#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 6.21 0.54 1.61 0.01 -1.26 -4.98 113.70 115.84 1h92 s SER 2 Ca 0.00 1.74 -0.20 0.00 1.31 0.00 0.00 55.95 58.80 1h92 s SER 2 Cb 0.00 -2.53 -0.07 0.00 0.21 0.00 0.00 66.02 63.63 1h92 s SER 2 CO 0.00 -0.87 0.93 -0.81 0.41 0.00 0.00 173.24 172.90 1h92 n PRO 3 N -1.65 1.01 -3.82 12.44 -0.04 -1.26 -4.97 135.00 136.72 1h92 n PRO 3 Ca 0.08 0.38 -0.37 0.00 -0.04 0.00 0.00 63.50 63.55 1h92 n PRO 3 Cb 0.53 -2.08 -0.06 0.00 -0.04 0.00 0.00 33.50 31.85 1h92 n PRO 3 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1h92 s LEU 4 N -1.21 4.38 0.02 1.53 1.02 -1.26 -5.10 118.68 118.07 1h92 s LEU 4 Ca 0.71 0.50 0.08 0.00 0.02 0.00 0.00 54.13 55.44 1h92 s LEU 4 Cb -0.46 -2.13 -0.03 0.00 0.02 0.00 0.00 46.19 43.59 1h92 s LEU 4 CO 0.51 0.38 -0.22 -1.10 0.02 0.00 0.00 176.35 175.94 1h92 s GLN 5 N -0.90 2.00 0.00 1.70 -0.21 -1.26 -5.01 119.66 115.99 1h92 s GLN 5 Ca 0.15 -1.00 0.24 0.00 0.02 0.00 0.00 55.36 54.78 1h92 s GLN 5 Cb -0.12 -2.10 0.32 0.00 1.00 0.00 0.00 33.01 32.11 1h92 s GLN 5 CO 0.04 0.54 1.31 -0.25 -2.12 0.00 0.00 175.29 174.81 1h92 n ASP 6 N 1.85 2.20 -0.00 5.90 8.00 -1.26 -4.09 116.55 129.15 1h92 n ASP 6 Ca -0.17 -1.62 0.11 0.00 0.71 0.00 0.00 54.79 53.83 1h92 n ASP 6 Cb 0.52 0.18 0.68 0.00 -0.02 0.00 0.00 41.12 42.48 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 0.45 0.01 -4.88 -2.24 2.85 -1.26 -4.75 115.26 105.44 1h92 n ASN 7 Ca 0.13 -1.29 -0.30 0.00 -0.11 0.00 0.00 54.58 53.01 1h92 n ASN 7 Cb 0.49 -0.00 -0.03 0.00 1.24 0.00 0.00 39.78 41.48 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 -1.71 3.83 0.20 1.20 1.43 -1.26 -0.27 118.68 122.10 1h92 s LEU 8 Ca 0.34 1.10 -0.08 0.00 -1.03 0.00 0.00 54.13 54.46 1h92 s LEU 8 Cb 0.16 -3.98 -0.02 0.00 0.03 0.00 0.00 46.19 42.38 1h92 s LEU 8 CO 0.26 -0.40 0.31 0.68 0.23 0.00 0.00 176.35 177.44 1h92 s VAL 9 N -2.37 0.03 -0.07 -1.59 -7.23 0.23 -2.82 120.40 106.57 1h92 s VAL 9 Ca 0.51 -1.56 0.02 0.00 -1.81 0.00 0.00 61.98 59.13 1h92 s VAL 9 Cb -0.10 -2.14 -0.03 0.00 0.56 0.00 0.00 36.38 34.67 1h92 s VAL 9 CO 0.32 -0.12 -0.10 -0.63 -0.31 0.00 0.00 175.10 174.26 1h92 s ILE 10 N -4.04 3.46 -0.34 -0.62 -1.09 -0.69 -0.91 121.20 116.97 1h92 s ILE 10 Ca 0.25 -0.57 -0.29 0.00 -2.23 0.00 0.00 60.65 57.81 1h92 