#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dl3 n SER 2 N 0.00 1.90 -3.54 1.61 2.88 -1.26 -4.99 113.62 110.22 2dl3 n SER 2 Ca 0.00 0.14 -0.01 0.00 -1.33 0.00 0.00 58.87 57.67 2dl3 n SER 2 Cb 0.00 -0.57 -0.05 0.00 -0.75 0.00 0.00 64.21 62.84 2dl3 n SER 2 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 2dl3 s SER 3 N -6.79 -0.73 0.00 -3.46 0.01 -1.26 -5.08 113.70 96.39 2dl3 s SER 3 Ca -0.32 1.05 0.00 0.00 1.31 0.00 0.00 55.95 57.99 2dl3 s SER 3 Cb 0.11 1.66 0.00 0.00 0.21 0.00 0.00 66.02 68.00 2dl3 s SER 3 CO 0.46 -0.15 0.00 0.61 0.41 0.00 0.00 173.24 174.56 2dl3 n GLY 4 N 4.69 0.95 3.55 3.44 0.00 -1.26 -4.90 105.19 111.66 2dl3 n GLY 4 Ca -0.13 -0.84 -0.42 0.00 0.00 0.00 0.00 46.02 44.63 2dl3 n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dl3 s SER 5 N -4.00 6.37 -0.10 1.61 0.01 -1.26 -5.05 113.70 111.29 2dl3 s SER 5 Ca 0.00 -0.04 0.01 0.00 1.31 0.00 0.00 55.95 57.23 2dl3 s SER 5 Cb 0.00 -2.31 -0.02 0.00 0.21 0.00 0.00 66.02 63.90 2dl3 s SER 5 CO 0.00 -0.63 -0.12 -0.44 0.41 0.00 0.00 173.24 172.46 2dl3 s SER 6 N 1.85 4.14 0.27 2.44 0.01 -1.26 -4.68 113.70 116.47 2dl3 s SER 6 Ca 0.23 -0.23 -0.19 0.00 1.31 0.00 0.00 55.95 57.06 2dl3 s SER 6 Cb -0.15 -1.29 -0.09 0.00 0.21 0.00 0.00 66.02 64.70 2dl3 s SER 6 CO 0.16 0.25 0.77 -0.83 0.41 0.00 0.00 173.24 174.00 2dl3 s GLY 7 N -0.17 2.56 -0.04 3.44 0.00 -1.26 -4.77 107.32 107.08 2dl3 s GLY 7 Ca 0.00 0.20 -0.02 0.00 0.00 0.00 0.00 44.72 44.90 2dl3 s GLY 7 CO 0.03 0.53 0.07 0.50 0.00 0.00 0.00 173.10 174.22 2dl3 s ARG 8 N -2.31 3.09 0.56 2.90 3.00 -0.46 -4.54 118.95 121.19 2dl3 s ARG 8 Ca 0.48 -0.42 -0.19 0.00 0.00 0.00 0.00 55.73 55.60 2dl3 s ARG 8 Cb -0.15 -2.88 -0.05 0.00 0.00 0.00 0.00 34.95 31.87 2dl3 s ARG 8 CO 0.20 0.68 1.12 -1.25 0.00 0.00 0.00 175.30 176.05 2dl3 s PRO 9 N -1.42 3.26 -0.25 3.54 0.04 -1.26 -0.20 135.00 138.71 2dl3 s PRO 9 Ca 0.19 1.57 -0.26 0.00 0.04 0.00 0.00 61.00 62.54 2dl3 s PRO 9 Cb -0.12 -2.00 0.08 0.00 0.04 0.00 0.00 34.50 32.51 2dl3 s PRO 9 CO 0.09 -0.92 0.78 0.00 0.04 0.00 0.00 177.00 176.99 2dl3 s ALA 10 N -1.88 -1.82 -0.13 8.56 0.00 -0.77 -3.29 121.76 122.43 2dl3 s ALA 10 Ca 0.72 1.92 -0.03 0.00 0.00 