#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dl3 s SER 2 N 0.00 0.01 -0.73 1.61 0.01 -1.26 -5.04 113.70 108.30 2dl3 s SER 2 Ca 0.00 0.09 -0.02 0.00 1.31 0.00 0.00 55.95 57.33 2dl3 s SER 2 Cb 0.00 0.01 0.41 0.00 0.21 0.00 0.00 66.02 66.65 2dl3 s SER 2 CO 0.00 -0.10 2.03 -1.54 0.41 0.00 0.00 173.24 174.04 2dl3 n SER 3 N 3.89 7.63 0.00 2.44 3.41 -1.26 -4.94 113.62 124.79 2dl3 n SER 3 Ca -0.24 -3.81 0.00 0.00 -0.26 0.00 0.00 58.87 54.57 2dl3 n SER 3 Cb 0.53 -1.01 0.00 0.00 -0.26 0.00 0.00 64.21 63.47 2dl3 n SER 3 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2dl3 n GLY 4 N -0.78 0.46 3.88 5.00 0.00 -1.26 -5.03 105.19 107.46 2dl3 n GLY 4 Ca 0.59 -0.44 -0.25 0.00 0.00 0.00 0.00 46.02 45.93 2dl3 n GLY 4 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2dl3 n SER 5 N 0.00 -1.19 -4.15 1.61 7.64 -1.26 -4.98 113.62 111.29 2dl3 n SER 5 Ca 0.00 -0.92 -0.22 0.00 1.01 0.00 0.00 58.87 58.74 2dl3 n SER 5 Cb 0.00 -3.45 -0.14 0.00 -1.01 0.00 0.00 64.21 59.61 2dl3 n SER 5 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2dl3 s SER 6 N -4.20 1.80 0.00 6.43 0.15 -1.26 -5.11 113.70 111.50 2dl3 s SER 6 Ca 0.11 -0.39 0.00 0.00 0.70 0.00 0.00 55.95 56.37 2dl3 s SER 6 Cb -0.06 -0.15 0.00 0.00 -1.71 0.00 0.00 66.02 64.10 2dl3 s SER 6 CO 0.86 0.11 0.00 0.61 1.20 0.00 0.00 173.24 176.02 2dl3 n GLY 7 N 2.21 5.57 3.42 9.45 0.00 -1.25 -4.47 105.19 120.11 2dl3 n GLY 7 Ca -0.16 -1.46 -0.31 0.00 0.00 0.00 0.00 46.02 44.08 2dl3 n GLY 7 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2dl3 s ARG 8 N 1.22 2.08 -0.03 1.61 0.52 0.86 -4.70 118.95 120.50 2dl3 s ARG 8 Ca 0.00 -0.96 -0.30 0.00 -0.52 0.00 0.00 55.73 53.95 2dl3 s ARG 8 Cb 0.00 -2.15 -0.05 0.00 0.52 0.00 0.00 34.95 33.26 2dl3 s ARG 8 CO 0.00 0.55 1.47 -1.25 0.02 0.00 0.00 175.30 176.09 2dl3 s PRO 9 N -1.20 4.24 0.02 3.54 0.04 -1.26 -1.23 135.00 139.15 2dl3 s PRO 9 Ca 0.13 2.02 0.01 0.00 0.04 0.00 0.00 61.00 63.20 2dl3 s PRO 9 Cb -0.10 -3.71 -0.02 0.00 0.04 0.00 0.00 34.50 30.72 2dl3 s PRO 9 CO 0.03 -0.68 -0.05 0.00 0.04 0.00 0.00 177.00 176.34 2dl3 s ALA 10 N 2.98 0.36 -0.11 8.56 0.00 -0.78 -2.89 121.76 129.88 2dl3 s ALA 10 Ca 0.66 -0.50 0.01 0.00 0.00 0.00 0.00 51.96 52.12 2dl3 