#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dl3 h SER 2 N 0.00 -0.95 -3.03 1.61 0.02 -2.08 -3.43 113.55 105.69 2dl3 h SER 2 Ca 0.00 0.05 -0.66 0.00 -0.84 0.00 0.00 61.79 60.33 2dl3 h SER 2 Cb 0.00 0.26 -0.10 0.00 0.14 0.00 0.00 62.40 62.70 2dl3 h SER 2 CO 0.00 -0.61 -0.56 -0.55 -1.14 0.00 0.00 176.83 173.97 2dl3 s SER 3 N -3.63 5.77 0.00 3.07 0.15 -1.26 -4.98 113.70 112.82 2dl3 s SER 3 Ca -0.15 0.24 0.00 0.00 0.70 0.00 0.00 55.95 56.74 2dl3 s SER 3 Cb 0.02 -1.72 0.00 0.00 -1.71 0.00 0.00 66.02 62.61 2dl3 s SER 3 CO 0.47 0.34 0.00 0.61 1.20 0.00 0.00 173.24 175.85 2dl3 n GLY 4 N 1.65 -0.15 2.45 9.45 0.00 -1.26 -4.99 105.19 112.34 2dl3 n GLY 4 Ca -0.16 -1.25 -0.14 0.00 0.00 0.00 0.00 46.02 44.47 2dl3 n GLY 4 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2dl3 n SER 5 N -0.20 3.27 -3.63 1.61 3.41 -1.26 -4.21 113.62 112.60 2dl3 n SER 5 Ca 0.00 -2.99 -0.15 0.00 -0.26 0.00 0.00 58.87 55.47 2dl3 n SER 5 Cb 0.00 -0.43 -0.07 0.00 -0.26 0.00 0.00 64.21 63.45 2dl3 n SER 5 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 2dl3 s SER 6 N -3.62 0.85 0.00 4.04 0.01 -1.26 -5.16 113.70 108.56 2dl3 s SER 6 Ca 0.39 -1.49 0.00 0.00 1.31 0.00 0.00 55.95 56.16 2dl3 s SER 6 Cb 0.38 0.54 0.00 0.00 0.21 0.00 0.00 66.02 67.15 2dl3 s SER 6 CO -0.02 -1.07 0.00 0.61 0.41 0.00 0.00 173.24 173.17 2dl3 n GLY 7 N -0.48 3.64 3.34 3.44 0.00 -1.26 -4.81 105.19 109.07 2dl3 n GLY 7 Ca 0.03 -1.81 -0.31 0.00 0.00 0.00 0.00 46.02 43.94 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 -3.07 2.08 0.18 1.61 0.52 -0.58 -4.80 118.95 114.89 2dl3 s ARG 8 Ca 0.00 -0.95 -0.30 0.00 -0.52 0.00 0.00 55.73 53.96 2dl3 s ARG 8 Cb 0.00 -2.07 -0.08 0.00 0.52 0.00 0.00 34.95 33.31 2dl3 s ARG 8 CO 0.00 0.55 1.31 -1.25 0.02 0.00 0.00 175.30 175.94 2dl3 s PRO 9 N -0.81 4.38 -0.12 3.54 0.04 -1.26 -0.88 135.00 139.89 2dl3 s PRO 9 Ca 0.11 2.04 -0.07 0.00 0.04 0.00 0.00 61.00 63.12 2dl3 s PRO 9 Cb -0.10 -3.21 0.05 0.00 0.04 0.00 0.00 34.50 31.28 2dl3 s PRO 9 CO 0.00 -0.28 0.29 0.00 0.04 0.00 0.00 177.00 177.06 2dl3 s ALA 10 N 0.28 -0.70 -0.16 8.56 0.00 -0.39 -1.22 121.76 128.13 2dl3 s ALA 10 Ca 0.58 1.09 -0.06 0.00 0.00 0.00 0.00 51.96 53.57 2dl3 