0.00 0.00 51.96 54.56 2dl3 s ALA 10 Cb -0.23 -1.08 -0.03 0.00 0.00 0.00 0.00 23.12 21.78 2dl3 s ALA 10 CO 0.30 -0.32 -0.03 0.50 0.00 0.00 0.00 175.76 176.20 2dl3 s ARG 11 N 0.15 3.45 -0.30 0.00 3.52 -0.42 -1.67 118.95 123.68 2dl3 s ARG 11 Ca -0.01 -0.49 -0.29 0.00 -0.13 0.00 0.00 55.73 54.81 2dl3 s ARG 11 Cb -0.04 -2.87 0.01 0.00 -1.56 0.00 0.00 34.95 30.49 2dl3 s ARG 11 CO 0.01 0.38 1.17 0.00 -0.81 0.00 0.00 175.30 176.05 2dl3 s ALA 12 N -0.01 3.47 0.01 6.12 0.00 -0.47 0.89 121.76 131.77 2dl3 s ALA 12 Ca 0.01 0.05 -0.21 0.00 0.00 0.00 0.00 51.96 51.82 2dl3 s ALA 12 Cb -0.13 -3.70 -0.19 0.00 0.00 0.00 0.00 23.12 19.09 2dl3 s ALA 12 CO 0.02 -1.55 1.20 0.87 0.00 0.00 0.00 175.76 176.30 2dl3 h LYS 13 N 8.51 0.36 -5.11 0.00 1.57 -0.15 0.58 116.57 122.33 2dl3 h LYS 13 Ca -0.23 -0.29 -0.68 0.00 -1.87 0.00 0.00 60.65 57.58 2dl3 h LYS 13 Cb 1.08 0.06 -0.13 0.00 0.08 0.00 0.00 32.23 33.31 2dl3 h LYS 13 CO 1.03 0.92 -0.50 -0.06 -0.57 0.00 0.00 179.45 180.27 2dl3 s PHE 14 N -3.67 1.75 -0.05 -1.35 0.40 -1.12 -4.60 117.98 109.33 2dl3 s PHE 14 Ca -0.14 -1.03 -0.19 0.00 -0.60 0.00 0.00 56.93 54.97 2dl3 s PHE 14 Cb 0.04 -1.55 -0.05 0.00 0.51 0.00 0.00 43.02 41.97 2dl3 s PHE 14 CO 0.78 0.15 0.53 0.16 0.70 0.00 0.00 175.22 177.54 2dl3 s ASP 15 N -3.89 6.83 -0.09 1.36 1.47 -1.26 -3.53 116.67 117.58 2dl3 s ASP 15 Ca 0.02 0.99 0.02 0.00 1.18 0.00 0.00 52.55 54.77 2dl3 s ASP 15 Cb 0.00 -2.32 0.01 0.00 -0.34 0.00 0.00 42.92 40.27 2dl3 s ASP 15 CO 0.01 0.08 -0.16 0.12 0.68 0.00 0.00 175.17 175.90 2dl3 s PHE 16 N 0.09 1.86 -0.19 2.11 2.19 0.15 -4.96 117.98 119.23 2dl3 s PHE 16 Ca 0.28 -0.78 -0.09 0.00 0.33 0.00 0.00 56.93 56.68 2dl3 s PHE 16 Cb -0.17 -1.32 -0.05 0.00 -1.31 0.00 0.00 43.02 40.17 2dl3 s PHE 16 CO 0.14 -0.38 0.11 0.15 1.83 0.00 0.00 175.22 177.07 2dl3 s LYS 17 N 0.73 4.05 -0.40 10.12 -0.14 -1.26 -0.72 119.74 132.12 2dl3 s LYS 17 Ca -0.12 -0.25 -0.16 0.00 -1.36 0.00 0.00 55.97 54.08 2dl3 s LYS 17 Cb -0.16 -3.34 0.01 0.00 -1.68 0.00 0.00 37.83 32.67 2dl3 s LYS 17 CO 0.03 0.34 0.38 0.00 -0.76 0.00 0.00 175.35 175.34 2dl3 s ALA 18 N 0.22 3.46 0.08 5.17 0.00 -1.26 -4.84 121.76 124.58 2dl3 s ALA 18 Ca 0.07 -1.47 -0.19 0.00 0.00 0.00 0.00 51.96 50.38 2dl3 s ALA 18 Cb -0.11 -2.95 -0.09 0.00 0.00 0.00 0.00 23.12 19.96 2dl3 s ALA 18 CO -0.01 -1.41 1.48 1.96 0.00 0.00 0.00 175.76 177.78 2dl3 h GLN 19 N 8.63 0.44 -4.98 0.00 4.20 -1.96 -3.46 115.11 117.97 2dl3 h GLN 19 Ca -0.28 -0.16 -0.52 0.00 0.06 0.00 0.00 58.65 57.75 2dl3 h GLN 19 Cb 1.12 -0.03 -0.13 0.00 0.30 0.00 0.00 27.48 28.74 2dl3 h GLN 19 CO 0.75 0.67 -0.52 0.95 -0.67 0.00 0.00 178.83 180.01 2dl3 s THR 20 N -4.79 0.42 0.18 -0.54 -4.23 -1.26 -5.05 115.64 100.36 2dl3 s THR 20 Ca -0.14 -2.00 -0.15 0.00 -1.18 0.00 0.00 61.69 58.23 2dl3 s THR 20 Cb 0.07 -2.41 0.12 0.00 1.34 0.00 0.00 72.50 71.62 2dl3 s THR 20 CO 0.75 0.00 1.68 -0.07 -0.54 0.00 0.00 174.62 176.44 2dl3 h LEU 21 N 1.93 -0.25 -0.84 4.79 3.38 -1.91 -1.64 115.31 120.77 2dl3 h LEU 21 Ca -0.33 0.12 0.23 0.00 0.09 0.00 0.00 57.88 57.99 2dl3 h LEU 21 Cb 1.26 0.22 -0.16 0.00 0.09 0.00 0.00 40.66 42.07 2dl3 h LEU 21 CO 0.51 -0.08 0.00 1.17 0.09 0.00 0.00 178.44 180.13 2dl3 n LYS 22 N -5.25 -0.07 -3.14 1.13 4.81 -1.26 -4.27 118.16 110.11 2dl3 n LYS 22 Ca 0.04 1.26 -0.22 0.00 -0.87 0.00 0.00 58.31 58.53 2dl3 n LYS 22 Cb 0.25 -2.00 0.01 0.00 0.02 0.00 0.00 35.03 33.31 2dl3 n LYS 22 CO 0.00 0.00 0.00 -1.21 1.17 0.00 0.00 177.40 177.36 2dl3 s GLU 23 N -5.81 3.08 -0.02 1.64 2.02 -0.62 0.81 118.70 119.80 2dl3 s GLU 23 Ca -0.11 -0.66 0.02 0.00 0.02 0.00 0.00 54.97 54.24 2dl3 s GLU 23 Cb 0.25 -2.64 0.00 0.00 0.10 0.00 0.00 34.13 31.84 2dl3 s GLU 23 CO 0.66 -0.17 -0.06 -1.17 0.02 0.00 0.00 175.26 174.53 2dl3 s LEU 24 N -4.44 1.77 0.40 1.80 2.96 -0.60 -4.38 118.68 116.19 2dl3 s LEU 24 Ca 0.47 -0.13 -0.25 0.00 -0.22 0.00 0.00 54.13 54.00 2dl3 s LEU 24 Cb -0.10 -0.41 -0.08 0.00 0.50 0.00 0.00 46.19 46.10 2dl3 s LEU 24 CO 0.36 0.04 1.19 -2.16 -1.32 0.00 0.00 176.35 174.46 2dl3 s PRO 25 N 0.22 4.04 -0.24 0.98 0.04 -1.26 -4.52 135.00 134.26 2dl3 s PRO 25 Ca -0.03 1.89 -0.03 0.00 0.04 0.00 0.00 61.00 62.87 2dl3 s PRO 25 Cb -0.07 -2.69 0.10 0.00 0.04 0.00 0.00 34.50 31.88 2dl3 s PRO 25 CO -0.00 -0.35 0.20 -0.51 0.04 0.00 0.00 177.00 176.39 2dl3 s LEU 26 N -2.48 0.07 0.33 -3.56 1.43 0.10 -4.96 118.68 109.62 2dl3 s LEU 