s ILE 10 Cb 0.03 -2.40 0.02 0.00 -1.58 0.00 0.00 42.46 38.53 1h92 s ILE 10 CO 0.06 0.59 1.07 0.00 -1.23 0.00 0.00 174.94 175.43 1h92 s ALA 11 N -0.70 3.45 -0.16 9.38 0.00 -0.29 -2.38 121.76 131.06 1h92 s ALA 11 Ca 0.11 -0.14 0.29 0.00 0.00 0.00 0.00 51.96 52.22 1h92 s ALA 11 Cb -0.11 -3.68 0.89 0.00 0.00 0.00 0.00 23.12 20.22 1h92 s ALA 11 CO 0.01 -1.57 1.81 -0.07 0.00 0.00 0.00 175.76 175.94 1h92 h LEU 12 N 10.20 0.00 -7.11 0.00 3.38 0.15 1.71 115.31 123.64 1h92 h LEU 12 Ca -0.21 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.69 1h92 h LEU 12 Cb 1.06 0.00 -0.21 0.00 0.09 0.00 0.00 40.66 41.60 1h92 h LEU 12 CO 1.04 0.00 0.04 -1.00 0.09 0.00 0.00 178.44 178.60 1h92 s HIS 13 N -3.45 -0.63 0.51 1.13 3.76 -1.25 -4.68 115.29 110.69 1h92 s HIS 13 Ca 0.04 1.39 -0.23 0.00 -0.15 0.00 0.00 55.06 56.11 1h92 s HIS 13 Cb 0.07 0.27 -0.06 0.00 1.11 0.00 0.00 32.58 33.97 1h92 s HIS 13 CO 0.60 -0.41 1.33 -1.13 -0.85 0.00 0.00 174.74 174.28 1h92 n SER 14 N 2.11 2.65 -4.88 1.40 3.41 -1.26 -4.50 113.62 112.54 1h92 n SER 14 Ca -0.16 1.01 -0.21 0.00 -0.26 0.00 0.00 58.87 59.26 1h92 n SER 14 Cb 0.56 -1.56 -0.03 0.00 -0.26 0.00 0.00 64.21 62.93 1h92 n SER 14 CO 0.00 0.00 0.00 -0.47 -0.16 0.00 0.00 175.04 174.41 1h92 s TYR 15 N -1.27 2.83 -0.15 7.33 5.04 0.79 -4.89 117.35 127.04 1h92 s TYR 15 Ca 0.68 -0.38 -0.00 0.00 -2.44 0.00 0.00 57.07 54.93 1h92 s TYR 15 Cb -0.44 -2.00 -0.01 0.00 0.35 0.00 0.00 41.96 39.87 1h92 s TYR 15 CO 0.52 0.01 -0.13 -1.21 -1.34 0.00 0.00 175.55 173.40 1h92 s GLU 16 N -4.08 3.31 -1.03 4.97 2.02 -1.26 -4.15 118.70 118.48 1h92 s GLU 16 Ca 0.45 -0.71 -0.23 0.00 0.02 0.00 0.00 54.97 54.50 1h92 s GLU 16 Cb -0.05 -2.65 0.05 0.00 0.10 0.00 0.00 34.13 31.58 1h92 s GLU 16 CO 0.28 0.11 1.47 -1.25 0.02 0.00 0.00 175.26 175.89 1h92 s PRO 17 N 0.61 3.58 0.00 0.39 0.04 -1.26 -4.70 135.00 133.66 1h92 s PRO 17 Ca -0.08 -1.14 0.28 0.00 0.04 0.00 0.00 61.00 60.10 1h92 s PRO 17 Cb -0.16 -5.36 1.18 0.00 0.04 0.00 0.00 34.50 30.21 1h92 s PRO 17 CO 0.03 -2.24 1.89 -1.13 0.04 0.00 0.00 177.00 175.59 1h92 n SER 18 N 8.98 0.01 -4.14 6.66 3.41 -1.26 -4.84 113.62 122.44 1h92 n SER 18 Ca 0.34 0.50 -0.28 0.00 -0.26 0.00 0.00 58.87 59.17 1h92 n SER 18 Cb 0.51 -0.51 -0.07 0.00 -0.26 0.00 0.00 64.21 63.88 1h92 n SER 18 