s ALA 10 Cb -0.36 -0.67 -0.04 0.00 0.00 0.00 0.00 23.12 22.05 2dl3 s ALA 10 CO 0.37 -0.20 0.05 0.50 0.00 0.00 0.00 175.76 176.48 2dl3 s ARG 11 N 1.09 3.76 -0.04 0.00 3.52 -0.86 -0.08 118.95 126.33 2dl3 s ARG 11 Ca -0.08 -0.35 -0.30 0.00 -0.13 0.00 0.00 55.73 54.88 2dl3 s ARG 11 Cb -0.08 -3.12 -0.05 0.00 -1.56 0.00 0.00 34.95 30.13 2dl3 s ARG 11 CO -0.08 0.39 1.44 0.00 -0.81 0.00 0.00 175.30 176.24 2dl3 s ALA 12 N 0.04 3.61 -0.04 6.12 0.00 0.27 -0.38 121.76 131.38 2dl3 s ALA 12 Ca 0.05 0.83 -0.09 0.00 0.00 0.00 0.00 51.96 52.74 2dl3 s ALA 12 Cb -0.12 -3.64 -0.30 0.00 0.00 0.00 0.00 23.12 19.06 2dl3 s ALA 12 CO 0.01 -1.08 0.69 0.87 0.00 0.00 0.00 175.76 176.25 2dl3 h LYS 13 N 8.33 0.37 -5.50 0.00 1.79 -0.35 0.93 116.57 122.13 2dl3 h LYS 13 Ca -0.36 -0.63 -0.43 0.00 -2.18 0.00 0.00 60.65 57.04 2dl3 h LYS 13 Cb 1.17 0.24 -0.17 0.00 -1.58 0.00 0.00 32.23 31.88 2dl3 h LYS 13 CO 0.93 1.28 -0.75 -0.06 -1.08 0.00 0.00 179.45 179.77 2dl3 s PHE 14 N -2.58 1.53 0.25 -1.35 0.08 -0.97 -4.67 117.98 110.26 2dl3 s PHE 14 Ca -0.15 -0.57 -0.30 0.00 0.12 0.00 0.00 56.93 56.04 2dl3 s PHE 14 Cb 0.06 -0.77 -0.09 0.00 -0.57 0.00 0.00 43.02 41.65 2dl3 s PHE 14 CO 0.85 0.21 1.30 0.34 -0.10 0.00 0.00 175.22 177.83 2dl3 s ASP 15 N -2.75 6.87 0.36 1.36 2.15 -1.26 -4.32 116.67 119.08 2dl3 s ASP 15 Ca 0.14 2.49 0.09 0.00 0.43 0.00 0.00 52.55 55.70 2dl3 s ASP 15 Cb -0.03 -2.62 -0.07 0.00 -0.30 0.00 0.00 42.92 39.89 2dl3 s ASP 15 CO 0.04 -0.51 -0.06 0.12 -0.17 0.00 0.00 175.17 174.59 2dl3 s PHE 16 N -0.37 2.40 -0.22 -5.34 5.36 -0.84 -4.98 117.98 113.99 2dl3 s PHE 16 Ca 0.54 -0.56 -0.04 0.00 -0.96 0.00 0.00 56.93 55.90 2dl3 s PHE 16 Cb -0.37 -1.48 0.09 0.00 -0.34 0.00 0.00 43.02 40.92 2dl3 s PHE 16 CO 0.43 0.52 0.19 0.21 -1.46 0.00 0.00 175.22 175.11 2dl3 s LYS 17 N -3.65 0.18 -0.83 10.12 2.20 -1.26 -3.79 119.74 122.72 2dl3 s LYS 17 Ca 0.33 -0.04 -0.25 0.00 -0.36 0.00 0.00 55.97 55.65 2dl3 s LYS 17 Cb 0.05 -1.27 -0.02 0.00 -1.51 0.00 0.00 37.83 35.08 2dl3 s LYS 17 CO 0.17 -0.78 1.81 0.00 -0.36 0.00 0.00 175.35 176.19 2dl3 s ALA 18 N 2.25 2.01 0.34 3.13 0.00 -1.26 -4.82 121.76 123.41 2dl3 s ALA 18 Ca 0.06 -1.36 0.10 0.00 0.00 0.00 0.00 