26 Ca 0.57 -0.67 -0.26 0.00 -1.03 0.00 0.00 54.13 52.75 2dl3 s LEU 26 Cb -0.32 0.16 -0.10 0.00 0.03 0.00 0.00 46.19 45.97 2dl3 s LEU 26 CO 0.40 -0.37 0.98 -1.58 0.23 0.00 0.00 176.35 176.01 2dl3 s GLN 27 N 2.26 4.50 -0.59 1.70 -0.44 -1.26 0.30 119.66 126.13 2dl3 s GLN 27 Ca 0.07 1.40 -0.33 0.00 -2.50 0.00 0.00 55.36 54.01 2dl3 s GLN 27 Cb -0.15 -2.78 -0.14 0.00 -1.64 0.00 0.00 33.01 28.29 2dl3 s GLN 27 CO -0.23 0.19 2.38 1.17 0.50 0.00 0.00 175.29 179.30 2dl3 n LYS 28 N 0.49 0.63 0.00 1.67 4.81 -1.23 -1.30 118.16 123.22 2dl3 n LYS 28 Ca 0.02 0.11 0.00 0.00 -0.87 0.00 0.00 58.31 57.57 2dl3 n LYS 28 Cb 0.50 -2.28 0.00 0.00 0.02 0.00 0.00 35.03 33.27 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 6.53 1.05 3.51 3.14 0.00 0.20 -5.00 105.19 114.62 2dl3 n GLY 29 Ca 0.49 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 46.18 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 -2.00 4.64 -0.27 1.61 1.11 -0.42 -4.83 116.67 116.51 2dl3 s ASP 30 Ca 0.00 -0.12 -0.15 0.00 0.18 0.00 0.00 52.55 52.46 2dl3 s ASP 30 Cb 0.00 -1.55 -0.04 0.00 1.07 0.00 0.00 42.92 42.41 2dl3 s ASP 30 CO 0.00 0.24 0.38 -0.63 1.18 0.00 0.00 175.17 176.33 2dl3 s ILE 31 N -0.06 5.17 0.32 0.77 -1.09 -1.26 -1.36 121.20 123.69 2dl3 s ILE 31 Ca 0.01 0.56 0.05 0.00 -2.23 0.00 0.00 60.65 59.04 2dl3 s ILE 31 Cb -0.13 -3.71 -0.06 0.00 -1.58 0.00 0.00 42.46 36.98 2dl3 s ILE 31 CO 0.03 0.15 0.00 0.68 -1.23 0.00 0.00 174.94 174.57 2dl3 s VAL 32 N 2.08 1.51 -0.26 2.92 -7.23 -0.67 -4.94 120.40 113.80 2dl3 s VAL 32 Ca 0.15 -2.05 0.02 0.00 -1.81 0.00 0.00 61.98 58.29 2dl3 s VAL 32 Cb -0.16 -2.69 0.05 0.00 0.56 0.00 0.00 36.38 34.14 2dl3 s VAL 32 CO 0.10 -0.12 -0.09 -0.31 -0.31 0.00 0.00 175.10 174.37 2dl3 s TYR 33 N -3.08 3.24 -0.40 2.82 2.02 -1.24 -1.84 117.35 118.86 2dl3 s TYR 33 Ca 0.33 -2.18 -0.29 0.00 -0.37 0.00 0.00 57.07 54.57 2dl3 s TYR 33 Cb 0.07 -1.97 0.01 0.00 -0.40 0.00 0.00 41.96 39.67 2dl3 s TYR 33 CO 0.15 -0.86 1.31 0.42 -1.57 0.00 0.00 175.55 175.00 2dl3 s ILE 34 N 1.15 4.05 -0.13 2.71 1.01 0.72 -3.06 121.20 127.65 2dl3 s ILE 34 Ca -0.07 1.11 -0.23 0.00 0.00 0.00 0.00 60.65 61.46 2dl3 s ILE 34 Cb -0.19 -4.29 -0.26 0.00 