#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 0.00 -4.07 1.61 0.02 -2.14 -3.46 113.55 105.51 2dl3 h SER 2 Ca 0.00 -0.54 -0.53 0.00 -0.84 0.00 0.00 61.79 59.88 2dl3 h SER 2 Cb 0.00 0.00 0.11 0.00 0.14 0.00 0.00 62.40 62.65 2dl3 h SER 2 CO 0.00 0.78 0.49 -0.55 -1.14 0.00 0.00 176.83 176.41 2dl3 s SER 3 N -5.92 5.36 -0.26 3.07 0.15 -1.26 -5.03 113.70 109.80 2dl3 s SER 3 Ca -0.11 2.43 -0.02 0.00 0.70 0.00 0.00 55.95 58.96 2dl3 s SER 3 Cb -0.02 -2.60 0.15 0.00 -1.71 0.00 0.00 66.02 61.84 2dl3 s SER 3 CO 0.38 -1.48 0.43 -0.83 1.20 0.00 0.00 173.24 172.94 2dl3 s GLY 4 N -1.46 -0.56 -0.72 9.45 0.00 -1.26 -5.03 107.32 107.74 2dl3 s GLY 4 Ca 0.74 1.07 -0.00 0.00 0.00 0.00 0.00 44.72 46.53 2dl3 s GLY 4 CO 0.35 2.85 1.82 1.44 0.00 0.00 0.00 173.10 179.57 2dl3 n SER 5 N 5.38 6.93 -0.02 1.64 7.64 -1.26 -4.70 113.62 129.23 2dl3 n SER 5 Ca -0.03 -3.81 0.01 0.00 1.01 0.00 0.00 58.87 56.06 2dl3 n SER 5 Cb 0.50 -0.91 0.32 0.00 -1.01 0.00 0.00 64.21 63.11 2dl3 n SER 5 CO 0.00 0.00 0.00 0.77 -3.01 0.00 0.00 175.04 172.80 2dl3 h SER 6 N 2.72 0.52 -3.64 6.43 4.64 -1.96 -3.44 113.55 118.83 2dl3 h SER 6 Ca 0.52 -0.07 -0.53 0.00 -0.47 0.00 0.00 61.79 61.23 2dl3 h SER 6 Cb 0.39 -0.14 0.21 0.00 -0.31 0.00 0.00 62.40 62.55 2dl3 h SER 6 CO 1.33 0.52 -0.30 0.61 -0.87 0.00 0.00 176.83 178.11 2dl3 n GLY 7 N -1.06 -1.43 3.30 -0.77 0.00 -1.26 -4.86 105.19 99.12 2dl3 n GLY 7 Ca 0.02 -0.67 -0.29 0.00 0.00 0.00 0.00 46.02 45.08 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 -3.78 1.74 0.12 1.61 0.52 -0.59 -4.80 118.95 113.77 2dl3 s ARG 8 Ca 0.62 -1.00 -0.31 0.00 -0.52 0.00 0.00 55.73 54.52 2dl3 s ARG 8 Cb -0.24 -1.83 -0.08 0.00 0.52 0.00 0.00 34.95 33.32 2dl3 s ARG 8 CO 0.63 0.48 1.36 -1.25 0.02 0.00 0.00 175.30 176.54 2dl3 s PRO 9 N -1.03 4.34 -0.05 3.54 0.04 -1.26 -1.22 135.00 139.36 2dl3 s PRO 9 Ca 0.10 2.03 -0.03 0.00 0.04 0.00 0.00 61.00 63.15 2dl3 s PRO 9 Cb -0.09 -3.26 0.03 0.00 0.04 0.00 0.00 34.50 31.22 2dl3 s PRO 9 CO 0.01 -0.40 0.12 0.00 0.04 0.00 0.00 177.00 176.78 2dl3 s ALA 10 N 1.01 -0.21 -0.19 8.56 0.00 -0.65 -1.35 121.76 128.92 2dl3 s ALA 10 Ca 0.63 0.56 -0.09 0.00 0.00 0.00 0.00 51.96 53.06 2dl3 