#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 6.32 0.54 1.61 0.01 -1.26 -4.88 113.70 116.04 1h92 s SER 2 Ca 0.00 2.24 0.28 0.00 1.31 0.00 0.00 55.95 59.78 1h92 s SER 2 Cb 0.00 -2.60 1.45 0.00 0.21 0.00 0.00 66.02 65.08 1h92 s SER 2 CO 0.00 -0.81 1.95 1.55 0.41 0.00 0.00 173.24 176.35 1h92 h PRO 3 N 2.17 0.00 -6.45 12.44 0.13 -2.14 -3.40 132.00 134.75 1h92 h PRO 3 Ca -0.49 0.00 -0.54 0.00 -0.87 0.00 0.00 66.00 64.10 1h92 h PRO 3 Cb 1.24 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.34 1h92 h PRO 3 CO 0.61 0.00 -0.03 -0.51 -0.23 0.00 0.00 178.00 177.84 1h92 s LEU 4 N -8.42 4.26 -0.05 1.56 1.43 -1.26 -5.08 118.68 111.13 1h92 s LEU 4 Ca -0.05 1.14 0.05 0.00 -1.03 0.00 0.00 54.13 54.24 1h92 s LEU 4 Cb 0.19 -3.53 -0.02 0.00 0.03 0.00 0.00 46.19 42.86 1h92 s LEU 4 CO 0.71 0.01 -0.19 -1.10 0.23 0.00 0.00 176.35 176.00 1h92 s GLN 5 N -2.29 2.44 -0.08 1.70 -0.21 -1.26 -5.00 119.66 114.96 1h92 s GLN 5 Ca 0.43 -0.79 0.18 0.00 0.02 0.00 0.00 55.36 55.20 1h92 s GLN 5 Cb -0.14 -2.26 0.66 0.00 1.00 0.00 0.00 33.01 32.27 1h92 s GLN 5 CO 0.20 0.55 1.57 -0.25 -2.12 0.00 0.00 175.29 175.23 1h92 n ASP 6 N 2.51 4.39 -0.02 5.90 8.00 -1.26 -4.35 116.55 131.72 1h92 n ASP 6 Ca -0.17 -2.35 0.05 0.00 0.71 0.00 0.00 54.79 53.03 1h92 n ASP 6 Cb 0.52 -0.53 0.30 0.00 -0.02 0.00 0.00 41.12 41.39 1h92 n ASP 6 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1h92 n ASN 7 N 1.07 0.06 -4.78 -2.24 5.03 -1.26 -4.82 115.26 108.31 1h92 n ASN 7 Ca 0.24 -1.69 -0.39 0.00 0.87 0.00 0.00 54.58 53.61 1h92 n ASN 7 Cb 0.80 -0.01 -0.06 0.00 -1.02 0.00 0.00 39.78 39.49 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 -1.32 4.54 0.25 3.41 1.02 -1.26 -0.83 118.68 124.49 1h92 s LEU 8 Ca 0.16 1.61 -0.12 0.00 0.02 0.00 0.00 54.13 55.80 1h92 s LEU 8 Cb 0.07 -3.37 -0.01 0.00 0.02 0.00 0.00 46.19 42.91 1h92 s LEU 8 CO 0.12 0.17 0.45 0.68 0.02 0.00 0.00 176.35 177.79 1h92 s VAL 9 N -1.23 0.00 0.08 -1.59 -7.23 -0.83 -4.00 120.40 105.60 1h92 s VAL 9 Ca 0.37 -1.46 0.06 0.00 -1.81 0.00 0.00 61.98 59.15 1h92 s VAL 9 Cb -0.22 -2.24 -0.04 0.00 0.56 0.00 0.00 36.38 34.44 1h92 s VAL 9 CO 0.25 0.00 -0.09 -0.63 -0.31 0.00 0.00 175.10 174.32 1h92 s ILE 10 N -4.00 3.46 -0.43 -0.62 1.01 -1.24 -1.58 121.20 117.80 1h92 s ILE 10 Ca 0.24 -1.15 -0.29 