s ALA 10 Cb -0.31 0.03 -0.02 0.00 0.00 0.00 0.00 23.12 22.82 2dl3 s ALA 10 CO 0.26 -0.02 -0.13 0.50 0.00 0.00 0.00 175.76 176.37 2dl3 s ARG 11 N -1.03 3.17 -0.42 0.00 3.52 -0.08 -1.71 118.95 122.40 2dl3 s ARG 11 Ca -0.08 -0.68 -0.29 0.00 -0.13 0.00 0.00 55.73 54.56 2dl3 s ARG 11 Cb -0.07 -2.58 0.02 0.00 -1.56 0.00 0.00 34.95 30.76 2dl3 s ARG 11 CO -0.00 0.33 1.14 0.00 -0.81 0.00 0.00 175.30 175.96 2dl3 s ALA 12 N 0.05 3.26 0.23 6.12 0.00 -0.73 0.30 121.76 130.99 2dl3 s ALA 12 Ca -0.05 -0.31 -0.01 0.00 0.00 0.00 0.00 51.96 51.60 2dl3 s ALA 12 Cb -0.14 -3.83 0.24 0.00 0.00 0.00 0.00 23.12 19.39 2dl3 s ALA 12 CO 0.04 -2.01 1.61 0.87 0.00 0.00 0.00 175.76 176.27 2dl3 h LYS 13 N 8.95 0.55 -4.94 0.00 1.79 0.80 0.17 116.57 123.88 2dl3 h LYS 13 Ca -0.23 -0.27 -0.38 0.00 -2.18 0.00 0.00 60.65 57.60 2dl3 h LYS 13 Cb 1.06 0.00 -0.14 0.00 -1.58 0.00 0.00 32.23 31.57 2dl3 h LYS 13 CO 1.09 0.85 -0.60 -0.06 -1.08 0.00 0.00 179.45 179.65 2dl3 s PHE 14 N -4.26 1.61 -0.34 -1.35 0.40 -0.98 -4.71 117.98 108.34 2dl3 s PHE 14 Ca -0.07 -1.17 -0.24 0.00 -0.60 0.00 0.00 56.93 54.84 2dl3 s PHE 14 Cb 0.12 -0.95 0.01 0.00 0.51 0.00 0.00 43.02 42.71 2dl3 s PHE 14 CO 0.82 -0.31 0.84 0.16 0.70 0.00 0.00 175.22 177.43 2dl3 s ASP 15 N -3.35 6.65 0.30 1.36 -4.77 -1.26 -3.83 116.67 111.76 2dl3 s ASP 15 Ca 0.37 0.57 -0.04 0.00 -3.30 0.00 0.00 52.55 50.15 2dl3 s ASP 15 Cb 0.08 -2.43 -0.05 0.00 -1.09 0.00 0.00 42.92 39.43 2dl3 s ASP 15 CO 0.14 -0.73 0.56 0.12 0.70 0.00 0.00 175.17 175.95 2dl3 s PHE 16 N 3.19 3.48 -0.26 2.11 5.36 -0.51 -4.92 117.98 126.43 2dl3 s PHE 16 Ca 0.34 0.59 0.01 0.00 -0.96 0.00 0.00 56.93 56.92 2dl3 s PHE 16 Cb -0.13 -2.07 0.07 0.00 -0.34 0.00 0.00 43.02 40.55 2dl3 s PHE 16 CO 0.16 0.15 -0.03 0.21 -1.46 0.00 0.00 175.22 174.25 2dl3 s LYS 17 N -3.70 1.62 -0.27 10.12 2.47 -1.26 -2.83 119.74 125.89 2dl3 s LYS 17 Ca 0.43 -1.20 -0.29 0.00 -1.56 0.00 0.00 55.97 53.35 2dl3 s LYS 17 Cb -0.11 -2.68 0.01 0.00 -1.46 0.00 0.00 37.83 33.59 2dl3 s LYS 17 CO 0.31 -0.68 1.13 0.00 0.16 0.00 0.00 175.35 176.27 2dl3 s ALA 18 N 1.29 3.56 0.12 3.13 0.00 -1.26 -4.92 121.76 123.67 2dl3 s ALA 18 Ca -0.02 0.12 -0.14 0.00 0.00 0.00 0.00 51.96 51.92 2dl3 s ALA 18 Cb -0.19 -3.64 -0.06 0.00 0.00 0.00 0.00 23.12 19.23 2dl3 s ALA 18 CO -0.08 -1.35 1.46 1.96 0.00 0.00 0.00 175.76 177.75 2dl3 h GLN 19 N 8.09 0.78 -4.43 0.00 1.08 -1.97 -3.47 115.11 115.19 2dl3 h GLN 19 Ca -0.22 -0.38 -0.24 0.00 -1.45 0.00 0.00 58.65 56.36 2dl3 h GLN 19 Cb 1.07 -0.00 -0.13 0.00 -0.05 0.00 0.00 27.48 28.37 2dl3 h GLN 19 CO 1.01 1.01 -0.48 0.95 -0.95 0.00 0.00 178.83 180.36 2dl3 s THR 20 N -4.47 0.00 0.28 -0.54 -4.23 -1.26 -5.04 115.64 100.38 2dl3 s THR 20 Ca -0.12 -1.87 -0.03 0.00 -1.18 0.00 0.00 61.69 58.50 2dl3 s THR 20 Cb 0.10 -2.46 0.37 0.00 1.34 0.00 0.00 72.50 71.85 2dl3 s THR 20 CO 0.84 0.00 1.59 -0.07 -0.54 0.00 0.00 174.62 176.44 2dl3 h LEU 21 N 2.46 -0.49 -0.90 4.79 3.38 -1.95 0.17 115.31 122.78 2dl3 h LEU 21 Ca -0.32 0.25 0.21 0.00 0.09 0.00 0.00 57.88 58.11 2dl3 h LEU 21 Cb 1.25 0.45 -0.17 0.00 0.09 0.00 0.00 40.66 42.28 2dl3 h LEU 21 CO 0.47 -0.28 -0.10 1.17 0.09 0.00 0.00 178.44 179.79 2dl3 n LYS 22 N -5.45 -0.08 -3.60 1.13 0.00 -1.26 -4.35 118.16 104.55 2dl3 n LYS 22 Ca 0.19 1.37 -0.24 0.00 0.00 0.00 0.00 58.31 59.62 2dl3 n LYS 22 Cb 0.62 -2.11 -0.02 0.00 0.00 0.00 0.00 35.03 33.51 2dl3 n LYS 22 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.40 176.19 2dl3 s GLU 23 N -5.99 3.49 -0.08 1.64 2.02 0.61 -0.71 118.70 119.68 2dl3 s GLU 23 Ca -0.12 -0.41 0.04 0.00 0.02 0.00 0.00 54.97 54.50 2dl3 s GLU 23 Cb 0.25 -2.76 -0.00 0.00 0.10 0.00 0.00 34.13 31.72 2dl3 s GLU 23 CO 0.70 0.29 -0.22 -1.17 0.02 0.00 0.00 175.26 174.87 2dl3 s LEU 24 N -3.92 2.02 0.32 1.80 2.96 0.06 -4.56 118.68 117.36 2dl3 s LEU 24 Ca 0.38 -0.50 -0.29 0.00 -0.22 0.00 0.00 54.13 53.51 2dl3 s LEU 24 Cb -0.10 -1.30 -0.10 0.00 0.50 0.00 0.00 46.19 45.20 2dl3 s LEU 24 CO 0.32 0.17 1.22 -2.16 -1.32 0.00 0.00 176.35 174.58 2dl3 s PRO 25 N 0.22 4.42 0.27 0.98 0.04 -1.26 -4.53 135.00 135.15 2dl3 s PRO 25 Ca -0.13 2.04 0.07 0.00 0.04 0.00 0.00 61.00 63.01 2dl3 s PRO 25 Cb -0.16 -3.07 -0.06 0.00 0.04 0.00 0.00 34.50 31.25 2dl3 s PRO 25 CO 0.06 -0.06 -0.08 -0.51 0.04 0.00 0.00 177.00 176.46 2dl3 s LEU 26 N -1.75 2.50 0.00 -3.56 1.43 -1.13 -4.93 118.68 111.24 2dl3 s LEU 26 Ca 0.48 -1.16 -0.00 0.00 -1.03 0.00 0.00 54.13 52.42 2dl3 s LEU 26 Cb -0.36 -0.67 -0.00 0.00 0.03 0.00 0.00 46.19 45.19 2dl3 s LEU 26 CO 0.47 -0.30 0.00 -1.10 0.23 0.00 0.00 176.35 175.66 2dl3 s GLN 27 N -3.71 0.08 -0.31 1.70 -0.21 -1.26 -1.42 119.66 114.53 2dl3 s GLN 27 Ca 0.29 -0.12 -0.40 0.00 0.02 0.00 0.00 55.36 55.15 2dl3 s GLN 27 Cb 0.03 0.03 -0.15 0.00 1.00 0.00 0.00 33.01 33.91 2dl3 s GLN 27 CO 0.11 -0.01 1.85 1.17 -2.12 0.00 0.00 175.29 176.29 2dl3 n LYS 28 N 2.75 1.03 -1.97 2.91 4.81 -1.25 -0.91 118.16 125.54 2dl3 n LYS 28 Ca -0.15 0.36 0.00 0.00 -0.87 0.00 0.00 58.31 57.66 2dl3 n LYS 28 Cb 0.59 -2.11 0.00 0.00 0.02 0.00 0.00 35.03 33.53 2dl3 n LYS 28 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2dl3 n GLY 29 N 4.82 0.82 3.54 3.14 0.00 0.58 -4.98 105.19 113.11 2dl3 n GLY 29 Ca 0.31 -0.65 -0.34 0.00 0.00 0.00 0.00 46.02 45.33 2dl3 n GLY 29 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2dl3 s ASP 30 N -2.86 5.15 -0.35 1.61 1.11 -0.09 -4.87 116.67 116.37 2dl3 s ASP 30 Ca 0.00 -0.07 -0.17 0.00 0.18 0.00 0.00 52.55 52.49 2dl3 s ASP 30 Cb 0.00 -1.87 -0.00 0.00 1.07 0.00 0.00 42.92 42.11 2dl3 s ASP 30 CO 0.00 0.14 0.45 -0.63 1.18 0.00 0.00 175.17 176.31 2dl3 s ILE 31 N 0.58 5.08 0.32 0.77 -1.09 -1.26 -1.77 121.20 123.83 2dl3 s ILE 31 Ca 0.00 0.19 0.10 0.00 -2.23 0.00 0.00 60.65 58.71 2dl3 s ILE 31 Cb -0.14 -3.92 -0.06 0.00 -1.58 0.00 0.00 42.46 36.76 2dl3 s ILE 31 CO 0.02 -0.19 -0.11 0.68 -1.23 0.00 0.00 174.94 174.11 2dl3 s VAL 32 N 2.24 2.21 -0.31 2.92 -7.23 -0.70 -4.95 120.40 114.58 2dl3 s VAL 32 Ca 0.16 -2.24 -0.01 0.00 -1.81 0.00 0.00 61.98 58.08 2dl3 s VAL 32 Cb -0.16 -2.55 0.06 0.00 0.56 0.00 0.00 36.38 34.29 2dl3 s VAL 32 CO 0.13 -0.26 0.02 -0.31 -0.31 0.00 0.00 175.10 174.37 2dl3 s TYR 33 N -2.64 3.33 -0.28 2.82 2.02 -1.25 -1.87 117.35 119.47 2dl3 s TYR 33 Ca 0.32 -2.03 -0.29 0.00 -0.37 0.00 0.00 57.07 54.70 2dl3 s TYR 33 Cb 0.01 -2.27 0.01 0.00 -0.40 0.00 0.00 41.96 39.31 2dl3 s TYR 33 CO 0.16 -0.84 1.14 0.42 -1.57 0.00 0.00 175.55 174.86 2dl3 s ILE 34 N 1.21 4.43 -0.08 2.71 1.01 -0.36 -2.98 121.20 127.15 2dl3 s ILE 34 Ca -0.03 1.67 -0.19 0.00 0.00 0.00 0.00 60.65 62.10 2dl3 s ILE 34 Cb -0.20 -4.30 -0.29 0.00 0.01 0.00 0.00 42.46 37.68 2dl3 s ILE 34 CO -0.02 -0.39 0.72 