0.01 0.00 0.00 42.46 37.73 2dl3 s ILE 34 CO -0.05 -0.73 0.63 1.88 0.00 0.00 0.00 174.94 176.67 2dl3 h TYR 35 N 9.92 0.19 -3.54 3.97 0.05 -0.57 -1.23 116.97 125.77 2dl3 h TYR 35 Ca -0.26 -0.14 -0.44 0.00 0.05 0.00 0.00 58.73 57.94 2dl3 h TYR 35 Cb 1.09 -0.01 -0.14 0.00 1.01 0.00 0.00 36.73 38.69 2dl3 h TYR 35 CO 0.94 1.28 -0.56 -1.59 -1.05 0.00 0.00 178.16 177.18 2dl3 s LYS 36 N -2.34 1.65 -0.31 4.88 -2.85 -1.11 -4.80 119.74 114.85 2dl3 s LYS 36 Ca -0.20 -1.95 -0.00 0.00 -1.00 0.00 0.00 55.97 52.81 2dl3 s LYS 36 Cb 0.01 -0.31 0.07 0.00 -2.06 0.00 0.00 37.83 35.54 2dl3 s LYS 36 CO 0.71 -0.41 0.01 -1.14 0.10 0.00 0.00 175.35 174.62 2dl3 s GLN 37 N -3.83 2.24 0.05 1.78 0.74 -1.26 -2.03 119.66 117.35 2dl3 s GLN 37 Ca 0.34 -1.42 -0.34 0.00 0.05 0.00 0.00 55.36 53.98 2dl3 s GLN 37 Cb 0.05 -3.18 -0.19 0.00 1.10 0.00 0.00 33.01 30.79 2dl3 s GLN 37 CO 0.16 -0.71 1.46 0.82 -0.55 0.00 0.00 175.29 176.48 2dl3 h ILE 38 N 6.53 0.07 -4.12 -2.34 1.08 -1.82 -3.48 117.51 113.42 2dl3 h ILE 38 Ca -0.18 -0.08 -0.36 0.00 -0.39 0.00 0.00 64.86 63.85 2dl3 h ILE 38 Cb 1.05 0.08 -0.09 0.00 -3.07 0.00 0.00 36.82 34.79 2dl3 h ILE 38 CO 0.54 0.00 -0.34 0.47 -0.69 0.00 0.00 178.15 178.13 2dl3 n ASP 39 N -5.57 -0.29 0.12 1.72 8.00 -1.24 -4.96 116.55 114.32 2dl3 n ASP 39 Ca -0.15 -2.60 0.11 0.00 0.71 0.00 0.00 54.79 52.86 2dl3 n ASP 39 Cb 0.47 1.16 0.47 0.00 -0.02 0.00 0.00 41.12 43.20 2dl3 n ASP 39 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2dl3 n GLN 40 N -0.49 0.17 -0.27 -1.24 10.64 -1.26 -2.57 117.38 122.35 2dl3 n GLN 40 Ca 0.04 0.41 0.04 0.00 -1.83 0.00 0.00 57.00 55.67 2dl3 n GLN 40 Cb 0.44 -1.83 0.06 0.00 -0.86 0.00 0.00 30.24 28.05 2dl3 n GLN 40 CO 0.00 0.00 0.00 0.09 -1.83 0.00 0.00 177.06 175.32 2dl3 n ASN 41 N -2.15 1.07 -4.24 2.61 3.02 -1.26 -4.97 115.26 109.35 2dl3 n ASN 41 Ca 0.02 -2.41 -0.13 0.00 -0.03 0.00 0.00 54.58 52.03 2dl3 n ASN 41 Cb 0.21 -0.28 -0.10 0.00 -0.61 0.00 0.00 39.78 39.00 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 -1.25 1.23 0.23 3.10 0.52 -1.06 -2.41 118.94 119.29 2dl3 s TRP 42 Ca 0.13 -1.20 -0.13 0.00 0.02 0.00 0.00 56.10 54.93 2dl3 s TRP 42 Cb 0.12 -0.68 -0.00 0.00 -1.15 