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 1h92 n HIS 19 N -1.51 0.49 1.56 7.33 8.25 -1.26 -5.02 115.22 125.06 1h92 n HIS 19 Ca 0.07 -2.57 0.13 0.00 -0.26 0.00 0.00 57.72 55.08 1h92 n HIS 19 Cb 0.33 -0.12 0.55 0.00 1.12 0.00 0.00 29.99 31.87 1h92 n HIS 19 CO 0.00 0.00 0.00 -0.25 0.64 0.00 0.00 176.34 176.73 1h92 n ASP 20 N -1.45 1.10 0.00 0.41 8.00 -1.26 -3.78 116.55 119.58 1h92 n ASP 20 Ca -0.11 -1.47 0.00 0.00 0.71 0.00 0.00 54.79 53.92 1h92 n ASP 20 Cb 0.62 -0.03 0.00 0.00 -0.02 0.00 0.00 41.12 41.69 1h92 n ASP 20 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1h92 n GLY 21 N 1.08 0.42 3.75 0.44 0.00 -1.26 -5.05 105.19 104.58 1h92 n GLY 21 Ca 0.18 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.88 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 -1.32 4.65 -0.19 1.61 1.01 -1.25 -1.81 116.67 119.37 1h92 s ASP 22 Ca 0.00 2.03 -0.01 0.00 0.71 0.00 0.00 52.55 55.28 1h92 s ASP 22 Cb 0.00 -2.55 0.01 0.00 1.01 0.00 0.00 42.92 41.39 1h92 s ASP 22 CO 0.00 -1.94 -0.13 -0.22 0.21 0.00 0.00 175.17 173.09 1h92 s LEU 23 N -5.29 2.46 -0.86 1.23 2.96 -0.56 -4.59 118.68 114.03 1h92 s LEU 23 Ca 0.67 -0.53 -0.02 0.00 -0.22 0.00 0.00 54.13 54.02 1h92 s LEU 23 Cb -0.21 -1.59 0.27 0.00 0.50 0.00 0.00 46.19 45.16 1h92 s LEU 23 CO 0.47 -0.00 2.15 0.61 -1.32 0.00 0.00 176.35 178.25 1h92 n GLY 24 N 4.66 5.43 3.20 7.98 0.00 -1.26 -4.57 105.19 120.63 1h92 n GLY 24 Ca -0.20 -2.36 -0.34 0.00 0.00 0.00 0.00 46.02 43.12 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 0.01 -1.54 -2.86 1.61 -1.74 -1.26 -3.89 117.46 107.79 1h92 n PHE 25 Ca 0.52 0.29 -0.21 0.00 -0.56 0.00 0.00 57.45 57.49 1h92 n PHE 25 Cb 0.30 -1.52 0.07 0.00 1.52 0.00 0.00 39.48 39.85 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 -3.00 2.16 0.03 3.97 2.02 -1.26 -0.15 118.70 122.47 1h92 s GLU 26 Ca 0.50 -1.38 -0.30 0.00 0.02 0.00 0.00 54.97 53.81 1h92 s GLU 26 Cb -0.06 -2.54 -0.06 0.00 0.10 0.00 0.00 34.13 31.56 1h92 s GLU 26 CO 0.67 -0.99 1.35 0.21 0.02 0.00 0.00 175.26 176.51 1h92 s LYS 27 N -4.80 4.32 0.00 1.61 2.20 -1.26 -2.12 119.74 119.69 1h92 s LYS 27 Ca 0.62 1.93 0.00 0.00 -0.36 0.00 0.00 55.97 58.17 1h92 s LYS 27 Cb -0.06 -3.46 0.00 0.00 -1.51 0.00 0.00 37.83 32.80 1h92 s LYS 27 CO 0.40 -0.48 0.00 0.41 -0.36 0.00 0.00 