#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 5.44 0.38 1.61 0.15 -1.26 -4.95 113.70 115.07 2dl3 s SER 2 Ca 0.00 -1.47 -0.24 0.00 0.70 0.00 0.00 55.95 54.94 2dl3 s SER 2 Cb 0.00 -2.58 -0.10 0.00 -1.71 0.00 0.00 66.02 61.63 2dl3 s SER 2 CO 0.00 -2.58 0.97 -0.55 1.20 0.00 0.00 173.24 172.27 2dl3 s SER 3 N 6.49 7.07 0.00 5.45 0.15 -1.26 -4.62 113.70 126.98 2dl3 s SER 3 Ca 0.65 1.81 0.00 0.00 0.70 0.00 0.00 55.95 59.11 2dl3 s SER 3 Cb -0.02 -2.56 0.00 0.00 -1.71 0.00 0.00 66.02 61.73 2dl3 s SER 3 CO 0.06 -0.26 0.00 0.61 1.20 0.00 0.00 173.24 174.85 2dl3 n GLY 4 N 0.05 0.84 3.58 9.45 0.00 -1.26 -5.11 105.19 112.73 2dl3 n GLY 4 Ca 0.05 -0.05 -0.08 0.00 0.00 0.00 0.00 46.02 45.94 2dl3 n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2dl3 s SER 5 N -0.18 -0.28 -0.18 1.61 1.04 -1.26 -5.16 113.70 109.28 2dl3 s SER 5 Ca 0.00 0.22 -0.08 0.00 0.48 0.00 0.00 55.95 56.57 2dl3 s SER 5 Cb 0.00 0.25 -0.04 0.00 0.10 0.00 0.00 66.02 66.33 2dl3 s SER 5 CO 0.00 -0.33 0.09 -0.44 0.98 0.00 0.00 173.24 173.54 2dl3 s SER 6 N -1.50 5.84 0.30 7.02 0.01 -1.26 -4.98 113.70 119.14 2dl3 s SER 6 Ca 0.03 0.15 0.00 0.00 1.31 0.00 0.00 55.95 57.44 2dl3 s SER 6 Cb -0.01 -2.00 0.00 0.00 0.21 0.00 0.00 66.02 64.22 2dl3 s SER 6 CO -0.03 0.19 0.00 0.61 0.41 0.00 0.00 173.24 174.43 2dl3 n GLY 7 N 3.43 -2.77 3.73 3.44 0.00 -1.26 -4.86 105.19 106.89 2dl3 n GLY 7 Ca -0.17 -1.26 -0.33 0.00 0.00 0.00 0.00 46.02 44.27 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 -3.32 2.95 0.36 1.61 0.52 0.14 -4.71 118.95 116.51 2dl3 s ARG 8 Ca 0.00 -0.51 -0.27 0.00 -0.52 0.00 0.00 55.73 54.43 2dl3 s ARG 8 Cb 0.00 -2.78 -0.09 0.00 0.52 0.00 0.00 34.95 32.60 2dl3 s ARG 8 CO 0.00 0.65 1.21 -1.25 0.02 0.00 0.00 175.30 175.93 2dl3 s PRO 9 N -1.47 4.21 -0.28 3.54 0.04 -1.26 -0.76 135.00 139.02 2dl3 s PRO 9 Ca 0.19 1.96 -0.18 0.00 0.04 0.00 0.00 61.00 63.01 2dl3 s PRO 9 Cb -0.12 -2.86 0.08 0.00 0.04 0.00 0.00 34.50 31.64 2dl3 s PRO 9 CO 0.10 -0.22 0.73 0.00 0.04 0.00 0.00 177.00 177.65 2dl3 s ALA 10 N -1.29 -1.89 -0.17 8.56 0.00 -0.98 -2.03 121.76 123.96 2dl3 s ALA 10 Ca 0.53 2.30 -0.08 0.00 0.00 0.00 0.00 51.96 54.71 2dl3 s ALA 10 Cb -0.34 -1.39 -0.04 0.00 0.00 0.00 0.00 23.12 21.34 2dl3 s ALA 10 CO 0.44 -0.36 0.09 0.50 0.00 0.00 0.00 175.76 176.43 2dl3 