0.00 0.00 33.47 31.75 2dl3 s TRP 42 CO 0.01 -0.42 0.45 0.71 0.02 0.00 0.00 176.95 177.73 2dl3 s TYR 43 N -3.89 0.33 -0.04 -1.98 2.02 0.22 -3.62 117.35 110.40 2dl3 s TYR 43 Ca 0.32 -0.69 -0.01 0.00 -0.37 0.00 0.00 57.07 56.32 2dl3 s TYR 43 Cb 0.07 0.17 0.03 0.00 -0.40 0.00 0.00 41.96 41.83 2dl3 s TYR 43 CO 0.09 -0.95 0.03 -2.00 -1.57 0.00 0.00 175.55 171.15 2dl3 s GLU 44 N -4.00 0.09 0.00 -0.62 2.56 -0.86 -0.77 118.70 115.10 2dl3 s GLU 44 Ca 0.21 0.24 0.00 0.00 0.00 0.00 0.00 54.97 55.42 2dl3 s GLU 44 Cb -0.00 -0.50 0.00 0.00 2.00 0.00 0.00 34.13 35.63 2dl3 s GLU 44 CO 0.07 -0.25 0.00 0.41 -0.56 0.00 0.00 175.26 174.93 2dl3 n GLY 45 N 4.77 3.58 3.31 -1.50 0.00 -1.09 0.18 105.19 114.44 2dl3 n GLY 45 Ca -0.15 -1.00 -0.22 0.00 0.00 0.00 0.00 46.02 44.65 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 0.62 1.21 -0.28 1.61 -6.30 -1.17 -2.89 118.70 111.49 2dl3 s GLU 46 Ca 0.00 -1.31 -0.16 0.00 -2.50 0.00 0.00 54.97 50.99 2dl3 s GLU 46 Cb 0.00 -1.32 0.11 0.00 0.00 0.00 0.00 34.13 32.92 2dl3 s GLU 46 CO 0.00 0.28 0.84 -1.58 0.02 0.00 0.00 175.26 174.82 2dl3 s HIS 47 N -1.75 -0.81 -1.48 5.30 2.46 0.15 -3.70 115.29 115.46 2dl3 s HIS 47 Ca 0.12 1.63 -0.02 0.00 0.47 0.00 0.00 55.06 57.26 2dl3 s HIS 47 Cb -0.07 0.48 0.02 0.00 -0.13 0.00 0.00 32.58 32.88 2dl3 s HIS 47 CO 0.06 -0.40 0.35 1.58 -2.47 0.00 0.00 174.74 173.86 2dl3 n HIS 48 N 3.92 -1.55 -2.38 3.88 -0.00 -1.26 0.56 115.22 118.39 2dl3 n HIS 48 Ca -0.19 0.72 -0.20 0.00 -0.00 0.00 0.00 57.72 58.05 2dl3 n HIS 48 Cb 0.58 -3.40 -0.01 0.00 -0.00 0.00 0.00 29.99 27.16 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 -2.06 -0.44 3.08 1.57 0.00 -1.26 -4.99 105.19 101.09 2dl3 n GLY 49 Ca -0.27 -0.06 -0.20 0.00 0.00 0.00 0.00 46.02 45.49 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 -4.99 0.91 -0.03 1.61 6.06 0.19 -5.15 118.95 117.56 2dl3 s ARG 50 Ca 0.00 -0.51 0.06 0.00 -2.50 0.00 0.00 55.73 52.79 2dl3 s ARG 50 Cb -0.00 -0.88 -0.01 0.00 0.06 0.00 0.00 34.95 34.11 2dl3 s ARG 50 CO 0.00 0.24 -0.22 0.08 -2.50 0.00 0.00 175.30 172.90 2dl3 s VAL 51 N -0.46 1.77 0.00 7.11 1.01 -1.26 0.29 120.40 128.86 2dl3 s VAL 51 Ca 0.03 -0.93 0.00 0.00 0.00 0.00 