1.88 0.00 0.00 0.00 174.94 177.13 2dl3 h TYR 35 N 8.24 0.48 -3.44 3.97 0.05 0.06 0.24 116.97 126.57 2dl3 h TYR 35 Ca -0.22 -0.35 -0.16 0.00 0.05 0.00 0.00 58.73 58.04 2dl3 h TYR 35 Cb 1.07 -0.02 -0.23 0.00 1.01 0.00 0.00 36.73 38.56 2dl3 h TYR 35 CO 0.83 1.43 -0.51 -1.59 -1.05 0.00 0.00 178.16 177.26 2dl3 s LYS 36 N -2.45 0.36 -0.37 4.88 -2.85 -1.11 -4.84 119.74 113.36 2dl3 s LYS 36 Ca -0.17 -0.13 -0.21 0.00 -1.00 0.00 0.00 55.97 54.45 2dl3 s LYS 36 Cb 0.03 0.15 0.01 0.00 -2.06 0.00 0.00 37.83 35.96 2dl3 s LYS 36 CO 0.80 -0.07 0.69 -1.14 0.10 0.00 0.00 175.35 175.72 2dl3 s GLN 37 N -0.76 3.64 0.04 1.78 0.74 -1.26 -1.56 119.66 122.28 2dl3 s GLN 37 Ca -0.08 0.07 -0.32 0.00 0.05 0.00 0.00 55.36 55.08 2dl3 s GLN 37 Cb -0.05 -3.83 -0.18 0.00 1.10 0.00 0.00 33.01 30.05 2dl3 s GLN 37 CO 0.01 -0.82 1.34 0.82 -0.55 0.00 0.00 175.29 176.08 2dl3 h ILE 38 N 5.74 0.00 -4.42 -2.34 1.08 -1.75 -3.48 117.51 112.34 2dl3 h ILE 38 Ca -0.26 -0.13 -0.36 0.00 -0.39 0.00 0.00 64.86 63.72 2dl3 h ILE 38 Cb 1.10 0.00 -0.14 0.00 -3.07 0.00 0.00 36.82 34.71 2dl3 h ILE 38 CO 0.87 0.00 -0.57 -0.62 -0.69 0.00 0.00 178.15 177.14 2dl3 s ASP 39 N -4.14 1.03 0.54 1.72 2.15 -1.12 -4.94 116.67 111.90 2dl3 s ASP 39 Ca -0.17 -1.54 0.31 0.00 0.43 0.00 0.00 52.55 51.58 2dl3 s ASP 39 Cb 0.02 0.42 1.66 0.00 -0.30 0.00 0.00 42.92 44.72 2dl3 s ASP 39 CO 0.50 -0.91 1.92 -0.61 -0.17 0.00 0.00 175.17 175.91 2dl3 h GLN 40 N 2.36 0.00 0.00 4.34 4.15 -2.03 -0.20 115.11 123.72 2dl3 h GLN 40 Ca -0.33 0.00 -0.04 0.00 0.77 0.00 0.00 58.65 59.06 2dl3 h GLN 40 Cb 1.25 0.00 -0.08 0.00 0.21 0.00 0.00 27.48 28.85 2dl3 h GLN 40 CO 0.49 0.00 -0.47 0.09 -1.93 0.00 0.00 178.83 177.01 2dl3 n ASN 41 N -2.68 1.28 -3.94 -0.69 3.02 -1.26 -4.96 115.26 106.02 2dl3 n ASN 41 Ca -0.02 -2.74 -0.09 0.00 -0.03 0.00 0.00 54.58 51.70 2dl3 n ASN 41 Cb 0.19 -0.36 -0.09 0.00 -0.61 0.00 0.00 39.78 38.90 2dl3 n ASN 41 CO 0.00 0.00 0.00 0.26 -2.62 0.00 0.00 177.26 174.90 2dl3 s TRP 42 N -1.56 0.22 0.34 3.10 0.52 -0.09 -1.90 118.94 119.58 2dl3 s TRP 42 Ca 0.25 -0.54 0.07 0.00 0.02 0.00 0.00 56.10 55.90 2dl3 s TRP 42 Cb 0.25 -0.16 -0.03 0.00 -1.15 0.00 0.00 33.47 32.38 2dl3 s TRP 42 CO -0.04 -0.37 0.31 0.66 0.02 