175.35 175.32 1h92 n GLY 28 N 3.52 1.25 3.72 5.54 0.00 0.58 -4.91 105.19 114.88 1h92 n GLY 28 Ca 0.12 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.72 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 -0.48 4.25 0.16 1.61 2.12 -0.90 -4.44 118.70 121.02 1h92 s GLU 29 Ca 0.00 2.26 -0.30 0.00 0.36 0.00 0.00 54.97 57.29 1h92 s GLU 29 Cb 0.00 -3.19 -0.07 0.00 0.26 0.00 0.00 34.13 31.13 1h92 s GLU 29 CO 0.00 -0.55 0.97 -1.14 -0.54 0.00 0.00 175.26 174.00 1h92 s GLN 30 N 1.12 4.74 0.09 4.30 0.74 -1.26 -1.14 119.66 128.24 1h92 s GLN 30 Ca 0.68 1.49 -0.01 0.00 0.05 0.00 0.00 55.36 57.57 1h92 s GLN 30 Cb -0.41 -3.34 -0.04 0.00 1.10 0.00 0.00 33.01 30.32 1h92 s GLN 30 CO 0.31 0.30 0.01 -0.51 -0.55 0.00 0.00 175.29 174.84 1h92 s LEU 31 N -0.42 2.18 -0.07 3.68 1.43 -0.09 -4.35 118.68 121.05 1h92 s LEU 31 Ca 0.45 -1.09 0.01 0.00 -1.03 0.00 0.00 54.13 52.47 1h92 s LEU 31 Cb -0.25 0.22 -0.03 0.00 0.03 0.00 0.00 46.19 46.17 1h92 s LEU 31 CO 0.31 -0.65 -0.10 -0.60 0.23 0.00 0.00 176.35 175.55 1h92 s ARG 32 N -3.97 2.76 -0.77 1.70 3.52 0.79 0.77 118.95 123.75 1h92 s ARG 32 Ca 0.15 -0.60 -0.15 0.00 -0.13 0.00 0.00 55.73 54.99 1h92 s ARG 32 Cb 0.08 -2.54 0.19 0.00 -1.56 0.00 0.00 34.95 31.11 1h92 s ARG 32 CO -0.04 0.60 0.75 0.42 -0.81 0.00 0.00 175.30 176.22 1h92 s ILE 33 N -0.64 5.41 -0.31 4.11 1.01 0.63 -0.99 121.20 130.41 1h92 s ILE 33 Ca 0.10 -2.13 0.21 0.00 0.00 0.00 0.00 60.65 58.82 1h92 s ILE 33 Cb -0.11 -4.48 0.25 0.00 0.01 0.00 0.00 42.46 38.12 1h92 s ILE 33 CO 0.01 -1.05 1.57 -0.07 0.00 0.00 0.00 174.94 175.40 1h92 h LEU 34 N 8.35 0.00 -7.63 2.97 3.38 -1.38 -3.45 115.31 117.55 1h92 h LEU 34 Ca 0.02 0.00 -0.33 0.00 0.09 0.00 0.00 57.88 57.66 1h92 h LEU 34 Cb 1.05 0.00 -0.33 0.00 0.09 0.00 0.00 40.66 41.47 1h92 h LEU 34 CO 0.86 0.17 -0.74 -0.70 0.09 0.00 0.00 178.44 178.12 1h92 s GLU 35 N -3.15 0.24 -0.48 1.13 2.12 -0.74 -4.94 118.70 112.89 1h92 s GLU 35 Ca 0.06 0.06 0.08 0.00 0.36 0.00 0.00 54.97 55.53 1h92 s GLU 35 Cb 0.06 -0.40 0.37 0.00 0.26 0.00 0.00 34.13 34.42 1h92 s GLU 35 CO 0.69 -0.11 0.94 1.04 -0.54 0.00 0.00 175.26 177.28 1h92 n GLN 36 N 3.96 2.59 -4.29 4.30 6.02 -1.26 -1.16 117.38 127.53 1h92 n GLN 36 Ca -0.25 -4.31 -0.29 0.00 -0.01 0.00 0.00 57.00 52.14 1h92 n GLN 36 Cb 0.52 -2.03 -0.11 0.00 