s ALA 10 Cb -0.36 -0.38 -0.05 0.00 0.00 0.00 0.00 23.12 22.34 2dl3 s ALA 10 CO 0.31 -0.13 0.10 0.50 0.00 0.00 0.00 175.76 176.54 2dl3 s ARG 11 N 0.97 4.04 -0.30 0.00 3.52 -0.79 -1.78 118.95 124.62 2dl3 s ARG 11 Ca -0.08 -0.26 -0.29 0.00 -0.13 0.00 0.00 55.73 54.98 2dl3 s ARG 11 Cb -0.10 -3.32 -0.01 0.00 -1.56 0.00 0.00 34.95 29.96 2dl3 s ARG 11 CO -0.04 0.33 1.60 0.00 -0.81 0.00 0.00 175.30 176.37 2dl3 s ALA 12 N 0.24 3.12 0.14 6.12 0.00 -0.75 -0.50 121.76 130.13 2dl3 s ALA 12 Ca 0.07 0.25 -0.08 0.00 0.00 0.00 0.00 51.96 52.21 2dl3 s ALA 12 Cb -0.12 -3.91 -0.05 0.00 0.00 0.00 0.00 23.12 19.05 2dl3 s ALA 12 CO -0.01 -2.21 1.38 0.87 0.00 0.00 0.00 175.76 175.79 2dl3 h LYS 13 N 11.18 0.65 -5.02 0.00 1.79 0.27 0.74 116.57 126.18 2dl3 h LYS 13 Ca -0.32 -0.50 -0.36 0.00 -2.18 0.00 0.00 60.65 57.29 2dl3 h LYS 13 Cb 1.14 0.10 -0.14 0.00 -1.58 0.00 0.00 32.23 31.74 2dl3 h LYS 13 CO 1.03 1.12 -0.66 -0.06 -1.08 0.00 0.00 179.45 179.80 2dl3 s PHE 14 N -3.77 1.47 -0.60 -1.35 0.40 -1.04 -4.77 117.98 108.32 2dl3 s PHE 14 Ca -0.08 -0.94 -0.28 0.00 -0.60 0.00 0.00 56.93 55.03 2dl3 s PHE 14 Cb 0.10 -0.84 0.03 0.00 0.51 0.00 0.00 43.02 42.81 2dl3 s PHE 14 CO 0.88 -0.08 1.21 0.16 0.70 0.00 0.00 175.22 178.09 2dl3 s ASP 15 N -3.27 6.41 0.17 1.36 1.47 -1.26 -4.21 116.67 117.34 2dl3 s ASP 15 Ca 0.27 0.05 -0.14 0.00 1.18 0.00 0.00 52.55 53.91 2dl3 s ASP 15 Cb 0.06 -2.55 -0.07 0.00 -0.34 0.00 0.00 42.92 40.01 2dl3 s ASP 15 CO 0.07 -1.53 0.57 0.12 0.68 0.00 0.00 175.17 175.08 2dl3 s PHE 16 N 5.08 3.56 -0.15 2.11 2.19 0.24 -4.94 117.98 126.08 2dl3 s PHE 16 Ca 0.42 1.05 0.02 0.00 0.33 0.00 0.00 56.93 58.75 2dl3 s PHE 16 Cb -0.08 -2.37 0.01 0.00 -1.31 0.00 0.00 43.02 39.27 2dl3 s PHE 16 CO 0.24 0.38 -0.20 0.21 1.83 0.00 0.00 175.22 177.68 2dl3 s LYS 17 N -2.17 3.06 -0.36 10.12 2.47 -1.26 -1.97 119.74 129.63 2dl3 s LYS 17 Ca 0.41 -0.83 -0.17 0.00 -1.56 0.00 0.00 55.97 53.82 2dl3 s LYS 17 Cb -0.14 -2.49 -0.00 0.00 -1.46 0.00 0.00 37.83 33.74 2dl3 s LYS 17 CO 0.20 -0.02 0.46 0.00 0.16 0.00 0.00 175.35 176.14 2dl3 s ALA 18 N 0.85 3.47 0.07 3.13 0.00 -1.26 -4.89 121.76 123.14 2dl3 s ALA 18 Ca -0.06 -1.14 -0.17 0.00 0.00 0.00 