0.00 0.00 0.00 0.00 60.65 59.45 1h92 s ILE 10 Cb -0.00 -2.59 0.03 0.00 0.01 0.00 0.00 42.46 39.90 1h92 s ILE 10 CO 0.09 0.17 1.11 0.00 0.00 0.00 0.00 174.94 176.32 1h92 s ALA 11 N -1.17 3.26 0.08 9.38 0.00 0.18 -3.66 121.76 129.83 1h92 s ALA 11 Ca 0.21 -0.35 0.27 0.00 0.00 0.00 0.00 51.96 52.08 1h92 s ALA 11 Cb -0.11 -3.82 1.02 0.00 0.00 0.00 0.00 23.12 20.21 1h92 s ALA 11 CO 0.13 -2.02 1.86 -0.07 0.00 0.00 0.00 175.76 175.66 1h92 h LEU 12 N 10.87 0.00 -7.32 0.00 -0.00 -0.79 1.18 115.31 119.25 1h92 h LEU 12 Ca -0.22 0.00 -0.09 0.00 -0.00 0.00 0.00 57.88 57.57 1h92 h LEU 12 Cb 1.06 0.00 -0.19 0.00 -0.00 0.00 0.00 40.66 41.53 1h92 h LEU 12 CO 1.10 0.14 -0.09 -1.00 -0.00 0.00 0.00 178.44 178.59 1h92 s HIS 13 N -3.62 -0.35 0.40 1.13 3.76 -1.25 -4.71 115.29 110.65 1h92 s HIS 13 Ca 0.01 0.52 -0.26 0.00 -0.15 0.00 0.00 55.06 55.18 1h92 s HIS 13 Cb 0.09 0.22 -0.09 0.00 1.11 0.00 0.00 32.58 33.92 1h92 s HIS 13 CO 0.61 -0.50 1.26 -1.54 -0.85 0.00 0.00 174.74 173.72 1h92 s SER 14 N -1.45 6.41 0.26 1.40 1.04 -1.26 -4.37 113.70 115.73 1h92 s SER 14 Ca -0.11 2.56 0.04 0.00 0.48 0.00 0.00 55.95 58.93 1h92 s SER 14 Cb -0.03 -2.63 -0.03 0.00 0.10 0.00 0.00 66.02 63.43 1h92 s SER 14 CO 0.04 -0.77 0.39 -0.47 0.98 0.00 0.00 173.24 173.42 1h92 s TYR 15 N -1.29 3.45 -0.22 5.02 5.04 0.91 -4.92 117.35 125.33 1h92 s TYR 15 Ca 0.56 0.03 -0.08 0.00 -2.44 0.00 0.00 57.07 55.15 1h92 s TYR 15 Cb -0.36 -1.64 -0.04 0.00 0.35 0.00 0.00 41.96 40.28 1h92 s TYR 15 CO 0.46 0.37 0.07 -1.21 -1.34 0.00 0.00 175.55 173.91 1h92 s GLU 16 N -4.04 3.81 -1.21 4.97 0.41 -1.26 -4.17 118.70 117.21 1h92 s GLU 16 Ca 0.35 -0.41 -0.19 0.00 -0.41 0.00 0.00 54.97 54.31 1h92 s GLU 16 Cb -0.09 -3.30 0.07 0.00 -1.78 0.00 0.00 34.13 29.04 1h92 s GLU 16 CO 0.30 0.01 1.62 -1.25 -0.49 0.00 0.00 175.26 175.46 1h92 s PRO 17 N 1.08 3.89 0.00 0.39 0.04 -1.26 -4.74 135.00 134.40 1h92 s PRO 17 Ca 0.04 -1.82 0.31 0.00 0.04 0.00 0.00 61.00 59.58 1h92 s PRO 17 Cb -0.14 -5.44 1.73 0.00 0.04 0.00 0.00 34.50 30.69 1h92 s PRO 17 CO 0.03 -2.19 2.15 -1.13 0.04 0.00 0.00 177.00 175.90 1h92 n SER 18 N 8.25 0.00 0.00 6.66 3.41 -1.26 -4.85 113.62 125.83 1h92 n SER 18 Ca 0.43 -0.59 0.00 0.00 -0.26 0.00 0.00 58.87 58.45 1h92 n SER 18 Cb 0.47 -0.14 0.00 0.00 -0.26 0.00 0.00 64.21 