s ARG 11 N 1.27 3.86 -0.13 0.00 3.52 0.16 -1.74 118.95 125.89 2dl3 s ARG 11 Ca -0.07 -0.26 -0.29 0.00 -0.13 0.00 0.00 55.73 54.97 2dl3 s ARG 11 Cb -0.05 -3.24 -0.03 0.00 -1.56 0.00 0.00 34.95 30.07 2dl3 s ARG 11 CO -0.14 0.42 1.44 0.00 -0.81 0.00 0.00 175.30 176.21 2dl3 s ALA 12 N -0.02 3.61 0.09 6.12 0.00 0.06 0.23 121.76 131.84 2dl3 s ALA 12 Ca 0.08 0.63 -0.13 0.00 0.00 0.00 0.00 51.96 52.54 2dl3 s ALA 12 Cb -0.12 -3.69 -0.19 0.00 0.00 0.00 0.00 23.12 19.12 2dl3 s ALA 12 CO 0.00 -1.34 1.26 0.87 0.00 0.00 0.00 175.76 176.55 2dl3 h LYS 13 N 8.95 0.76 -5.08 0.00 1.79 -1.27 -0.71 116.57 121.01 2dl3 h LYS 13 Ca -0.32 -0.70 -0.45 0.00 -2.18 0.00 0.00 60.65 57.00 2dl3 h LYS 13 Cb 1.14 0.17 -0.14 0.00 -1.58 0.00 0.00 32.23 31.82 2dl3 h LYS 13 CO 0.97 1.29 -0.59 -0.06 -1.08 0.00 0.00 179.45 179.98 2dl3 s PHE 14 N -3.57 1.80 -0.51 -1.35 0.40 -1.15 -4.72 117.98 108.87 2dl3 s PHE 14 Ca -0.10 -1.10 -0.24 0.00 -0.60 0.00 0.00 56.93 54.89 2dl3 s PHE 14 Cb 0.08 -1.13 0.04 0.00 0.51 0.00 0.00 43.02 42.51 2dl3 s PHE 14 CO 0.91 -0.17 0.88 -0.51 0.70 0.00 0.00 175.22 177.03 2dl3 s ASP 15 N -3.46 6.37 0.20 1.36 1.11 -1.26 -3.67 116.67 117.32 2dl3 s ASP 15 Ca 0.34 -0.28 -0.15 0.00 0.18 0.00 0.00 52.55 52.64 2dl3 s ASP 15 Cb 0.07 -2.42 -0.08 0.00 1.07 0.00 0.00 42.92 41.57 2dl3 s ASP 15 CO 0.15 -1.11 0.62 0.12 1.18 0.00 0.00 175.17 176.13 2dl3 s PHE 16 N 3.68 3.56 -0.22 4.23 5.36 0.45 -4.94 117.98 130.11 2dl3 s PHE 16 Ca 0.30 1.14 -0.02 0.00 -0.96 0.00 0.00 56.93 57.39 2dl3 s PHE 16 Cb -0.13 -2.44 0.01 0.00 -0.34 0.00 0.00 43.02 40.12 2dl3 s PHE 16 CO 0.20 0.34 -0.08 0.15 -1.46 0.00 0.00 175.22 174.38 2dl3 s LYS 17 N -2.20 3.17 -0.42 10.12 1.02 -1.26 -2.10 119.74 128.06 2dl3 s LYS 17 Ca 0.42 -0.75 -0.28 0.00 0.02 0.00 0.00 55.97 55.39 2dl3 s LYS 17 Cb -0.14 -2.92 0.02 0.00 -0.52 0.00 0.00 37.83 34.27 2dl3 s LYS 17 CO 0.20 -0.25 1.04 0.00 -0.92 0.00 0.00 175.35 175.42 2dl3 s ALA 18 N 1.41 3.29 0.15 5.17 0.00 -1.26 -4.92 121.76 125.59 2dl3 s ALA 18 Ca 0.04 -0.45 -0.13 0.00 0.00 0.00 0.00 51.96 51.42 2dl3 s ALA 18 Cb -0.15 -3.73 0.02 0.00 0.00 0.00 0.00 23.12 19.27 2dl3 s ALA 18 CO -0.06 -1.93 1.65 1.96 0.00 0.00 0.00 175.76 177.38 2dl3 h GLN 19 N 8.82 0.78 -4.74 0.00 4.20 -1.97 -3.46 115.11 118.73 2dl3 h GLN 19 Ca -0.23 -0.19 -0.33 0.00 0.06 0.00 0.00 58.65 57.97 2dl3 h GLN 19 Cb 1.07 -0.10 -0.14 0.00 0.30 0.00 0.00 27.48 28.60 2dl3 h GLN 19 CO 1.06 0.76 -0.59 0.95 -0.67 0.00 0.00 178.83 180.34 2dl3 s THR 20 N -5.29 0.16 0.32 -0.54 -4.23 -1.26 -5.03 115.64 99.76 2dl3 s THR 20 Ca -0.13 -2.00 0.09 0.00 -1.18 0.00 0.00 61.69 58.48 2dl3 s THR 20 Cb 0.11 -2.53 0.31 0.00 1.34 0.00 0.00 72.50 71.74 2dl3 s THR 20 CO 0.79 0.00 1.74 -0.07 -0.54 0.00 0.00 174.62 176.54 2dl3 h LEU 21 N 2.43 0.69 -0.87 4.79 3.38 -2.01 0.52 115.31 124.23 2dl3 h LEU 21 Ca -0.34 0.13 0.23 0.00 0.09 0.00 0.00 57.88 57.98 2dl3 h LEU 21 Cb 1.25 0.02 -0.13 0.00 0.09 0.00 0.00 40.66 41.88 2dl3 h LEU 21 CO 0.52 0.14 0.28 0.50 0.09 0.00 0.00 178.44 179.96 2dl3 h LYS 22 N 0.61 0.25 -5.98 1.13 1.63 -1.96 -3.40 116.57 108.86 2dl3 h LYS 22 Ca 0.63 -0.02 -0.61 0.00 -0.85 0.00 0.00 60.65 59.80 2dl3 h LYS 22 Cb 1.18 -0.06 -0.05 0.00 -0.60 0.00 0.00 32.23 32.70 2dl3 h LYS 22 CO -0.45 0.17 -0.37 -1.21 -3.45 0.00 0.00 179.45 174.14 2dl3 s GLU 23 N -5.92 3.60 -0.15 1.90 2.02 0.17 -1.44 118.70 118.88 2dl3 s GLU 23 Ca -0.12 -0.08 -0.04 0.00 0.02 0.00 0.00 54.97 54.75 2dl3 s GLU 23 Cb 0.25 -3.02 -0.03 0.00 0.10 0.00 0.00 34.13 31.43 2dl3 s GLU 23 CO 0.77 0.60 -0.02 -1.17 0.02 0.00 0.00 175.26 175.46 2dl3 s LEU 24 N -2.02 3.37 0.28 1.80 2.96 -0.64 -4.62 118.68 119.80 2dl3 s LEU 24 Ca 0.31 -0.07 -0.29 0.00 -0.22 0.00 0.00 54.13 53.86 2dl3 s LEU 24 Cb -0.13 -1.81 -0.10 0.00 0.50 0.00 0.00 46.19 44.65 2dl3 s LEU 24 CO 0.19 0.19 1.25 -2.16 -1.32 0.00 0.00 176.35 174.50 2dl3 s PRO 25 N 0.24 4.44 0.00 0.98 0.04 -1.26 -4.58 135.00 134.86 2dl3 s PRO 25 Ca -0.01 2.05 0.03 0.00 0.04 0.00 0.00 61.00 63.11 2dl3 s PRO 25 Cb -0.14 -3.14 -0.01 0.00 0.04 0.00 0.00 34.50 31.25 2dl3 s PRO 25 CO 0.02 -0.10 -0.10 -0.51 0.04 0.00 0.00 177.00 176.35 2dl3 s LEU 26 N -1.17 2.06 0.12 -3.56 1.43 -0.89 -4.97 118.68 111.70 2dl3 s LEU 26 Ca 0.50 -0.24 0.07 0.00 -1.03 0.00 0.00 54.13 53.43 2dl3 s LEU 26 Cb -0.37 -0.49 -0.04 0.00 0.03 0.00 0.00 46.19 45.32 2dl3 s LEU 26 CO 0.45 0.09 -0.05 0.00 0.23 0.00 0.00 176.35 177.07 2dl3 s GLN 27 N -0.44 2.29 -0.14 1.70 -2.07 -1.26 0.17 119.66 119.90 2dl3 s GLN 27 Ca 0.03 -1.02 -0.29 0.00 -1.82 0.00 0.00 55.36 52.25 2dl3 s GLN 27 Cb -0.05 -2.36 -0.06 0.00 -1.09 0.00 0.00 