0.00 51.96 50.59 2dl3 s ALA 18 Cb -0.15 -2.96 -0.12 0.00 0.00 0.00 0.00 23.12 19.89 2dl3 s ALA 18 CO -0.02 -1.23 1.37 1.96 0.00 0.00 0.00 175.76 177.84 2dl3 h GLN 19 N 8.50 0.56 -5.07 0.00 4.20 -1.97 -3.46 115.11 117.87 2dl3 h GLN 19 Ca -0.28 -0.31 -0.61 0.00 0.06 0.00 0.00 58.65 57.51 2dl3 h GLN 19 Cb 1.13 0.02 -0.13 0.00 0.30 0.00 0.00 27.48 28.80 2dl3 h GLN 19 CO 0.75 0.91 -0.50 0.95 -0.67 0.00 0.00 178.83 180.27 2dl3 s THR 20 N -4.26 0.70 0.14 -0.54 -4.23 -1.26 -5.05 115.64 101.15 2dl3 s THR 20 Ca -0.13 -2.00 -0.17 0.00 -1.18 0.00 0.00 61.69 58.21 2dl3 s THR 20 Cb 0.07 -2.24 -0.01 0.00 1.34 0.00 0.00 72.50 71.67 2dl3 s THR 20 CO 0.80 0.00 1.76 -0.07 -0.54 0.00 0.00 174.62 176.57 2dl3 h LEU 21 N 1.61 0.18 -0.95 4.79 4.07 -1.99 -2.36 115.31 120.65 2dl3 h LEU 21 Ca -0.37 0.02 0.35 0.00 0.08 0.00 0.00 57.88 57.96 2dl3 h LEU 21 Cb 1.29 -0.01 -0.17 0.00 1.08 0.00 0.00 40.66 42.85 2dl3 h LEU 21 CO 0.61 0.14 0.36 0.29 -1.08 0.00 0.00 178.44 178.75 2dl3 n LYS 22 N -4.99 -0.06 -3.73 1.13 5.02 -1.26 -4.31 118.16 109.97 2dl3 n LYS 22 Ca -0.00 1.34 -0.28 0.00 -2.02 0.00 0.00 58.31 57.35 2dl3 n LYS 22 Cb 0.09 -2.32 -0.03 0.00 -0.02 0.00 0.00 35.03 32.74 2dl3 n LYS 22 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 2dl3 s GLU 23 N -5.60 3.53 -0.07 1.97 2.02 -0.89 -0.91 118.70 118.75 2dl3 s GLU 23 Ca -0.10 -0.32 0.05 0.00 0.02 0.00 0.00 54.97 54.62 2dl3 s GLU 23 Cb 0.31 -2.87 -0.00 0.00 0.10 0.00 0.00 34.13 31.67 2dl3 s GLU 23 CO 0.74 0.44 -0.23 -1.17 0.02 0.00 0.00 175.26 175.06 2dl3 s LEU 24 N -3.13 2.03 0.38 1.80 2.96 -0.85 -4.69 118.68 117.18 2dl3 s LEU 24 Ca 0.38 -0.49 -0.26 0.00 -0.22 0.00 0.00 54.13 53.54 2dl3 s LEU 24 Cb -0.11 -1.30 -0.09 0.00 0.50 0.00 0.00 46.19 45.19 2dl3 s LEU 24 CO 0.28 0.19 1.20 -2.16 -1.32 0.00 0.00 176.35 174.54 2dl3 s PRO 25 N 0.08 4.14 -0.07 0.98 0.04 -1.26 -4.55 135.00 134.36 2dl3 s PRO 25 Ca -0.09 1.93 -0.00 0.00 0.04 0.00 0.00 61.00 62.87 2dl3 s PRO 25 Cb -0.15 -2.79 0.02 0.00 0.04 0.00 0.00 34.50 31.63 2dl3 s PRO 25 CO 0.05 -0.27 -0.03 -0.51 0.04 0.00 0.00 177.00 176.28 2dl3 s LEU 26 N -2.29 0.99 0.12 -3.56 1.43 -0.83 -4.97 118.68 109.57 2dl3 s LEU 26 Ca 0.55 -0.13 -0.14 0.00 -1.03 0.00 0.00 54.13 53.38 2dl3 s LEU 26 Cb -0.33 -0.50 -0.07 0.00 0.03 0.00 0.00 46.19 45.33 2dl3 s LEU 26 CO 0.42 -0.12 0.51 -1.58 0.23 0.00 0.00 176.35 175.81 2dl3 s GLN 27 N 1.48 3.95 -0.56 1.70 2.00 -1.26 0.82 119.66 127.80 2dl3 s GLN 27 Ca -0.02 0.45 -0.32 0.00 -2.00 0.00 0.00 55.36 53.47 2dl3 s GLN 27 Cb -0.13 -2.99 -0.13 0.00 0.80 0.00 0.00 33.01 30.56 2dl3 s GLN 27 CO -0.03 0.52 2.38 1.17 -0.50 0.00 0.00 175.29 178.83 2dl3 n LYS 28 N 0.97 0.77 -0.56 1.67 4.81 -1.26 -1.50 118.16 123.06 2dl3 n LYS 28 Ca -0.07 0.13 0.00 0.00 -0.87 0.00 0.00 58.31 57.50 2dl3 n LYS 28 Cb 0.52 -2.47 0.00 0.00 0.02 0.00 0.00 35.03 33.10 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 6.41 0.75 3.50 3.14 0.00 0.25 -5.00 105.19 114.25 2dl3 n GLY 29 Ca 0.47 -0.14 -0.34 0.00 0.00 0.00 0.00 46.02 46.01 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 -1.88 4.51 -0.35 1.61 1.11 -0.56 -4.83 116.67 116.27 2dl3 s ASP 30 Ca 0.00 -0.13 -0.18 0.00 0.18 0.00 0.00 52.55 52.42 2dl3 s ASP 30 Cb 0.00 -1.42 -0.00 0.00 1.07 0.00 0.00 42.92 42.57 2dl3 s ASP 30 CO 0.00 0.26 0.53 -0.63 1.18 0.00 0.00 175.17 176.51 2dl3 s ILE 31 N -0.21 5.00 0.27 0.77 -1.09 -1.26 -1.81 121.20 122.87 2dl3 s ILE 31 Ca 0.02 0.36 0.09 0.00 -2.23 0.00 0.00 60.65 58.89 2dl3 s ILE 31 Cb -0.13 -3.98 -0.05 0.00 -1.58 0.00 0.00 42.46 36.72 2dl3 s ILE 31 CO 0.03 -0.23 -0.12 0.68 -1.23 0.00 0.00 174.94 174.07 2dl3 s VAL 32 N 2.42 1.97 -0.28 2.92 -7.23 -0.73 -4.96 120.40 114.51 2dl3 s VAL 32 Ca 0.19 -2.22 -0.00 0.00 -1.81 0.00 0.00 61.98 58.14 2dl3 s VAL 32 Cb -0.15 -2.35 0.05 0.00 0.56 0.00 0.00 36.38 34.48 2dl3 s VAL 32 CO 0.13 -0.38 -0.04 -0.31 -0.31 0.00 0.00 175.10 174.19 2dl3 s TYR 33 N -2.81 3.24 -0.40 2.82 2.02 -1.25 -1.63 117.35 119.33 2dl3 s TYR 33 Ca 0.28 -1.98 -0.28 0.00 -0.37 0.00 0.00 57.07 54.73 2dl3 s TYR 33 Cb 0.00 -2.04 0.02 0.00 -0.40 0.00 0.00 41.96 39.54 2dl3 s TYR 33 CO 0.12 -0.82 1.04 0.42 -1.57 0.00 0.00 175.55 174.74 2dl3 s ILE 34 N 1.21 4.43 -0.06 2.71 1.01 -0.36 -2.82 121.20 127.32 2dl3 s ILE 34 Ca -0.06 1.33 -0.23 0.00 0.00 0.00 0.00 60.65 61.69 2dl3 s ILE 34 Cb -0.19 -4.45 -0.31 0.00 0.01 0.00 0.00 