51.96 50.76 2dl3 s ALA 18 Cb -0.16 -4.46 0.86 0.00 0.00 0.00 0.00 23.12 19.36 2dl3 s ALA 18 CO -0.19 -4.30 1.79 1.96 0.00 0.00 0.00 175.76 175.02 2dl3 h GLN 19 N 12.03 0.62 0.00 0.00 4.20 -1.96 -3.44 115.11 126.57 2dl3 h GLN 19 Ca -0.01 -0.04 -0.37 0.00 0.06 0.00 0.00 58.65 58.29 2dl3 h GLN 19 Cb 1.05 -0.14 -0.09 0.00 0.30 0.00 0.00 27.48 28.60 2dl3 h GLN 19 CO 1.25 0.41 -0.34 0.25 -0.67 0.00 0.00 178.83 179.73 2dl3 n THR 20 N -4.70 0.00 -0.05 -0.54 -2.24 -1.26 -5.06 114.28 100.43 2dl3 n THR 20 Ca 0.23 -1.75 -0.11 0.00 -2.27 0.00 0.00 64.05 60.15 2dl3 n THR 20 Cb 0.64 0.78 -0.04 0.00 -2.10 0.00 0.00 70.33 69.61 2dl3 n THR 20 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 2dl3 h LEU 21 N 0.00 0.24 -1.07 3.22 5.85 -1.96 -2.74 115.31 118.85 2dl3 h LEU 21 Ca -0.19 -0.12 0.43 0.00 0.84 0.00 0.00 57.88 58.83 2dl3 h LEU 21 Cb 0.88 -0.06 -0.17 0.00 0.37 0.00 0.00 40.66 41.67 2dl3 h LEU 21 CO 0.29 0.29 0.60 0.11 -0.34 0.00 0.00 178.44 179.40 2dl3 h LYS 22 N 0.17 0.00 -6.71 1.25 1.57 -1.97 -3.40 116.57 107.49 2dl3 h LYS 22 Ca 0.06 -0.00 -0.44 0.00 -1.87 0.00 0.00 60.65 58.40 2dl3 h LYS 22 Cb 0.12 -0.00 0.04 0.00 0.08 0.00 0.00 32.23 32.46 2dl3 h LYS 22 CO -0.01 0.00 -0.10 -1.21 -0.57 0.00 0.00 179.45 177.56 2dl3 s GLU 23 N -5.48 2.74 -0.05 3.15 2.02 -1.03 -1.51 118.70 118.53 2dl3 s GLU 23 Ca -0.09 -0.81 0.02 0.00 0.02 0.00 0.00 54.97 54.11 2dl3 s GLU 23 Cb 0.33 -2.57 0.01 0.00 0.10 0.00 0.00 34.13 32.01 2dl3 s GLU 23 CO 0.79 -0.50 -0.09 -1.17 0.02 0.00 0.00 175.26 174.31 2dl3 s LEU 24 N -4.61 1.59 0.39 1.80 2.96 -0.16 -4.37 118.68 116.29 2dl3 s LEU 24 Ca 0.54 -0.21 -0.26 0.00 -0.22 0.00 0.00 54.13 53.98 2dl3 s LEU 24 Cb -0.10 -0.63 -0.09 0.00 0.50 0.00 0.00 46.19 45.87 2dl3 s LEU 24 CO 0.37 0.02 1.19 -2.16 -1.32 0.00 0.00 176.35 174.45 2dl3 s PRO 25 N 0.59 4.10 0.09 0.98 0.04 -1.26 -4.41 135.00 135.13 2dl3 s PRO 25 Ca -0.10 1.91 0.02 0.00 0.04 0.00 0.00 61.00 62.86 2dl3 s PRO 25 Cb -0.13 -2.75 -0.04 0.00 0.04 0.00 0.00 34.50 31.62 2dl3 s PRO 25 CO 0.02 -0.30 -0.07 -0.51 0.04 0.00 0.00 177.00 176.18 2dl3 s LEU 26 N -2.37 2.47 0.02 -3.56 1.43 -1.25 -4.95 118.68 110.48 2dl3 s LEU 26 Ca 0.56 -0.94 0.07 0.00 -1.03 