64.28 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 -1.14 0.00 0.05 7.33 8.25 -1.26 -5.07 115.22 123.39 1h92 n HIS 19 Ca 0.19 0.00 0.07 0.00 -0.26 0.00 0.00 57.72 57.72 1h92 n HIS 19 Cb 0.17 0.00 -0.10 0.00 1.12 0.00 0.00 29.99 31.18 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 0.00 1.81 -0.69 0.41 8.00 -1.26 -4.45 116.55 120.37 1h92 n ASP 20 Ca 0.00 -0.07 0.06 0.00 0.71 0.00 0.00 54.79 55.49 1h92 n ASP 20 Cb 0.00 1.56 0.17 0.00 -0.02 0.00 0.00 41.12 42.83 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 1.70 2.81 3.90 0.44 0.00 -1.26 -5.00 105.19 107.79 1h92 n GLY 21 Ca -0.02 -0.43 -0.28 0.00 0.00 0.00 0.00 46.02 45.29 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 -1.04 6.43 -0.26 1.61 1.11 -1.26 -2.18 116.67 121.08 1h92 s ASP 22 Ca 0.25 0.84 -0.04 0.00 0.18 0.00 0.00 52.55 53.79 1h92 s ASP 22 Cb 0.14 -2.20 0.01 0.00 1.07 0.00 0.00 42.92 41.94 1h92 s ASP 22 CO 0.16 -0.32 -0.00 -0.22 1.18 0.00 0.00 175.17 175.97 1h92 s LEU 23 N -3.88 3.37 -0.69 1.23 2.96 -1.03 -4.69 118.68 115.96 1h92 s LEU 23 Ca 0.46 -0.68 -0.02 0.00 -0.22 0.00 0.00 54.13 53.67 1h92 s LEU 23 Cb -0.10 -1.77 0.29 0.00 0.50 0.00 0.00 46.19 45.11 1h92 s LEU 23 CO 0.33 -0.12 2.21 0.61 -1.32 0.00 0.00 176.35 178.06 1h92 n GLY 24 N 4.78 5.21 3.11 7.98 0.00 -1.26 -4.59 105.19 120.41 1h92 n GLY 24 Ca -0.16 -2.22 -0.27 0.00 0.00 0.00 0.00 46.02 43.37 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 -1.71 -3.85 1.61 -1.74 -1.26 -3.88 117.46 106.43 1h92 n PHE 25 Ca 0.53 0.21 -0.26 0.00 -0.56 0.00 0.00 57.45 57.37 1h92 n PHE 25 Cb 0.40 -1.45 -0.00 0.00 1.52 0.00 0.00 39.48 39.95 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 -3.11 2.25 0.25 3.97 2.02 -1.26 -0.07 118.70 122.75 1h92 s GLU 26 Ca 0.43 -2.02 -0.30 0.00 0.02 0.00 0.00 54.97 53.10 1h92 s GLU 26 Cb -0.05 -2.12 -0.09 0.00 0.10 0.00 0.00 34.13 31.97 1h92 s GLU 26 CO 0.52 -0.66 1.32 0.21 0.02 0.00 0.00 175.26 176.67 1h92 s LYS 27 N -4.31 4.38 0.00 1.61 2.20 -1.26 -2.20 119.74 120.16 1h92 s LYS 27 Ca 0.35 2.13 0.00 0.00 -0.36 0.00 0.00 55.97 58.08 1h92 s LYS 27 Cb -0.02 -3.14 0.00 0.00 -1.51 0.00 0.00 37.83 33.15 1h92 s LYS 27 CO 0.22 -0.23 0.00 0.41 -0.36 0.00 0.00 175.35 175.39 1h92 n GLY 28 N 1.82 2.46 3.68 5.54 0.00 0.41 -4.94 105.19 114.16 