42.46 37.52 2dl3 s ILE 34 CO -0.03 -0.69 0.87 1.88 0.00 0.00 0.00 174.94 176.97 2dl3 h TYR 35 N 8.65 0.47 -4.46 3.97 0.05 -0.93 -1.56 116.97 123.16 2dl3 h TYR 35 Ca -0.22 -0.34 -0.22 0.00 0.05 0.00 0.00 58.73 58.00 2dl3 h TYR 35 Cb 1.07 -0.02 -0.14 0.00 1.01 0.00 0.00 36.73 38.65 2dl3 h TYR 35 CO 0.88 1.27 -0.54 -1.59 -1.05 0.00 0.00 178.16 177.13 2dl3 s LYS 36 N -2.40 1.27 -0.27 4.88 -2.85 -1.07 -4.76 119.74 114.54 2dl3 s LYS 36 Ca -0.14 -1.59 -0.04 0.00 -1.00 0.00 0.00 55.97 53.20 2dl3 s LYS 36 Cb 0.00 0.30 0.02 0.00 -2.06 0.00 0.00 37.83 36.10 2dl3 s LYS 36 CO 0.81 -0.44 -0.00 -1.14 0.10 0.00 0.00 175.35 174.68 2dl3 s GLN 37 N -4.11 2.90 0.02 1.78 0.74 -1.26 -1.09 119.66 118.63 2dl3 s GLN 37 Ca 0.37 -0.95 -0.16 0.00 0.05 0.00 0.00 55.36 54.67 2dl3 s GLN 37 Cb 0.06 -3.15 -0.09 0.00 1.10 0.00 0.00 33.01 30.93 2dl3 s GLN 37 CO 0.12 -0.43 1.10 0.82 -0.55 0.00 0.00 175.29 176.35 2dl3 h ILE 38 N 6.05 0.00 -2.87 -2.34 1.08 -1.75 -3.48 117.51 114.21 2dl3 h ILE 38 Ca -0.31 -0.07 -0.51 0.00 -0.39 0.00 0.00 64.86 63.58 2dl3 h ILE 38 Cb 1.11 0.00 -0.14 0.00 -3.07 0.00 0.00 36.82 34.73 2dl3 h ILE 38 CO 0.58 0.00 -0.55 -1.81 -0.69 0.00 0.00 178.15 175.68 2dl3 s ASP 39 N -3.14 2.46 0.21 1.72 1.01 -1.19 -4.95 116.67 112.80 2dl3 s ASP 39 Ca -0.08 -1.56 0.16 0.00 0.71 0.00 0.00 52.55 51.77 2dl3 s ASP 39 Cb 0.01 0.31 0.81 0.00 1.01 0.00 0.00 42.92 45.06 2dl3 s ASP 39 CO 0.25 -0.82 1.48 1.67 0.21 0.00 0.00 175.17 177.96 2dl3 n GLN 40 N -0.79 0.10 -0.09 8.23 -0.06 -1.26 -1.34 117.38 122.18 2dl3 n GLN 40 Ca -0.04 0.56 0.02 0.00 -2.00 0.00 0.00 57.00 55.54 2dl3 n GLN 40 Cb 0.65 -1.80 0.02 0.00 -4.06 0.00 0.00 30.24 25.05 2dl3 n GLN 40 CO 0.00 0.00 0.00 0.09 -0.20 0.00 0.00 177.06 176.95 2dl3 n ASN 41 N -2.02 1.13 -4.24 1.69 4.13 -1.26 -4.98 115.26 109.71 2dl3 n ASN 41 Ca -0.00 -1.87 -0.14 0.00 1.68 0.00 0.00 54.58 54.25 2dl3 n ASN 41 Cb 0.05 -0.10 -0.10 0.00 -1.54 0.00 0.00 39.78 38.09 2dl3 n ASN 41 CO 0.00 0.00 0.00 0.26 0.28 0.00 0.00 177.26 177.80 2dl3 s TRP 42 N -0.85 1.21 0.31 3.10 0.52 -0.45 -2.61 118.94 120.17 2dl3 s TRP 42 Ca 0.05 -1.01 0.03 0.00 0.02 0.00 0.00 56.10 55.20 2dl3 s TRP 42 Cb 0.05 -0.69 -0.01 