0.00 0.00 54.13 52.79 2dl3 s LEU 26 Cb -0.32 -0.09 -0.02 0.00 0.03 0.00 0.00 46.19 45.78 2dl3 s LEU 26 CO 0.41 -0.42 -0.22 -1.10 0.23 0.00 0.00 176.35 175.25 2dl3 s GLN 27 N -3.50 1.59 -0.76 1.70 -0.21 -1.26 -1.99 119.66 115.23 2dl3 s GLN 27 Ca 0.09 -0.91 -0.25 0.00 0.02 0.00 0.00 55.36 54.31 2dl3 s GLN 27 Cb 0.03 -1.65 -0.16 0.00 1.00 0.00 0.00 33.01 32.23 2dl3 s GLN 27 CO -0.04 0.43 2.45 1.17 -2.12 0.00 0.00 175.29 177.19 2dl3 n LYS 28 N 2.08 0.52 0.00 2.91 4.81 -1.26 -1.19 118.16 126.04 2dl3 n LYS 28 Ca -0.16 -0.19 0.00 0.00 -0.87 0.00 0.00 58.31 57.09 2dl3 n LYS 28 Cb 0.53 -2.66 0.00 0.00 0.02 0.00 0.00 35.03 32.92 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 6.24 0.92 3.46 3.14 0.00 0.32 -4.99 105.19 114.28 2dl3 n GLY 29 Ca 0.51 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 46.20 2dl3 n GLY 29 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 2dl3 s ASP 30 N -1.78 4.33 -0.21 1.61 1.47 -0.33 -4.78 116.67 116.97 2dl3 s ASP 30 Ca 0.00 -0.19 -0.20 0.00 1.18 0.00 0.00 52.55 53.34 2dl3 s ASP 30 Cb 0.00 -1.42 -0.03 0.00 -0.34 0.00 0.00 42.92 41.13 2dl3 s ASP 30 CO 0.00 0.24 0.59 -0.63 0.68 0.00 0.00 175.17 176.05 2dl3 s ILE 31 N -0.09 5.04 0.33 2.11 -1.09 -1.26 -0.56 121.20 125.68 2dl3 s ILE 31 Ca -0.00 1.08 0.05 0.00 -2.23 0.00 0.00 60.65 59.55 2dl3 s ILE 31 Cb -0.14 -3.90 -0.07 0.00 -1.58 0.00 0.00 42.46 36.78 2dl3 s ILE 31 CO 0.03 0.11 0.02 0.68 -1.23 0.00 0.00 174.94 174.56 2dl3 s VAL 32 N 1.96 1.44 -0.27 2.92 -7.23 0.89 -4.93 120.40 115.17 2dl3 s VAL 32 Ca 0.26 -2.03 0.02 0.00 -1.81 0.00 0.00 61.98 58.43 2dl3 s VAL 32 Cb -0.16 -2.76 0.07 0.00 0.56 0.00 0.00 36.38 34.09 2dl3 s VAL 32 CO 0.10 -0.06 -0.05 -0.31 -0.31 0.00 0.00 175.10 174.47 2dl3 s TYR 33 N -3.12 3.03 -0.46 2.82 2.02 -1.25 -1.26 117.35 119.12 2dl3 s TYR 33 Ca 0.35 -2.27 -0.29 0.00 -0.37 0.00 0.00 57.07 54.49 2dl3 s TYR 33 Cb 0.08 -2.03 0.02 0.00 -0.40 0.00 0.00 41.96 39.63 2dl3 s TYR 33 CO 0.15 -0.86 1.27 0.42 -1.57 0.00 0.00 175.55 174.96 2dl3 s ILE 34 N 1.17 4.04 -0.08 2.71 1.01 -0.06 -3.04 121.20 126.95 2dl3 s ILE 34 Ca -0.03 1.04 -0.26 0.00 0.00 0.00 0.00 60.65 61.40 2dl3 s ILE 34 Cb -0.19 -4.44 -0.24 0.00 0.01 0.00 