0.00 0.00 176.95 177.53 2dl3 n TYR 43 N 0.73 -0.87 -3.63 -1.98 4.01 0.53 -2.77 117.16 113.18 2dl3 n TYR 43 Ca -0.19 -2.82 -0.07 0.00 -0.16 0.00 0.00 57.90 54.67 2dl3 n TYR 43 Cb 0.59 0.32 -0.08 0.00 -0.31 0.00 0.00 39.34 39.85 2dl3 n TYR 43 CO 0.00 0.00 0.00 -2.00 -0.46 0.00 0.00 176.86 174.40 2dl3 s GLU 44 N -3.33 0.38 0.00 -0.72 2.12 -0.60 -1.76 118.70 114.79 2dl3 s GLU 44 Ca 0.40 1.09 0.00 0.00 0.36 0.00 0.00 54.97 56.82 2dl3 s GLU 44 Cb 0.02 0.41 0.00 0.00 0.26 0.00 0.00 34.13 34.81 2dl3 s GLU 44 CO 0.28 -0.27 0.00 0.41 -0.54 0.00 0.00 175.26 175.14 2dl3 n GLY 45 N 5.40 4.99 2.90 -1.50 0.00 -0.93 0.71 105.19 116.76 2dl3 n GLY 45 Ca -0.09 -0.88 -0.12 0.00 0.00 0.00 0.00 46.02 44.93 2dl3 n GLY 45 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2dl3 s GLU 46 N 2.93 0.09 -0.13 1.61 2.12 -1.16 -2.67 118.70 121.49 2dl3 s GLU 46 Ca 0.00 -0.11 -0.08 0.00 0.36 0.00 0.00 54.97 55.14 2dl3 s GLU 46 Cb 0.00 -0.03 0.05 0.00 0.26 0.00 0.00 34.13 34.40 2dl3 s GLU 46 CO 0.00 0.01 0.32 -1.58 -0.54 0.00 0.00 175.26 173.47 2dl3 s HIS 47 N -0.21 -0.43 -1.55 5.30 2.46 0.89 -3.96 115.29 117.79 2dl3 s HIS 47 Ca -0.02 0.97 -0.03 0.00 0.47 0.00 0.00 55.06 56.45 2dl3 s HIS 47 Cb -0.02 0.14 0.03 0.00 -0.13 0.00 0.00 32.58 32.61 2dl3 s HIS 47 CO -0.00 -0.25 0.23 1.58 -2.47 0.00 0.00 174.74 173.82 2dl3 n HIS 48 N 3.89 -1.39 -2.84 3.88 -0.00 -1.26 0.88 115.22 118.37 2dl3 n HIS 48 Ca -0.21 0.67 -0.19 0.00 -0.00 0.00 0.00 57.72 57.98 2dl3 n HIS 48 Cb 0.55 -2.99 0.03 0.00 -0.00 0.00 0.00 29.99 27.57 2dl3 n HIS 48 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 2dl3 n GLY 49 N -2.20 -0.36 2.72 1.57 0.00 -1.26 -5.00 105.19 100.67 2dl3 n GLY 49 Ca -0.26 -0.01 -0.22 0.00 0.00 0.00 0.00 46.02 45.53 2dl3 n GLY 49 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2dl3 s ARG 50 N -5.46 0.33 -0.18 1.61 3.52 0.25 -5.13 118.95 113.89 2dl3 s ARG 50 Ca 0.23 0.17 -0.09 0.00 -0.13 0.00 0.00 55.73 55.91 2dl3 s ARG 50 Cb -0.10 -0.91 -0.05 0.00 -1.56 0.00 0.00 34.95 32.33 2dl3 s ARG 50 CO 0.29 -0.35 0.12 0.08 -0.81 0.00 0.00 175.30 174.63 2dl3 s VAL 51 N 2.05 5.36 0.02 7.11 1.01 -1.26 -0.08 120.40 134.60 2dl3 s VAL 51 Ca 0.05 0.17 -0.05 0.00 0.00 0.00 0.00 