 0.00 0.00 23.12 23.01 1h92 s ALA 60 CO 0.00 -0.03 1.67 0.21 0.00 0.00 0.00 175.76 177.62 1h92 s LYS 61 N -1.94 4.18 0.43 0.00 2.20 -1.26 -3.84 119.74 119.52 1h92 s LYS 61 Ca -0.06 2.46 0.12 0.00 -0.36 0.00 0.00 55.97 58.13 1h92 s LYS 61 Cb -0.08 -3.32 0.96 0.00 -1.51 0.00 0.00 37.83 33.88 1h92 s LYS 61 CO -0.00 -0.71 2.01 0.00 -0.36 0.00 0.00 175.35 176.29 1h92 h ALA 62 N 7.47 1.70 -0.01 3.13 0.00 -1.88 -3.49 119.26 126.18 1h92 h ALA 62 Ca -0.43 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.36 1h92 h ALA 62 Cb 1.21 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.93 1h92 h ALA 62 CO 0.93 0.23 0.00 0.09 0.00 0.00 0.00 179.25 180.50