0.00 61.98 61.08 2dl3 s VAL 51 Cb -0.05 -1.48 0.00 0.00 0.00 0.00 0.00 36.38 34.84 2dl3 s VAL 51 CO 0.00 0.50 0.00 0.61 0.00 0.00 0.00 175.10 176.21 2dl3 n GLY 52 N 2.78 0.78 3.62 4.51 0.00 -1.14 -4.72 105.19 111.02 2dl3 n GLY 52 Ca -0.17 -0.74 -0.24 0.00 0.00 0.00 0.00 46.02 44.87 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 -2.14 3.37 -0.11 -0.61 -4.36 0.24 -2.65 121.20 114.94 2dl3 s ILE 53 Ca 0.00 -1.86 -0.30 0.00 -0.26 0.00 0.00 60.65 58.23 2dl3 s ILE 53 Cb 0.00 -2.77 0.09 0.00 1.25 0.00 0.00 42.46 41.03 2dl3 s ILE 53 CO 0.00 -0.31 0.79 0.72 0.24 0.00 0.00 174.94 176.38 2dl3 s PHE 54 N -2.17 -0.58 0.38 1.37 -0.12 0.05 -1.56 117.98 115.35 2dl3 s PHE 54 Ca 0.30 1.04 -0.26 0.00 -0.05 0.00 0.00 56.93 57.96 2dl3 s PHE 54 Cb -0.07 0.41 -0.09 0.00 -0.63 0.00 0.00 43.02 42.64 2dl3 s PHE 54 CO 0.19 -0.50 1.20 -1.25 -0.05 0.00 0.00 175.22 174.80 2dl3 s PRO 55 N -1.00 4.13 0.09 1.99 0.04 -1.26 0.69 135.00 139.67 2dl3 s PRO 55 Ca -0.07 1.92 -0.16 0.00 0.04 0.00 0.00 61.00 62.74 2dl3 s PRO 55 Cb -0.01 -2.78 -0.10 0.00 0.04 0.00 0.00 34.50 31.65 2dl3 s PRO 55 CO 0.06 -0.28 1.39 -0.09 0.04 0.00 0.00 177.00 178.12 2dl3 h ARG 56 N 2.83 0.65 -0.58 4.56 2.43 -1.75 -2.98 114.38 119.54 2dl3 h ARG 56 Ca -0.49 -0.37 0.17 0.00 -0.81 0.00 0.00 59.98 58.48 2dl3 h ARG 56 Cb 1.23 0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 30.78 2dl3 h ARG 56 CO 0.63 0.98 0.66 0.00 -1.51 0.00 0.00 179.97 180.73 2dl3 h THR 57 N 0.36 0.25 0.09 0.20 1.03 -1.93 0.67 112.91 113.58 2dl3 h THR 57 Ca 0.03 0.00 -0.25 0.00 -0.01 0.00 0.00 66.41 66.18 2dl3 h THR 57 Cb 0.89 0.47 -0.01 0.00 -1.07 0.00 0.00 68.15 68.43 2dl3 h THR 57 CO 0.07 0.00 -1.17 1.88 -0.01 0.00 0.00 175.52 176.30 2dl3 h TYR 58 N 0.00 0.34 -1.03 0.00 -1.99 -1.91 -3.47 116.97 108.91 2dl3 h TYR 58 Ca 0.28 -0.25 -0.53 0.00 2.00 0.00 0.00 58.73 60.23 2dl3 h TYR 58 Cb 1.60 -0.01 -0.03 0.00 2.00 0.00 0.00 36.73 40.28 2dl3 h TYR 58 CO 0.00 1.19 -0.31 0.96 -0.00 0.00 0.00 178.16 180.01 2dl3 s ILE 59 N -2.67 2.17 -0.12 -2.88 -5.25 0.23 0.59 121.20 113.27 2dl3 s ILE 59 Ca -0.02 -1.36 -0.04 0.00 -0.99 0.00 0.00 60.65 58.24 2dl3 s ILE 59 Cb 0.08 -2.53 0.05 0.00 2.95 0.00 