1.02 0.00 0.00 30.24 29.64 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 -3.24 3.96 0.67 1.08 0.15 -1.26 -5.02 113.70 110.05 1h92 s SER 37 Ca 0.45 -0.54 0.00 0.00 0.70 0.00 0.00 55.95 56.55 1h92 s SER 37 Cb 0.34 -0.58 0.00 0.00 -1.71 0.00 0.00 66.02 64.07 1h92 s SER 37 CO -0.12 0.17 0.00 0.61 1.20 0.00 0.00 173.24 175.10 1h92 n GLY 38 N 0.74 -1.15 0.13 9.45 0.00 -1.26 -4.00 105.19 109.10 1h92 n GLY 38 Ca -0.15 -1.12 -0.08 0.00 0.00 0.00 0.00 46.02 44.67 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 0.20 -5.89 1.61 5.08 -2.01 -3.44 114.58 110.13 1h92 h GLU 39 Ca 0.00 -0.21 -0.63 0.00 -1.00 0.00 0.00 59.36 57.53 1h92 h GLU 39 Cb 0.00 0.06 -0.05 0.00 0.50 0.00 0.00 28.75 29.26 1h92 h GLU 39 CO 0.00 0.93 -0.40 -1.58 -1.00 0.00 0.00 179.01 176.96 1h92 s TRP 40 N -3.25 3.57 0.20 4.33 0.52 -1.26 -3.97 118.94 119.08 1h92 s TRP 40 Ca -0.03 0.54 0.11 0.00 0.02 0.00 0.00 56.10 56.75 1h92 s TRP 40 Cb 0.10 -1.97 -0.04 0.00 -1.15 0.00 0.00 33.47 30.41 1h92 s TRP 40 CO 0.82 0.62 -0.23 -1.58 0.02 0.00 0.00 176.95 176.60 1h92 s TRP 41 N -1.30 2.32 0.01 -1.98 0.51 -0.83 -4.22 118.94 113.46 1h92 s TRP 41 Ca 0.27 -0.35 -0.15 0.00 -2.12 0.00 0.00 56.10 53.75 1h92 s TRP 41 Cb -0.13 -1.14 -0.06 0.00 -0.81 0.00 0.00 33.47 31.33 1h92 s TRP 41 CO 0.16 0.52 0.42 0.21 -0.51 0.00 0.00 176.95 177.75 1h92 s LYS 42 N -2.74 3.93 0.26 4.98 2.20 -0.31 0.50 119.74 128.56 1h92 s LYS 42 Ca 0.22 0.43 -0.09 0.00 -0.36 0.00 0.00 55.97 56.17 1h92 s LYS 42 Cb -0.08 -3.20 -0.01 0.00 -1.51 0.00 0.00 37.83 33.03 1h92 s LYS 42 CO 0.10 0.68 0.41 0.00 -0.36 0.00 0.00 175.35 176.18 1h92 s ALA 43 N -1.11 0.21 0.02 3.13 0.00 -0.49 -1.02 121.76 122.50 1h92 s ALA 43 Ca 0.25 -1.16 0.00 0.00 0.00 0.00 0.00 51.96 51.06 1h92 s ALA 43 Cb -0.17 1.14 -0.02 0.00 0.00 0.00 0.00 23.12 24.08 1h92 s ALA 43 CO 0.14 -0.79 -0.03 -1.14 0.00 0.00 0.00 175.76 173.94 1h92 s GLN 44 N -3.85 0.27 -0.43 0.00 0.74 -0.17 -0.76 119.66 115.46 1h92 s GLN 44 Ca 0.27 -0.49 -0.19 0.00 0.05 0.00 0.00 55.36 55.00 1h92 s GLN 44 Cb 0.01 0.04 0.02 0.00 1.10 0.00 0.00 33.01 34.18 1h92 s GLN 44 CO 0.12 -0.03 0.55 0.45 -0.55 0.00 0.00 175.29 175.83 1h92 s SER 45 N -1.15 6.26 0.00 6.67 0.15 0.31 -0.15 113.70 125.79 1h92 s SER 45 Ca -0.12 -0.52 0.19 0.00 0.70 0.00 0.00 55.95 