1h92 n GLY 28 Ca 0.04 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.64 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 -0.37 4.17 0.16 1.61 2.02 -0.93 -4.44 118.70 120.92 1h92 s GLU 29 Ca 0.00 2.44 -0.30 0.00 0.02 0.00 0.00 54.97 57.13 1h92 s GLU 29 Cb 0.00 -3.70 -0.07 0.00 0.10 0.00 0.00 34.13 30.46 1h92 s GLU 29 CO 0.00 -0.81 0.96 -0.65 0.02 0.00 0.00 175.26 174.78 1h92 s GLN 30 N 3.01 4.75 0.07 1.61 -0.21 -1.26 -0.64 119.66 126.99 1h92 s GLN 30 Ca 0.78 1.48 0.01 0.00 0.02 0.00 0.00 55.36 57.65 1h92 s GLN 30 Cb -0.42 -3.34 -0.04 0.00 1.00 0.00 0.00 33.01 30.22 1h92 s GLN 30 CO 0.35 0.32 -0.05 -0.51 -2.12 0.00 0.00 175.29 173.27 1h92 s LEU 31 N -0.45 2.46 -0.12 2.90 1.43 -0.62 -2.90 118.68 121.38 1h92 s LEU 31 Ca 0.45 -0.93 -0.03 0.00 -1.03 0.00 0.00 54.13 52.59 1h92 s LEU 31 Cb -0.25 0.04 -0.03 0.00 0.03 0.00 0.00 46.19 45.98 1h92 s LEU 31 CO 0.31 -0.49 -0.02 -0.13 0.23 0.00 0.00 176.35 176.25 1h92 s ARG 32 N -3.52 3.37 -0.80 1.70 0.52 0.55 -1.96 118.95 118.80 1h92 s ARG 32 Ca 0.06 -0.47 -0.19 0.00 -0.52 0.00 0.00 55.73 54.61 1h92 s ARG 32 Cb 0.04 -2.86 0.12 0.00 0.52 0.00 0.00 34.95 32.77 1h92 s ARG 32 CO -0.06 0.44 0.99 0.42 0.02 0.00 0.00 175.30 177.12 1h92 s ILE 33 N -0.18 4.72 0.12 1.52 -1.09 -0.01 -0.65 121.20 125.63 1h92 s ILE 33 Ca 0.04 -1.27 0.08 0.00 -2.23 0.00 0.00 60.65 57.27 1h92 s ILE 33 Cb -0.13 -4.69 -0.18 0.00 -1.58 0.00 0.00 42.46 35.88 1h92 s ILE 33 CO 0.02 -1.40 1.31 -0.07 -1.23 0.00 0.00 174.94 173.58 1h92 h LEU 34 N 10.36 0.00 -8.30 2.97 3.38 -1.40 -3.46 115.31 118.86 1h92 h LEU 34 Ca -0.02 0.00 -0.46 0.00 0.09 0.00 0.00 57.88 57.48 1h92 h LEU 34 Cb 1.05 0.00 -0.26 0.00 0.09 0.00 0.00 40.66 41.54 1h92 h LEU 34 CO 1.10 0.95 -0.80 -1.61 0.09 0.00 0.00 178.44 178.16 1h92 s GLU 35 N -2.79 1.02 -0.37 1.13 2.02 -0.72 -4.95 118.70 114.04 1h92 s GLU 35 Ca 0.01 -0.69 0.14 0.00 0.02 0.00 0.00 54.97 54.45 1h92 s GLU 35 Cb 0.10 -1.02 0.39 0.00 0.10 0.00 0.00 34.13 33.71 1h92 s GLU 35 CO 0.81 0.26 0.84 0.00 0.02 0.00 0.00 175.26 177.19 1h92 n GLN 36 N 2.15 1.26 -5.08 1.61 10.64 -1.26 -2.11 117.38 124.60 1h92 n GLN 36 Ca -0.17 -3.46 -0.30 0.00 -1.83 0.00 0.00 57.00 51.24 1h92 n GLN 36 Cb 0.55 -1.59 -0.15 0.00 -0.86 0.00 0.00 30.24 28.19 1h92 n GLN 36 CO 0.00 0.00 0.00 0.45 -1.83 0.00 0.00 177.06 175.68 1h92 s SER 37 N -2.79 3.01 0.14 2.61 0.15 -1.26 -5.03 113.70 110.52 1h92 s SER 37 Ca 0.36 -0.51 0.00 0.00 0.70 0.00 0.00 55.95 56.50 1h92 s SER 37 Cb 0.39 -0.30 0.00 0.00 -1.71 0.00 0.00 66.02 64.39 1h92 s SER 37 CO -0.04 0.28 0.00 0.61 1.20 0.00 0.00 173.24 175.29 1h92 n GLY 38 N 2.15 -2.04 0.18 9.45 0.00 -1.26 -4.14 105.19 109.52 1h92 n GLY 38 Ca -0.16 -1.40 0.03 0.00 0.00 0.00 0.00 46.02 44.49 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 0.00 -5.86 1.61 5.08 -2.01 -3.43 114.58 109.97 1h92 h GLU 39 Ca 0.00 0.00 -0.63 0.00 -1.00 0.00 0.00 59.36 57.73 1h92 h GLU 39 Cb 0.19 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.39 1h92 h GLU 39 CO 0.00 0.44 -0.50 -1.58 -1.00 0.00 0.00 179.01 176.37 1h92 s TRP 40 N -3.79 3.52 0.18 4.33 0.52 -1.26 -4.00 118.94 118.44 1h92 s TRP 40 Ca -0.01 0.31 0.09 0.00 0.02 0.00 0.00 56.10 56.50 1h92 s TRP 40 Cb 0.13 -1.80 -0.04 0.00 -1.15 0.00 0.00 33.47 30.61 1h92 s TRP 40 CO 0.71 0.62 -0.18 -1.58 0.02 0.00 0.00 176.95 176.54 1h92 s TRP 41 N -1.39 1.90 -0.01 -1.98 0.51 -0.81 -4.17 118.94 113.00 1h92 s TRP 41 Ca 0.30 -0.46 -0.04 0.00 -2.12 0.00 0.00 56.10 53.78 1h92 s TRP 41 Cb -0.13 -0.92 -0.04 0.00 -0.81 0.00 0.00 33.47 31.57 1h92 s TRP 41 CO 0.22 0.39 0.22 0.21 -0.51 0.00 0.00 176.95 177.47 1h92 s LYS 42 N -2.96 3.50 0.29 4.98 2.20 -0.89 0.11 119.74 126.97 1h92 s LYS 42 Ca 0.18 -0.21 -0.09 0.00 -0.36 0.00 0.00 55.97 55.49 1h92 s LYS 42 Cb -0.05 -3.09 0.04 0.00 -1.51 0.00 0.00 37.83 33.22 1h92 s LYS 42 CO 0.08 0.67 0.55 0.00 -0.36 0.00 0.00 175.35 176.29 1h92 n ALA 43 N 1.06 -1.15 -2.90 3.13 0.00 -0.83 -1.02 120.51 118.80 1h92 n ALA 43 Ca -0.11 -0.99 -0.10 0.00 0.00 0.00 0.00 53.44 52.24 1h92 n ALA 43 Cb 0.53 0.79 -0.09 0.00 0.00 0.00 0.00 19.45 20.67 1h92 n ALA 43 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.50 176.36 1h92 s GLN 44 N -2.15 0.56 -0.20 0.00 0.74 0.18 -1.48 119.66 117.30 1h92 s GLN 44 Ca 0.13 -0.60 -0.08 0.00 0.05 0.00 0.00 55.36 54.86 1h92 s GLN 44 Cb -0.03 0.22 -0.04 0.00 1.10 0.00 0.00 33.01 34.26 1h92 s GLN 44 CO 0.10 -0.14 0.09 0.45 -0.55 0.00 0.00 175.29 175.24 1h92 s SER 45 N -1.83 5.75 0.00 6.67 0.15 0.21 0.20 113.70 124.86 1h92 s SER 45 Ca -0.09 0.08 0.08 0.00 0.70 0.00 0.00 55.95 56.72 1h92 s