61.98 62.14 2dl3 s VAL 51 Cb -0.13 -3.42 0.02 0.00 0.00 0.00 0.00 36.38 32.85 2dl3 s VAL 51 CO -0.05 0.48 0.23 0.61 0.00 0.00 0.00 175.10 176.37 2dl3 n GLY 52 N 3.21 0.94 3.74 4.51 0.00 -1.09 -4.82 105.19 111.68 2dl3 n GLY 52 Ca -0.17 -0.93 -0.22 0.00 0.00 0.00 0.00 46.02 44.69 2dl3 n GLY 52 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2dl3 s ILE 53 N -2.34 3.65 -0.04 -0.61 -4.36 0.11 -2.19 121.20 115.42 2dl3 s ILE 53 Ca 0.05 -1.65 -0.29 0.00 -0.26 0.00 0.00 60.65 58.50 2dl3 s ILE 53 Cb -0.00 -3.08 0.09 0.00 1.25 0.00 0.00 42.46 40.71 2dl3 s ILE 53 CO 0.01 -0.30 0.77 0.72 0.24 0.00 0.00 174.94 176.38 2dl3 s PHE 54 N -2.29 -0.54 0.38 1.37 -0.12 -0.72 -0.76 117.98 115.30 2dl3 s PHE 54 Ca 0.34 0.80 -0.26 0.00 -0.05 0.00 0.00 56.93 57.76 2dl3 s PHE 54 Cb -0.06 0.45 -0.09 0.00 -0.63 0.00 0.00 43.02 42.70 2dl3 s PHE 54 CO 0.23 -0.57 1.20 -1.25 -0.05 0.00 0.00 175.22 174.77 2dl3 s PRO 55 N -1.73 4.13 0.08 1.99 0.04 -1.26 -0.35 135.00 137.90 2dl3 s PRO 55 Ca -0.05 1.92 -0.17 0.00 0.04 0.00 0.00 61.00 62.74 2dl3 s PRO 55 Cb -0.00 -2.78 -0.10 0.00 0.04 0.00 0.00 34.50 31.66 2dl3 s PRO 55 CO 0.03 -0.28 1.40 -0.09 0.04 0.00 0.00 177.00 178.10 2dl3 h ARG 56 N 2.84 0.59 -0.57 4.56 2.43 -1.69 -2.95 114.38 119.58 2dl3 h ARG 56 Ca -0.49 -0.31 0.17 0.00 -0.81 0.00 0.00 59.98 58.54 2dl3 h ARG 56 Cb 1.23 0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 30.77 2dl3 h ARG 56 CO 0.63 0.90 0.76 0.00 -1.51 0.00 0.00 179.97 180.75 2dl3 h THR 57 N 0.30 0.16 0.11 0.20 1.03 -1.93 0.86 112.91 113.65 2dl3 h THR 57 Ca 0.04 0.00 -0.29 0.00 -0.01 0.00 0.00 66.41 66.15 2dl3 h THR 57 Cb 0.79 0.37 -0.01 0.00 -1.07 0.00 0.00 68.15 68.23 2dl3 h THR 57 CO 0.06 0.00 -1.39 1.88 -0.01 0.00 0.00 175.52 176.06 2dl3 h TYR 58 N 0.00 0.42 -4.99 0.00 -1.99 -1.91 -3.47 116.97 105.03 2dl3 h TYR 58 Ca 0.27 -0.31 -0.31 0.00 2.00 0.00 0.00 58.73 60.38 2dl3 h TYR 58 Cb 1.79 -0.02 -0.03 0.00 2.00 0.00 0.00 36.73 40.47 2dl3 h TYR 58 CO 0.00 1.30 -0.15 0.44 -0.00 0.00 0.00 178.16 179.75 2dl3 n ILE 59 N -3.46 0.00 -3.76 -2.88 -6.64 0.30 0.13 119.36 103.05 2dl3 n ILE 59 Ca -0.12 -1.19 -0.13 0.00 -1.77 0.00 0.00 62.75 59.54 2dl3 n ILE 59 Cb 1.03 -0.22 -0.10 0.00 -1.44 0.00 