56.19 1h92 s SER 45 Cb -0.08 -2.27 1.08 0.00 -1.71 0.00 0.00 66.02 63.03 1h92 s SER 45 CO -0.01 -0.69 1.54 -0.11 1.20 0.00 0.00 173.24 175.17 1h92 n LEU 46 N 5.95 0.00 -0.02 3.45 7.94 -1.26 0.27 117.00 133.33 1h92 n LEU 46 Ca -0.04 0.08 -0.10 0.00 -1.11 0.00 0.00 56.01 54.83 1h92 n LEU 46 Cb 0.47 -0.08 -0.14 0.00 0.53 0.00 0.00 43.42 44.20 1h92 n LEU 46 CO 0.50 -0.03 -0.60 0.41 -1.11 0.00 0.00 177.39 176.56 1h92 n THR 47 N -1.08 1.61 -0.00 1.96 -1.04 -1.26 -4.43 114.28 110.04 1h92 n THR 47 Ca 0.13 -0.78 0.00 0.00 -2.04 0.00 0.00 64.05 61.35 1h92 n THR 47 Cb 0.09 -1.08 0.00 0.00 -1.82 0.00 0.00 70.33 67.52 1h92 n THR 47 CO 0.00 0.00 0.00 0.35 -0.64 0.00 0.00 175.07 174.78 1h92 n THR 48 N -3.07 0.00 -2.58 12.58 -2.24 -1.08 -5.01 114.28 112.87 1h92 n THR 48 Ca -0.20 -0.48 -0.06 0.00 -2.27 0.00 0.00 64.05 61.04 1h92 n THR 48 Cb 1.06 1.00 0.01 0.00 -2.10 0.00 0.00 70.33 70.31 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 0.86 0.42 3.55 3.38 0.00 0.14 -5.04 105.19 108.51 1h92 n GLY 49 Ca 0.00 -0.50 -0.32 0.00 0.00 0.00 0.00 46.02 45.20 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 -5.02 2.42 0.01 1.61 -0.21 -1.13 -4.91 119.66 112.43 1h92 s GLN 50 Ca 0.11 -0.80 0.08 0.00 0.02 0.00 0.00 55.36 54.77 1h92 s GLN 50 Cb -0.05 -2.41 -0.02 0.00 1.00 0.00 0.00 33.01 31.53 1h92 s GLN 50 CO 0.13 0.58 -0.25 -2.00 -2.12 0.00 0.00 175.29 171.64 1h92 s GLU 51 N -1.42 1.92 -0.07 2.91 2.12 -1.26 0.11 118.70 123.01 1h92 s GLU 51 Ca 0.16 -0.97 -0.32 0.00 0.36 0.00 0.00 54.97 54.21 1h92 s GLU 51 Cb -0.11 -1.95 0.12 0.00 0.26 0.00 0.00 34.13 32.45 1h92 s GLU 51 CO 0.07 0.52 1.15 0.20 -0.54 0.00 0.00 175.26 176.66 1h92 s GLY 52 N -0.83 -0.35 0.43 -1.50 0.00 0.06 -4.83 107.32 100.30 1h92 s GLY 52 Ca 0.10 1.08 -0.23 0.00 0.00 0.00 0.00 44.72 45.67 1h92 s GLY 52 CO 0.00 0.32 1.06 -1.36 0.00 0.00 0.00 173.10 173.13 1h92 s PHE 53 N -2.64 3.13 -0.04 1.90 0.08 -0.75 -1.40 117.98 118.26 1h92 s PHE 53 Ca 0.10 1.61 -0.03 0.00 0.12 0.00 0.00 56.93 58.73 1h92 s PHE 53 Cb 0.01 -3.14 0.02 0.00 -0.57 0.00 0.00 43.02 39.33 1h92 s PHE 53 CO -0.04 -0.81 0.10 0.96 -0.10 0.00 0.00 175.22 175.32 1h92 s ILE 54 N -1.74 -0.01 0.83 0.64 -5.25 0.18 -1.49 121.20 114.36 1h92 s ILE 54 Ca 0.62 0.04 -0.13 0.00 -0.99 0.00 0.00 60.65 60.19 1h92 s