0.00 -1.15 0.00 0.00 33.47 31.67 2dl3 s TRP 42 CO 0.01 -0.20 0.34 0.66 0.02 0.00 0.00 176.95 177.77 2dl3 n TYR 43 N -0.24 -0.99 -3.67 -1.98 4.01 0.26 -3.14 117.16 111.39 2dl3 n TYR 43 Ca -0.07 -2.37 -0.10 0.00 -0.16 0.00 0.00 57.90 55.20 2dl3 n TYR 43 Cb 0.63 0.37 -0.11 0.00 -0.31 0.00 0.00 39.34 39.92 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 -3.01 0.31 0.00 -0.72 2.12 -0.25 -1.61 118.70 115.53 2dl3 s GLU 44 Ca 0.32 0.89 0.00 0.00 0.36 0.00 0.00 54.97 56.54 2dl3 s GLU 44 Cb 0.01 0.15 0.00 0.00 0.26 0.00 0.00 34.13 34.54 2dl3 s GLU 44 CO 0.23 -0.22 0.00 0.41 -0.54 0.00 0.00 175.26 175.13 2dl3 n GLY 45 N 4.98 3.98 3.28 -1.50 0.00 -0.79 -0.22 105.19 114.93 2dl3 n GLY 45 Ca -0.14 -0.94 -0.18 0.00 0.00 0.00 0.00 46.02 44.76 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 1.28 1.15 -0.30 1.61 2.12 -1.13 -1.85 118.70 121.58 2dl3 s GLU 46 Ca 0.00 -1.37 -0.13 0.00 0.36 0.00 0.00 54.97 53.83 2dl3 s GLU 46 Cb 0.00 -1.01 0.13 0.00 0.26 0.00 0.00 34.13 33.52 2dl3 s GLU 46 CO 0.00 0.18 0.78 -1.58 -0.54 0.00 0.00 175.26 174.10 2dl3 s HIS 47 N -2.44 -1.06 -1.53 5.30 2.46 0.17 -3.92 115.29 114.27 2dl3 s HIS 47 Ca 0.14 1.89 -0.11 0.00 0.47 0.00 0.00 55.06 57.45 2dl3 s HIS 47 Cb -0.03 0.64 0.08 0.00 -0.13 0.00 0.00 32.58 33.13 2dl3 s HIS 47 CO 0.04 -0.53 0.82 1.58 -2.47 0.00 0.00 174.74 174.19 2dl3 n HIS 48 N 5.02 -2.03 -1.50 3.88 -0.00 -1.26 0.01 115.22 119.34 2dl3 n HIS 48 Ca -0.13 0.85 -0.10 0.00 -0.00 0.00 0.00 57.72 58.35 2dl3 n HIS 48 Cb 0.52 -3.75 -0.03 0.00 -0.00 0.00 0.00 29.99 26.73 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 -1.65 0.83 2.92 1.57 0.00 -1.26 -5.01 105.19 102.60 2dl3 n GLY 49 Ca -0.04 -0.57 -0.27 0.00 0.00 0.00 0.00 46.02 45.14 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 -3.23 1.62 -0.22 1.61 3.52 0.10 -5.12 118.95 117.23 2dl3 s ARG 50 Ca 0.00 -0.29 -0.09 0.00 -0.13 0.00 0.00 55.73 55.22 2dl3 s ARG 50 Cb 0.00 -1.65 -0.05 0.00 -1.56 0.00 0.00 34.95 31.70 2dl3 s ARG 50 CO 0.00 -0.26 0.12 0.08 -0.81 0.00 0.00 175.30 174.43 2dl3 s VAL 51 N 1.68 5.13 0.40 7.11 1.01 -1.26 0.41 120.40 134.88 2dl3 s VAL 51 Ca 0.05 0.10 -0.15 0.00 0.00 0.00 0.00 61.98 