SER 45 Cb -0.04 -2.00 0.36 0.00 -1.71 0.00 0.00 66.02 62.63 1h92 s SER 45 CO -0.02 0.14 1.25 0.18 1.20 0.00 0.00 173.24 175.99 1h92 n LEU 46 N 3.80 0.61 -0.11 3.45 4.77 -1.14 -1.30 117.00 127.07 1h92 n LEU 46 Ca -0.16 -0.29 -0.21 0.00 -0.03 0.00 0.00 56.01 55.32 1h92 n LEU 46 Cb 0.52 -0.07 -0.12 0.00 -2.33 0.00 0.00 43.42 41.43 1h92 n LEU 46 CO 0.35 0.15 -1.28 0.35 -1.33 0.00 0.00 177.39 175.63 1h92 n THR 47 N -0.23 1.54 0.32 -5.08 -2.24 -1.26 -4.61 114.28 102.71 1h92 n THR 47 Ca 0.07 -0.53 0.04 0.00 -2.27 0.00 0.00 64.05 61.35 1h92 n THR 47 Cb 0.11 -1.56 -0.04 0.00 -2.10 0.00 0.00 70.33 66.74 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 -3.50 0.00 -2.75 4.28 -2.24 -1.24 -5.00 114.28 103.83 1h92 n THR 48 Ca -0.45 -0.31 -0.07 0.00 -2.27 0.00 0.00 64.05 60.94 1h92 n THR 48 Cb 0.97 0.95 0.02 0.00 -2.10 0.00 0.00 70.33 70.17 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 1.24 0.47 3.54 3.38 0.00 -0.42 -5.04 105.19 108.37 1h92 n GLY 49 Ca 0.01 -0.43 -0.32 0.00 0.00 0.00 0.00 46.02 45.28 1h92 n GLY 49 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1h92 s GLN 50 N -5.27 2.49 -0.06 1.61 0.74 -1.22 -4.91 119.66 113.04 1h92 s GLN 50 Ca 0.16 -0.73 0.05 0.00 0.05 0.00 0.00 55.36 54.89 1h92 s GLN 50 Cb -0.07 -2.43 -0.02 0.00 1.10 0.00 0.00 33.01 31.60 1h92 s GLN 50 CO 0.19 0.61 -0.21 -2.00 -0.55 0.00 0.00 175.29 173.33 1h92 s GLU 51 N -1.13 2.56 -0.02 1.67 2.12 -1.26 -0.62 118.70 122.02 1h92 s GLU 51 Ca 0.14 -0.83 -0.30 0.00 0.36 0.00 0.00 54.97 54.34 1h92 s GLU 51 Cb -0.11 -2.25 0.11 0.00 0.26 0.00 0.00 34.13 32.14 1h92 s GLU 51 CO 0.04 0.45 1.10 0.20 -0.54 0.00 0.00 175.26 176.51 1h92 s GLY 52 N -0.32 -0.35 0.42 -1.50 0.00 -0.55 -4.78 107.32 100.24 1h92 s GLY 52 Ca 0.02 0.86 -0.24 0.00 0.00 0.00 0.00 44.72 45.36 1h92 s GLY 52 CO 0.02 0.25 1.15 -1.36 0.00 0.00 0.00 173.10 173.15 1h92 s PHE 53 N -2.79 3.03 -0.00 1.90 0.08 -0.92 -1.96 117.98 117.32 1h92 s PHE 53 Ca 0.10 1.56 0.01 0.00 0.12 0.00 0.00 56.93 58.73 1h92 s PHE 53 Cb 0.01 -3.34 -0.00 0.00 -0.57 0.00 0.00 43.02 39.11 1h92 s PHE 53 CO -0.04 -1.26 -0.04 0.96 -0.10 0.00 0.00 175.22 174.74 1h92 s ILE 54 N -1.51 0.34 0.59 0.64 -5.25 0.31 -2.45 121.20 113.86 1h92 s ILE 54 Ca 0.60 -0.19 -0.19 0.00 -0.99 0.00 0.00 60.65 59.88 1h92 s ILE 