0.00 42.46 37.59 2dl3 s ILE 34 CO -0.07 -0.94 0.96 1.88 0.00 0.00 0.00 174.94 176.76 2dl3 h TYR 35 N 9.98 0.12 -3.33 3.97 0.05 -1.10 -1.54 116.97 125.12 2dl3 h TYR 35 Ca -0.25 -0.07 -0.50 0.00 0.05 0.00 0.00 58.73 57.96 2dl3 h TYR 35 Cb 1.08 -0.01 -0.13 0.00 1.01 0.00 0.00 36.73 38.67 2dl3 h TYR 35 CO 0.98 0.90 -0.53 -1.59 -1.05 0.00 0.00 178.16 176.88 2dl3 s LYS 36 N -2.91 1.79 -0.22 4.88 -2.85 -1.20 -4.71 119.74 114.51 2dl3 s LYS 36 Ca -0.17 -2.06 0.00 0.00 -1.00 0.00 0.00 55.97 52.74 2dl3 s LYS 36 Cb -0.01 -0.35 0.03 0.00 -2.06 0.00 0.00 37.83 35.44 2dl3 s LYS 36 CO 0.71 -0.47 -0.13 -1.14 0.10 0.00 0.00 175.35 174.42 2dl3 s GLN 37 N -3.72 2.78 -0.03 1.78 0.74 -1.26 -2.87 119.66 117.08 2dl3 s GLN 37 Ca 0.30 -0.99 -0.09 0.00 0.05 0.00 0.00 55.36 54.63 2dl3 s GLN 37 Cb 0.04 -2.80 -0.05 0.00 1.10 0.00 0.00 33.01 31.29 2dl3 s GLN 37 CO 0.17 -0.36 0.51 0.82 -0.55 0.00 0.00 175.29 175.89 2dl3 h ILE 38 N 6.19 0.00 -4.14 -2.34 1.08 -1.83 -3.49 117.51 112.98 2dl3 h ILE 38 Ca -0.35 -0.41 -0.46 0.00 -0.39 0.00 0.00 64.86 63.25 2dl3 h ILE 38 Cb 1.11 0.00 -0.13 0.00 -3.07 0.00 0.00 36.82 34.72 2dl3 h ILE 38 CO 0.57 0.00 -0.52 -0.62 -0.69 0.00 0.00 178.15 176.89 2dl3 s ASP 39 N -4.16 1.79 0.50 1.72 2.15 -1.17 -4.96 116.67 112.54 2dl3 s ASP 39 Ca -0.05 -1.67 0.34 0.00 0.43 0.00 0.00 52.55 51.60 2dl3 s ASP 39 Cb 0.00 0.50 1.69 0.00 -0.30 0.00 0.00 42.92 44.81 2dl3 s ASP 39 CO 0.15 -0.98 2.02 -0.61 -0.17 0.00 0.00 175.17 175.58 2dl3 h GLN 40 N 2.11 0.00 0.00 4.34 4.15 -2.03 -2.12 115.11 121.56 2dl3 h GLN 40 Ca -0.30 0.00 -0.00 0.00 0.77 0.00 0.00 58.65 59.12 2dl3 h GLN 40 Cb 1.25 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 28.93 2dl3 h GLN 40 CO 0.46 0.00 -0.23 0.09 -1.93 0.00 0.00 178.83 177.22 2dl3 n ASN 41 N -2.75 1.42 -4.06 -0.69 3.02 -1.26 -4.92 115.26 106.03 2dl3 n ASN 41 Ca -0.01 -2.69 -0.07 0.00 -0.03 0.00 0.00 54.58 51.78 2dl3 n ASN 41 Cb 0.13 -0.35 -0.10 0.00 -0.61 0.00 0.00 39.78 38.86 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 -1.76 0.47 0.34 3.10 0.52 -0.80 -2.20 118.94 118.61 2dl3 s TRP 42 Ca 0.20 -0.99 -0.05 0.00 0.02 0.00 0.00 56.10 55.29 2dl3 s TRP 42 Cb 0.18 -0.34 0.01 0.00 -1.15 