33.01 29.45 2dl3 s GLN 27 CO -0.00 0.50 2.15 1.17 -1.32 0.00 0.00 175.29 177.78 2dl3 n LYS 28 N 0.41 2.21 0.00 9.60 4.81 -1.24 -2.10 118.16 131.85 2dl3 n LYS 28 Ca -0.12 0.68 0.00 0.00 -0.87 0.00 0.00 58.31 58.01 2dl3 n LYS 28 Cb 0.53 -3.15 0.00 0.00 0.02 0.00 0.00 35.03 32.43 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 5.41 2.00 3.63 3.14 0.00 -0.27 -5.00 105.19 114.10 2dl3 n GLY 29 Ca 0.27 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.96 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 -2.00 4.85 -0.29 1.61 1.47 -0.89 -4.88 116.67 116.54 2dl3 s ASP 30 Ca 0.00 -0.02 -0.07 0.00 1.18 0.00 0.00 52.55 53.64 2dl3 s ASP 30 Cb 0.00 -1.24 0.00 0.00 -0.34 0.00 0.00 42.92 41.35 2dl3 s ASP 30 CO 0.00 0.33 0.08 -0.63 0.68 0.00 0.00 175.17 175.63 2dl3 s ILE 31 N -0.93 4.01 0.39 2.11 -1.09 -1.26 -0.76 121.20 123.66 2dl3 s ILE 31 Ca 0.15 -0.61 0.08 0.00 -2.23 0.00 0.00 60.65 58.04 2dl3 s ILE 31 Cb -0.11 -3.03 -0.07 0.00 -1.58 0.00 0.00 42.46 37.66 2dl3 s ILE 31 CO 0.05 0.12 -0.03 0.68 -1.23 0.00 0.00 174.94 174.54 2dl3 s VAL 32 N 1.52 2.09 -0.23 2.92 -7.23 -0.71 -4.96 120.40 113.80 2dl3 s VAL 32 Ca 0.03 -2.07 0.01 0.00 -1.81 0.00 0.00 61.98 58.14 2dl3 s VAL 32 Cb -0.17 -2.87 0.03 0.00 0.56 0.00 0.00 36.38 33.93 2dl3 s VAL 32 CO 0.02 -0.07 -0.12 -0.31 -0.31 0.00 0.00 175.10 174.31 2dl3 s TYR 33 N -2.67 3.04 -0.46 2.82 2.02 -1.25 -2.33 117.35 118.52 2dl3 s TYR 33 Ca 0.34 -1.83 -0.26 0.00 -0.37 0.00 0.00 57.07 54.95 2dl3 s TYR 33 Cb 0.07 -1.97 0.03 0.00 -0.40 0.00 0.00 41.96 39.68 2dl3 s TYR 33 CO 0.18 -0.80 0.96 0.42 -1.57 0.00 0.00 175.55 174.74 2dl3 s ILE 34 N 1.24 4.43 -0.05 2.71 1.01 0.06 -2.81 121.20 127.78 2dl3 s ILE 34 Ca -0.01 0.85 -0.22 0.00 0.00 0.00 0.00 60.65 61.26 2dl3 s ILE 34 Cb -0.17 -4.46 -0.30 0.00 0.01 0.00 0.00 42.46 37.54 2dl3 s ILE 34 CO -0.07 -0.86 0.90 1.88 0.00 0.00 0.00 174.94 176.79 2dl3 h TYR 35 N 9.08 0.49 -4.40 3.97 0.05 -0.80 0.43 116.97 125.81 2dl3 h TYR 35 Ca -0.24 -0.35 -0.20 0.00 0.05 0.00 0.00 58.73 57.99 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 0.89 1.27 -0.52 -1.59 -1.05 0.00 0.00 178.16 177.16 2dl3 s LYS 36 N -2.46 1.27 -0.29 4.88 -2.85 -1.15 -4.80 119.74 114.34 2dl3 s LYS 36 Ca -0.14 -1.55 -0.04 0.00 -1.00 0.00 0.00 55.97 53.24 2dl3 s LYS 36 Cb 0.01 