61.98 2dl3 s VAL 51 Cb -0.13 -3.36 0.06 0.00 0.00 0.00 0.00 36.38 32.95 2dl3 s VAL 51 CO -0.08 0.40 0.80 -0.83 0.00 0.00 0.00 175.10 175.38 2dl3 s GLY 52 N 0.77 0.44 0.23 4.51 0.00 -0.77 -4.93 107.32 107.57 2dl3 s GLY 52 Ca 0.06 -0.81 0.05 0.00 0.00 0.00 0.00 44.72 44.02 2dl3 s GLY 52 CO 0.02 -0.34 0.30 -0.26 0.00 0.00 0.00 173.10 172.81 2dl3 s ILE 53 N -2.11 5.02 -0.03 0.90 -4.36 -0.08 -1.88 121.20 118.65 2dl3 s ILE 53 Ca 0.16 -1.07 -0.29 0.00 -0.26 0.00 0.00 60.65 59.19 2dl3 s ILE 53 Cb -0.05 -3.70 0.10 0.00 1.25 0.00 0.00 42.46 40.06 2dl3 s ILE 53 CO 0.12 -0.30 0.84 0.72 0.24 0.00 0.00 174.94 176.56 2dl3 s PHE 54 N -1.99 -0.44 0.32 1.37 -0.12 -0.64 -2.01 117.98 114.48 2dl3 s PHE 54 Ca 0.34 0.53 -0.28 0.00 -0.05 0.00 0.00 56.93 57.46 2dl3 s PHE 54 Cb -0.09 0.49 -0.10 0.00 -0.63 0.00 0.00 43.02 42.69 2dl3 s PHE 54 CO 0.28 -0.54 1.22 -1.25 -0.05 0.00 0.00 175.22 174.87 2dl3 s PRO 55 N -2.25 4.40 0.13 1.99 0.04 -1.26 0.89 135.00 138.93 2dl3 s PRO 55 Ca -0.01 2.03 -0.12 0.00 0.04 0.00 0.00 61.00 62.94 2dl3 s PRO 55 Cb -0.01 -3.05 -0.07 0.00 0.04 0.00 0.00 34.50 31.41 2dl3 s PRO 55 CO -0.03 -0.08 1.44 0.07 0.04 0.00 0.00 177.00 178.44 2dl3 h ARG 56 N 3.41 0.87 -0.43 4.56 0.11 -1.79 -2.95 114.38 118.17 2dl3 h ARG 56 Ca -0.48 -0.49 0.12 0.00 0.10 0.00 0.00 59.98 59.23 2dl3 h ARG 56 Cb 1.22 0.03 -0.02 0.00 1.11 0.00 0.00 29.97 32.32 2dl3 h ARG 56 CO 0.65 1.14 0.53 0.00 0.10 0.00 0.00 179.97 182.40 2dl3 h THR 57 N 0.67 0.27 0.03 0.08 1.03 -1.93 0.56 112.91 113.61 2dl3 h THR 57 Ca 0.04 0.00 -0.22 0.00 -0.01 0.00 0.00 66.41 66.22 2dl3 h THR 57 Cb 1.02 0.56 -0.02 0.00 -1.07 0.00 0.00 68.15 68.64 2dl3 h THR 57 CO 0.10 0.00 -1.05 1.88 -0.01 0.00 0.00 175.52 176.44 2dl3 h TYR 58 N 0.00 0.10 -0.77 0.00 -1.99 -1.91 -3.47 116.97 108.94 2dl3 h TYR 58 Ca 0.20 -0.07 -0.57 0.00 2.00 0.00 0.00 58.73 60.29 2dl3 h TYR 58 Cb 1.27 -0.00 -0.05 0.00 2.00 0.00 0.00 36.73 39.95 2dl3 h TYR 58 CO 0.00 1.06 -0.32 0.96 -0.00 0.00 0.00 178.16 179.85 2dl3 s ILE 59 N -2.70 1.84 -0.20 -2.88 -5.25 0.20 0.93 121.20 113.13 2dl3 s ILE 59 Ca -0.00 -1.48 -0.04 0.00 -0.99 0.00 0.00 60.65 58.14 2dl3 s ILE 59 Cb 0.09 -2.32 0.10 0.00 2.95 