0.00 0.00 33.47 32.17 2dl3 s TRP 42 CO 0.01 -0.39 0.50 0.71 0.02 0.00 0.00 176.95 177.80 2dl3 s TYR 43 N -3.83 0.91 -0.13 -1.98 2.02 0.57 -3.03 117.35 111.88 2dl3 s TYR 43 Ca 0.06 -1.19 -0.06 0.00 -0.37 0.00 0.00 57.07 55.50 2dl3 s TYR 43 Cb 0.07 0.02 0.05 0.00 -0.40 0.00 0.00 41.96 41.71 2dl3 s TYR 43 CO -0.10 -1.16 0.29 -2.00 -1.57 0.00 0.00 175.55 171.02 2dl3 s GLU 44 N -3.09 0.24 0.00 -0.62 2.12 -1.14 -1.47 118.70 114.75 2dl3 s GLU 44 Ca 0.28 0.64 0.00 0.00 0.36 0.00 0.00 54.97 56.26 2dl3 s GLU 44 Cb -0.01 -0.07 0.00 0.00 0.26 0.00 0.00 34.13 34.31 2dl3 s GLU 44 CO 0.18 -0.19 0.00 0.41 -0.54 0.00 0.00 175.26 175.13 2dl3 n GLY 45 N 4.47 3.85 3.23 -1.50 0.00 -1.12 -0.50 105.19 113.62 2dl3 n GLY 45 Ca -0.21 -0.70 -0.22 0.00 0.00 0.00 0.00 46.02 44.89 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 1.79 1.08 -0.29 1.61 2.12 -1.17 -3.20 118.70 120.64 2dl3 s GLU 46 Ca 0.00 -1.02 -0.14 0.00 0.36 0.00 0.00 54.97 54.18 2dl3 s GLU 46 Cb 0.00 -1.22 0.12 0.00 0.26 0.00 0.00 34.13 33.29 2dl3 s GLU 46 CO 0.00 0.29 0.76 -1.58 -0.54 0.00 0.00 175.26 174.19 2dl3 s HIS 47 N -1.07 -1.04 -1.28 5.30 2.46 0.92 -3.89 115.29 116.69 2dl3 s HIS 47 Ca 0.04 1.92 -0.09 0.00 0.47 0.00 0.00 55.06 57.40 2dl3 s HIS 47 Cb -0.09 0.62 -0.00 0.00 -0.13 0.00 0.00 32.58 32.98 2dl3 s HIS 47 CO 0.03 -0.52 0.61 1.58 -2.47 0.00 0.00 174.74 173.98 2dl3 n HIS 48 N 4.76 -1.79 -1.86 3.88 -0.00 -1.26 -0.08 115.22 118.87 2dl3 n HIS 48 Ca -0.15 0.63 -0.15 0.00 -0.00 0.00 0.00 57.72 58.04 2dl3 n HIS 48 Cb 0.54 -3.70 -0.04 0.00 -0.00 0.00 0.00 29.99 26.79 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 -1.81 0.64 3.09 1.57 0.00 -1.26 -4.94 105.19 102.49 2dl3 n GLY 49 Ca -0.22 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.56 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 -4.04 1.48 0.07 1.61 6.06 0.89 -5.14 118.95 119.88 2dl3 s ARG 50 Ca 0.00 -0.50 0.06 0.00 -2.50 0.00 0.00 55.73 52.79 2dl3 s ARG 50 Cb 0.00 -1.32 -0.04 0.00 0.06 0.00 0.00 34.95 33.65 2dl3 s ARG 50 CO 0.00 0.20 -0.11 0.08 -2.50 0.00 0.00 175.30 172.98 2dl3 s VAL 51 N 0.07 3.33 -1.09 7.11 1.01 -1.26 -0.05 120.40 129.52 2dl3 s VAL 51 Ca -0.03 -1.13 0.00 0.00 0.00 