0.00 42.46 43.01 2dl3 s ILE 59 CO 0.86 0.00 0.11 -0.70 -1.79 0.00 0.00 174.94 173.42 2dl3 s GLU 60 N -4.27 0.03 0.34 0.37 2.56 0.26 -4.76 118.70 113.23 2dl3 s GLU 60 Ca 0.44 0.23 -0.29 0.00 0.00 0.00 0.00 54.97 55.35 2dl3 s GLU 60 Cb -0.03 -1.03 -0.12 0.00 2.00 0.00 0.00 34.13 34.95 2dl3 s GLU 60 CO 0.27 -0.49 1.46 1.28 -0.56 0.00 0.00 175.26 177.21 2dl3 n LEU 61 N 5.30 4.28 -4.96 2.70 4.77 -1.26 -1.31 117.00 126.53 2dl3 n LEU 61 Ca -0.05 1.20 -0.22 0.00 -0.03 0.00 0.00 56.01 56.91 2dl3 n LEU 61 Cb 0.50 -1.57 -0.00 0.00 -2.33 0.00 0.00 43.42 40.01 2dl3 n LEU 61 CO 0.07 -0.04 0.17 -0.76 -1.33 0.00 0.00 177.39 175.50 2dl3 s LEU 62 N -1.34 3.91 0.49 2.23 1.43 -1.21 -4.90 118.68 119.29 2dl3 s LEU 62 Ca 0.57 0.24 -0.04 0.00 -1.03 0.00 0.00 54.13 53.87 2dl3 s LEU 62 Cb -0.51 -3.12 -0.02 0.00 0.03 0.00 0.00 46.19 42.57 2dl3 s LEU 62 CO 0.59 -0.44 0.77 -0.55 0.23 0.00 0.00 176.35 176.96 2dl3 s SER 63 N -4.12 6.08 0.25 2.29 0.15 -1.26 -4.91 113.70 112.18 2dl3 s SER 63 Ca 0.43 0.76 -0.01 0.00 0.70 0.00 0.00 55.95 57.84 2dl3 s SER 63 Cb -0.10 -2.03 0.00 0.00 -1.71 0.00 0.00 66.02 62.18 2dl3 s SER 63 CO 0.35 -0.66 0.33 0.61 1.20 0.00 0.00 173.24 175.07 2dl3 n GLY 64 N -2.26 2.50 3.66 9.45 0.00 -1.26 -5.10 105.19 112.18 2dl3 n GLY 64 Ca 0.01 -1.57 -0.29 0.00 0.00 0.00 0.00 46.02 44.17 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 -2.60 0.08 0.16 1.61 0.04 -1.26 -5.09 135.00 127.93 2dl3 s PRO 65 Ca 0.21 0.40 -0.23 0.00 0.04 0.00 0.00 61.00 61.42 2dl3 s PRO 65 Cb -0.00 -1.71 0.07 0.00 0.04 0.00 0.00 34.50 32.90 2dl3 s PRO 65 CO 0.15 -2.94 0.65 -1.12 0.04 0.00 0.00 177.00 173.78 2dl3 s SER 66 N -3.52 -0.51 -0.12 6.66 0.01 -1.26 -5.14 113.70 109.82 2dl3 s SER 66 Ca 0.66 -0.07 -0.25 0.00 1.31 0.00 0.00 55.95 57.60 2dl3 s SER 66 Cb -0.17 0.59 -0.02 0.00 0.21 0.00 0.00 66.02 66.62 2dl3 s SER 66 CO 0.57 -0.97 0.81 -0.55 0.41 0.00 0.00 173.24 173.51 2dl3 s SER 67 N -2.74 7.00 0.00 2.44 0.15 -1.26 -5.38 113.70 113.91 2dl3 s SER 67 Ca 0.03 1.22 0.00 0.00 0.70 0.00 0.00 55.95 57.90 2dl3 s SER 67 Cb -0.02 -2.45 0.00 0.00 -1.71 0.00 0.00 66.02 61.84 2dl3 s SER 67 CO -0.10 -0.30 0.00 0.61 1.20 0.00 0.00 173.24 174.65