54 Cb -0.28 -0.29 -0.04 0.00 2.95 0.00 0.00 42.46 44.80 1h92 s ILE 54 CO 0.35 0.09 1.21 -2.16 -1.79 0.00 0.00 174.94 172.65 1h92 s PRO 55 N -0.11 3.00 0.00 0.37 0.04 -1.26 -1.92 135.00 135.12 1h92 s PRO 55 Ca 0.02 1.85 0.24 0.00 0.04 0.00 0.00 61.00 63.14 1h92 s PRO 55 Cb -0.02 -1.96 1.21 0.00 0.04 0.00 0.00 34.50 33.77 1h92 s PRO 55 CO -0.00 -1.19 1.78 1.97 0.04 0.00 0.00 177.00 179.60 1h92 n PHE 56 N -1.53 0.00 -0.02 0.56 -1.74 -1.26 -3.17 117.46 110.31 1h92 n PHE 56 Ca 0.13 0.00 -0.01 0.00 -0.56 0.00 0.00 57.45 57.02 1h92 n PHE 56 Cb 0.49 -0.27 -0.13 0.00 1.52 0.00 0.00 39.48 41.09 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 -1.27 0.40 -0.11 5.98 5.15 -1.26 -4.06 115.26 120.09 1h92 n ASN 57 Ca 0.12 0.18 0.15 0.00 -0.60 0.00 0.00 54.58 54.42 1h92 n ASN 57 Cb 0.18 0.84 0.83 0.00 -0.53 0.00 0.00 39.78 41.11 1h92 n ASN 57 CO 0.00 0.00 0.00 0.49 1.40 0.00 0.00 177.26 179.15 1h92 n PHE 58 N -2.70 0.00 -3.97 1.20 3.01 -1.19 -4.82 117.46 108.99 1h92 n PHE 58 Ca -0.16 -0.00 -0.09 0.00 1.01 0.00 0.00 57.45 58.21 1h92 n PHE 58 Cb 0.88 0.00 -0.10 0.00 -0.01 0.00 0.00 39.48 40.25 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 -2.00 0.14 0.07 -4.37 -7.23 -1.25 -0.06 120.40 105.70 1h92 s VAL 59 Ca 0.45 -1.16 -0.11 0.00 -1.81 0.00 0.00 61.98 59.35 1h92 s VAL 59 Cb 0.21 -0.80 0.01 0.00 0.56 0.00 0.00 36.38 36.36 1h92 s VAL 59 CO 0.35 -0.64 0.25 0.00 -0.31 0.00 0.00 175.10 174.76 1h92 s ALA 60 N -2.45 -0.48 -0.00 1.32 0.00 -1.24 -4.88 121.76 114.02 1h92 s ALA 60 Ca -0.06 -0.29 -0.30 0.00 0.00 0.00 0.00 51.96 51.30 1h92 s ALA 60 Cb -0.02 0.43 -0.06 0.00 0.00 0.00 0.00 23.12 23.46 1h92 s ALA 60 CO -0.04 -0.47 1.55 0.15 0.00 0.00 0.00 175.76 176.95 1h92 s LYS 61 N -3.22 4.22 0.51 0.00 1.02 -1.26 -3.70 119.74 117.30 1h92 s LYS 61 Ca -0.00 2.13 0.17 0.00 0.02 0.00 0.00 55.97 58.29 1h92 s LYS 61 Cb 0.02 -3.72 1.27 0.00 -0.52 0.00 0.00 37.83 34.87 1h92 s LYS 61 CO -0.08 -0.71 2.13 0.00 -0.92 0.00 0.00 175.35 175.77 1h92 h ALA 62 N 8.54 1.89 -0.00 5.17 0.00 -1.91 -3.49 119.26 129.45 1h92 h ALA 62 Ca -0.39 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.48 1h92 h ALA 62 Cb 1.18 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.97 1h92 h ALA 62 CO 0.93 0.05 0.00 -1.71 0.00 0.00 0.00 179.25 178.52