0.00 0.00 61.98 60.82 2dl3 s VAL 51 Cb -0.10 -2.50 0.00 0.00 0.00 0.00 0.00 36.38 33.78 2dl3 s VAL 51 CO 0.01 0.22 0.00 0.61 0.00 0.00 0.00 175.10 175.95 2dl3 n GLY 52 N 1.08 -0.63 3.36 4.51 0.00 -1.19 -4.75 105.19 107.56 2dl3 n GLY 52 Ca -0.14 -0.56 -0.19 0.00 0.00 0.00 0.00 46.02 45.13 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 -3.44 1.80 -0.06 -0.61 -4.36 -0.57 -2.77 121.20 111.19 2dl3 s ILE 53 Ca 0.00 -2.23 -0.31 0.00 -0.26 0.00 0.00 60.65 57.85 2dl3 s ILE 53 Cb 0.00 -2.09 0.07 0.00 1.25 0.00 0.00 42.46 41.70 2dl3 s ILE 53 CO 0.00 -0.56 0.69 0.72 0.24 0.00 0.00 174.94 176.03 2dl3 s PHE 54 N -2.93 -0.65 0.30 1.37 -0.71 -0.54 -0.98 117.98 113.84 2dl3 s PHE 54 Ca 0.23 1.13 -0.29 0.00 -1.04 0.00 0.00 56.93 56.96 2dl3 s PHE 54 Cb -0.01 0.41 -0.10 0.00 -1.21 0.00 0.00 43.02 42.11 2dl3 s PHE 54 CO 0.08 -0.59 1.23 -1.25 -1.34 0.00 0.00 175.22 173.35 2dl3 s PRO 55 N -1.15 4.46 0.12 1.99 0.04 -1.26 -0.31 135.00 138.89 2dl3 s PRO 55 Ca -0.10 2.06 -0.16 0.00 0.04 0.00 0.00 61.00 62.83 2dl3 s PRO 55 Cb -0.00 -3.12 -0.03 0.00 0.04 0.00 0.00 34.50 31.39 2dl3 s PRO 55 CO 0.09 -0.06 1.61 -0.09 0.04 0.00 0.00 177.00 178.60 2dl3 h ARG 56 N 3.74 0.58 0.00 4.56 2.43 -1.74 -2.38 114.38 121.58 2dl3 h ARG 56 Ca -0.48 -0.14 0.00 0.00 -0.81 0.00 0.00 59.98 58.55 2dl3 h ARG 56 Cb 1.22 -0.07 0.00 0.00 -0.42 0.00 0.00 29.97 30.70 2dl3 h ARG 56 CO 0.67 0.63 0.46 1.15 -1.51 0.00 0.00 179.97 181.38 2dl3 h THR 57 N 0.43 0.00 0.05 0.20 2.02 -1.93 0.68 112.91 114.36 2dl3 h THR 57 Ca 0.11 0.00 -0.31 0.00 0.77 0.00 0.00 66.41 66.98 2dl3 h THR 57 Cb 0.32 0.41 -0.04 0.00 -1.74 0.00 0.00 68.15 67.10 2dl3 h THR 57 CO 0.00 0.00 -1.74 1.88 0.37 0.00 0.00 175.52 176.03 2dl3 h TYR 58 N 0.00 0.18 -1.19 3.16 -1.99 -1.81 -3.46 116.97 111.85 2dl3 h TYR 58 Ca 0.00 -0.13 -0.53 0.00 2.00 0.00 0.00 58.73 60.07 2dl3 h TYR 58 Cb 0.93 -0.01 -0.04 0.00 2.00 0.00 0.00 36.73 39.61 2dl3 h TYR 58 CO 0.00 1.25 -0.36 0.96 -0.00 0.00 0.00 178.16 180.01 2dl3 s ILE 59 N -2.59 2.25 -0.18 -2.88 -5.25 0.24 0.40 121.20 113.18 2dl3 s ILE 59 Ca -0.10 -1.44 -0.03 0.00 -0.99 0.00 0.00 60.65 58.10 2dl3 s ILE 59 Cb 0.08 -2.69 0.06 0.00 2.95 0.00 0.00 42.46 42.86 2dl3 