ILE 54 Cb -0.21 -0.16 0.07 0.00 2.95 0.00 0.00 42.46 45.12 1h92 s ILE 54 CO 0.26 0.02 1.01 -0.81 -1.79 0.00 0.00 174.94 173.63 1h92 n PRO 55 N 3.28 0.03 0.00 0.37 -0.04 -1.26 -1.97 135.00 135.41 1h92 n PRO 55 Ca -0.15 0.08 0.13 0.00 -0.04 0.00 0.00 63.50 63.52 1h92 n PRO 55 Cb 0.58 -2.28 0.38 0.00 -0.04 0.00 0.00 33.50 32.14 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 -3.38 0.00 -0.05 0.54 -1.74 -1.25 -4.12 117.46 107.46 1h92 n PHE 56 Ca 0.12 0.00 -0.03 0.00 -0.56 0.00 0.00 57.45 56.98 1h92 n PHE 56 Cb 0.51 -0.02 -0.15 0.00 1.52 0.00 0.00 39.48 41.34 1h92 n PHE 56 CO 0.00 0.00 0.00 0.27 -0.56 0.00 0.00 176.76 176.47 1h92 n ASN 57 N 0.32 0.15 -0.46 5.98 6.94 -1.26 -4.20 115.26 122.74 1h92 n ASN 57 Ca 0.16 0.07 0.12 0.00 -0.02 0.00 0.00 54.58 54.91 1h92 n ASN 57 Cb 0.42 1.13 0.48 0.00 -2.36 0.00 0.00 39.78 39.44 1h92 n ASN 57 CO 0.00 0.00 0.00 0.49 -1.03 0.00 0.00 177.26 176.72 1h92 n PHE 58 N -2.64 0.10 -4.24 -2.53 3.72 -1.26 -4.85 117.46 105.76 1h92 n PHE 58 Ca -0.21 -0.05 -0.18 0.00 -0.05 0.00 0.00 57.45 56.96 1h92 n PHE 58 Cb 0.95 0.00 -0.13 0.00 -0.94 0.00 0.00 39.48 39.36 1h92 n PHE 58 CO 0.00 0.00 0.00 0.14 -0.05 0.00 0.00 176.76 176.85 1h92 s VAL 59 N -1.90 0.90 0.22 -4.37 -7.23 -1.26 0.17 120.40 106.93 1h92 s VAL 59 Ca 0.35 -0.97 0.01 0.00 -1.81 0.00 0.00 61.98 59.56 1h92 s VAL 59 Cb 0.19 -0.85 -0.05 0.00 0.56 0.00 0.00 36.38 36.23 1h92 s VAL 59 CO 0.30 -0.10 0.07 0.00 -0.31 0.00 0.00 175.10 175.06 1h92 s ALA 60 N -0.95 1.50 0.05 1.32 0.00 -1.00 -4.90 121.76 117.78 1h92 s ALA 60 Ca -0.02 -1.75 -0.30 0.00 0.00 0.00 0.00 51.96 49.89 1h92 s ALA 60 Cb -0.08 0.96 -0.05 0.00 0.00 0.00 0.00 23.12 23.95 1h92 s ALA 60 CO 0.01 -0.44 1.04 0.15 0.00 0.00 0.00 175.76 176.52 1h92 s LYS 61 N -4.02 4.56 0.21 0.00 1.02 -1.26 -1.71 119.74 118.53 1h92 s LYS 61 Ca 0.34 1.54 -0.01 0.00 0.02 0.00 0.00 55.97 57.85 1h92 s LYS 61 Cb 0.07 -3.40 -0.04 0.00 -0.52 0.00 0.00 37.83 33.94 1h92 s LYS 61 CO 0.10 -0.04 0.40 0.00 -0.92 0.00 0.00 175.35 174.90 1h92 s ALA 62 N 0.71 3.81 -2.23 5.17 0.00 -1.13 -4.86 121.76 123.25 1h92 s ALA 62 Ca 0.52 -0.80 0.30 0.00 0.00 0.00 0.00 51.96 51.99 1h92 s ALA 62 Cb -0.24 -2.03 1.52 0.00 0.00 0.00 0.00 23.12 22.37 1h92 s ALA 62 CO 0.29 0.43 2.01 0.09 0.00 0.00 0.00 175.76 178.58