0.00 39.64 38.91 2dl3 n ILE 59 CO 0.00 0.00 0.00 -1.83 -1.77 0.00 0.00 176.55 172.95 2dl3 s GLU 60 N -3.21 0.53 -0.33 6.28 4.04 0.15 -4.70 118.70 121.46 2dl3 s GLU 60 Ca 0.16 0.12 -0.24 0.00 0.04 0.00 0.00 54.97 55.05 2dl3 s GLU 60 Cb -0.01 0.24 0.01 0.00 0.02 0.00 0.00 34.13 34.39 2dl3 s GLU 60 CO 0.10 -0.12 0.82 -0.51 -1.84 0.00 0.00 175.26 173.71 2dl3 s LEU 61 N -0.61 4.08 0.82 1.83 1.43 -1.26 -0.90 118.68 124.07 2dl3 s LEU 61 Ca -0.07 0.58 -0.11 0.00 -1.03 0.00 0.00 54.13 53.50 2dl3 s LEU 61 Cb -0.04 -3.11 0.09 0.00 0.03 0.00 0.00 46.19 43.16 2dl3 s LEU 61 CO 0.02 -0.69 1.09 -0.76 0.23 0.00 0.00 176.35 176.25 2dl3 s LEU 62 N 3.09 2.72 0.10 1.79 1.43 -1.14 -5.00 118.68 121.67 2dl3 s LEU 62 Ca 0.33 1.70 -0.14 0.00 -1.03 0.00 0.00 54.13 54.99 2dl3 s LEU 62 Cb -0.13 -4.28 0.03 0.00 0.03 0.00 0.00 46.19 41.83 2dl3 s LEU 62 CO 0.15 -2.30 0.34 -0.55 0.23 0.00 0.00 176.35 174.22 2dl3 s SER 63 N -3.39 -0.15 0.00 2.29 0.15 -1.26 -4.98 113.70 106.37 2dl3 s SER 63 Ca 0.62 -0.33 0.00 0.00 0.70 0.00 0.00 55.95 56.94 2dl3 s SER 63 Cb -0.18 0.42 0.00 0.00 -1.71 0.00 0.00 66.02 64.56 2dl3 s SER 63 CO 0.56 -0.77 0.00 0.61 1.20 0.00 0.00 173.24 174.85 2dl3 n GLY 64 N 0.01 -2.64 1.84 9.45 0.00 -1.26 -5.03 105.19 107.57 2dl3 n GLY 64 Ca -0.16 -1.27 -0.16 0.00 0.00 0.00 0.00 46.02 44.43 2dl3 n GLY 64 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2dl3 n PRO 65 N 0.00 -2.15 -1.02 1.61 -0.04 -1.26 -4.89 135.00 127.25 2dl3 n PRO 65 Ca 0.00 -0.92 -0.35 0.00 -0.04 0.00 0.00 63.50 62.19 2dl3 n PRO 65 Cb 0.00 -0.86 -0.02 0.00 -0.04 0.00 0.00 33.50 32.58 2dl3 n PRO 65 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2dl3 n SER 66 N -3.99 -1.02 -3.55 3.54 2.88 -1.26 -4.96 113.62 105.27 2dl3 n SER 66 Ca 0.08 0.81 -0.09 0.00 -1.33 0.00 0.00 58.87 58.34 2dl3 n SER 66 Cb 0.31 -0.69 -0.03 0.00 -0.75 0.00 0.00 64.21 63.04 2dl3 n SER 66 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 2dl3 s SER 67 N -0.73 -0.34 0.00 -3.46 1.04 -1.26 -5.26 113.70 103.68 2dl3 s SER 67 Ca 0.47 0.19 0.00 0.00 0.48 0.00 0.00 55.95 57.08 2dl3 s SER 67 Cb -0.66 0.32 0.00 0.00 0.10 0.00 0.00 66.02 65.78 2dl3 s SER 67 CO 0.41 -0.45 0.00 0.61 0.98 0.00 0.00 173.24 174.80