s ILE 59 CO 0.81 0.00 0.04 -0.70 -1.79 0.00 0.00 174.94 173.30 2dl3 s GLU 60 N -4.16 0.57 -0.14 0.37 2.56 0.49 -4.76 118.70 113.62 2dl3 s GLU 60 Ca 0.43 -0.33 -0.29 0.00 0.00 0.00 0.00 54.97 54.78 2dl3 s GLU 60 Cb -0.02 -1.97 -0.07 0.00 2.00 0.00 0.00 34.13 34.07 2dl3 s GLU 60 CO 0.25 -0.62 2.14 1.28 -0.56 0.00 0.00 175.26 177.76 2dl3 n LEU 61 N 5.09 3.52 -4.71 2.70 4.77 -1.26 -2.04 117.00 125.07 2dl3 n LEU 61 Ca -0.08 0.43 -0.42 0.00 -0.03 0.00 0.00 56.01 55.91 2dl3 n LEU 61 Cb 0.48 -1.54 -0.03 0.00 -2.33 0.00 0.00 43.42 40.00 2dl3 n LEU 61 CO 0.12 -0.41 0.74 -0.76 -1.33 0.00 0.00 177.39 175.75 2dl3 s LEU 62 N 7.07 4.36 -0.01 2.23 1.43 -0.35 -4.98 118.68 128.42 2dl3 s LEU 62 Ca 0.97 1.73 -0.07 0.00 -1.03 0.00 0.00 54.13 55.74 2dl3 s LEU 62 Cb -0.38 -3.57 0.01 0.00 0.03 0.00 0.00 46.19 42.27 2dl3 s LEU 62 CO 0.38 -0.33 0.15 -0.94 0.23 0.00 0.00 176.35 175.84 2dl3 s SER 63 N 1.04 -0.02 0.00 2.29 1.04 -1.26 -4.63 113.70 112.15 2dl3 s SER 63 Ca 0.53 -0.08 0.00 0.00 0.48 0.00 0.00 55.95 56.88 2dl3 s SER 63 Cb -0.23 0.24 0.00 0.00 0.10 0.00 0.00 66.02 66.13 2dl3 s SER 63 CO 0.27 -0.30 0.00 0.61 0.98 0.00 0.00 173.24 174.80 2dl3 n GLY 64 N 1.78 -0.82 3.57 7.32 0.00 -1.26 -5.09 105.19 110.69 2dl3 n GLY 64 Ca -0.20 0.54 -0.40 0.00 0.00 0.00 0.00 46.02 45.95 2dl3 n GLY 64 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2dl3 s PRO 65 N 0.44 2.87 -0.01 1.61 0.04 -1.26 -4.87 135.00 133.82 2dl3 s PRO 65 Ca 0.00 0.83 -0.25 0.00 0.04 0.00 0.00 61.00 61.62 2dl3 s PRO 65 Cb 0.00 -4.31 -0.20 0.00 0.04 0.00 0.00 34.50 30.03 2dl3 s PRO 65 CO 0.00 -2.43 1.29 1.03 0.04 0.00 0.00 177.00 176.93 2dl3 h SER 66 N 14.13 -0.03 -3.53 6.66 0.87 -2.04 -3.38 113.55 126.22 2dl3 h SER 66 Ca -0.28 -0.42 -0.76 0.00 -1.23 0.00 0.00 61.79 59.10 2dl3 h SER 66 Cb 1.16 0.01 -0.27 0.00 -0.44 0.00 0.00 62.40 62.85 2dl3 h SER 66 CO 1.16 0.41 -0.15 -0.55 -0.53 0.00 0.00 176.83 177.18 2dl3 s SER 67 N -5.60 6.20 0.00 6.23 0.15 -1.26 -5.30 113.70 114.12 2dl3 s SER 67 Ca -0.15 -2.29 0.07 0.00 0.70 0.00 0.00 55.95 54.28 2dl3 s SER 67 Cb 0.02 -2.13 0.43 0.00 -1.71 0.00 0.00 66.02 62.63 2dl3 s SER 67 CO 0.66 -0.66 0.89 0.61 1.20 0.00 0.00 173.24 175.94