0.00 0.00 42.46 43.28 2dl3 s ILE 59 CO 0.83 0.00 0.24 -0.70 -1.79 0.00 0.00 174.94 173.53 2dl3 s GLU 60 N -4.24 0.21 -0.14 0.37 2.12 0.34 -4.73 118.70 112.63 2dl3 s GLU 60 Ca 0.37 0.29 -0.34 0.00 0.36 0.00 0.00 54.97 55.64 2dl3 s GLU 60 Cb -0.02 -1.03 -0.12 0.00 0.26 0.00 0.00 34.13 33.23 2dl3 s GLU 60 CO 0.22 -0.63 1.92 1.28 -0.54 0.00 0.00 175.26 177.52 2dl3 n LEU 61 N 5.33 3.24 -0.03 2.70 4.77 -1.26 -1.89 117.00 129.85 2dl3 n LEU 61 Ca -0.05 0.89 -0.15 0.00 -0.03 0.00 0.00 56.01 56.67 2dl3 n LEU 61 Cb 0.50 -1.35 -0.11 0.00 -2.33 0.00 0.00 43.42 40.12 2dl3 n LEU 61 CO 0.07 -0.18 0.41 -0.07 -1.33 0.00 0.00 177.39 176.30 2dl3 h LEU 62 N 9.69 0.18-10.69 2.23 3.38 -1.58 -3.46 115.31 115.05 2dl3 h LEU 62 Ca -0.46 -0.78 -0.46 0.00 0.09 0.00 0.00 57.88 56.27 2dl3 h LEU 62 Cb 1.28 -0.05 0.13 0.00 0.09 0.00 0.00 40.66 42.10 2dl3 h LEU 62 CO 0.96 0.94 0.41 -0.94 0.09 0.00 0.00 178.44 179.89 2dl3 s SER 63 N -6.25 3.83 0.00 -0.43 1.04 -1.25 -5.06 113.70 105.58 2dl3 s SER 63 Ca -0.16 0.58 0.00 0.00 0.48 0.00 0.00 55.95 56.85 2dl3 s SER 63 Cb 0.00 -0.89 0.00 0.00 0.10 0.00 0.00 66.02 65.23 2dl3 s SER 63 CO 0.73 -2.31 0.00 0.61 0.98 0.00 0.00 173.24 173.25 2dl3 n GLY 64 N -3.40 3.88 3.67 7.32 0.00 -1.26 -5.02 105.19 110.38 2dl3 n GLY 64 Ca 0.11 -1.58 -0.42 0.00 0.00 0.00 0.00 46.02 44.12 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 -2.56 4.21 0.04 1.61 0.04 -1.26 -5.02 135.00 132.07 2dl3 s PRO 65 Ca 0.00 2.01 0.02 0.00 0.04 0.00 0.00 61.00 63.07 2dl3 s PRO 65 Cb 0.00 -3.84 -0.04 0.00 0.04 0.00 0.00 34.50 30.66 2dl3 s PRO 65 CO 0.00 -0.76 0.07 0.45 0.04 0.00 0.00 177.00 176.80 2dl3 s SER 66 N 2.68 5.52 0.16 6.66 0.15 -1.26 -5.02 113.70 122.58 2dl3 s SER 66 Ca 0.67 0.04 -0.16 0.00 0.70 0.00 0.00 55.95 57.20 2dl3 s SER 66 Cb -0.30 -1.51 0.04 0.00 -1.71 0.00 0.00 66.02 62.54 2dl3 s SER 66 CO 0.25 0.22 1.79 -1.28 1.20 0.00 0.00 173.24 175.42 2dl3 h SER 67 N 3.66 0.37 0.00 5.45 0.87 -2.08 -3.57 113.55 118.25 2dl3 h SER 67 Ca -0.48 0.01 0.00 0.00 -1.23 0.00 0.00 61.79 60.09 2dl3 h SER 67 Cb 1.17 -0.07 0.00 0.00 -0.44 0.00 0.00 62.40 63.06 2dl3 h SER 67 CO 0.64 0.26 0.00 0.61 -0.53 0.00 0.00 176.83 177.81