0.31 0.03 0.00 -2.06 0.00 0.00 37.83 36.12 2dl3 s LYS 36 CO 0.82 -0.44 0.02 -1.14 0.10 0.00 0.00 175.35 174.71 2dl3 s GLN 37 N -4.13 2.78 0.04 1.78 0.74 -1.26 -1.32 119.66 118.29 2dl3 s GLN 37 Ca 0.36 -1.04 -0.30 0.00 0.05 0.00 0.00 55.36 54.43 2dl3 s GLN 37 Cb 0.05 -3.22 -0.16 0.00 1.10 0.00 0.00 33.01 30.78 2dl3 s GLN 37 CO 0.11 -0.51 1.33 0.82 -0.55 0.00 0.00 175.29 176.49 2dl3 h ILE 38 N 6.14 0.00 -3.87 -2.34 1.08 -1.76 -3.47 117.51 113.29 2dl3 h ILE 38 Ca -0.28 -0.10 -0.37 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 0.58 0.00 -0.59 -0.62 -0.69 0.00 0.00 178.15 176.82 2dl3 s ASP 39 N -3.93 1.26 0.17 1.72 2.15 -1.19 -4.95 116.67 111.89 2dl3 s ASP 39 Ca -0.16 -1.45 0.12 0.00 0.43 0.00 0.00 52.55 51.49 2dl3 s ASP 39 Cb 0.02 0.26 0.62 0.00 -0.30 0.00 0.00 42.92 43.52 2dl3 s ASP 39 CO 0.47 -0.80 1.35 0.00 -0.17 0.00 0.00 175.17 176.03 2dl3 n GLN 40 N -0.50 0.07 -0.24 4.34 6.02 -1.26 -1.00 117.38 124.82 2dl3 n GLN 40 Ca 0.00 0.57 0.04 0.00 -0.01 0.00 0.00 57.00 57.61 2dl3 n GLN 40 Cb 0.66 -1.74 0.06 0.00 1.02 0.00 0.00 30.24 30.24 2dl3 n GLN 40 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 2dl3 n ASN 41 N -1.90 1.19 -4.04 1.08 3.02 -1.26 -5.00 115.26 108.34 2dl3 n ASN 41 Ca -0.01 -2.42 -0.08 0.00 -0.03 0.00 0.00 54.58 52.04 2dl3 n ASN 41 Cb 0.02 -0.27 -0.09 0.00 -0.61 0.00 0.00 39.78 38.82 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 -1.35 0.52 0.27 3.10 0.52 -0.17 -3.16 118.94 118.67 2dl3 s TRP 42 Ca 0.14 -0.98 0.06 0.00 0.02 0.00 0.00 56.10 55.34 2dl3 s TRP 42 Cb 0.12 -0.31 -0.02 0.00 -1.15 0.00 0.00 33.47 32.11 2dl3 s TRP 42 CO 0.01 -0.48 0.23 0.66 0.02 0.00 0.00 176.95 177.39 2dl3 n TYR 43 N -0.01 -0.62 -3.67 -1.98 4.01 0.16 -3.17 117.16 111.88 2dl3 n TYR 43 Ca -0.11 -2.28 -0.10 0.00 -0.16 0.00 0.00 57.90 55.24 2dl3 n TYR 43 Cb 0.62 0.23 -0.11 0.00 -0.31 0.00 0.00 39.34 39.77 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 -3.11 0.29 0.00 -0.72 2.56 -0.43 -2.16 118.70 115.13 2dl3 s GLU 44 Ca 0.32 0.89 0.00 0.00 0.00 0.00 0.00 54.97 56.18 2dl3 s GLU 44 Cb 0.02 0.15 0.00 0.00 2.00 0.00 0.00 34.13 36.30 2dl3 s GLU 44 CO 0.23 -0.23 0.00 0.41 -0.56 0.00 0.00 175.26 175.10 2dl3 n GLY 45 N 5.08 3.50 3.38 -1.50 0.00 -1.02 -0.05 105.19 114.59 2dl3 n GLY 45 Ca -0.12 -1.10 -0.22 0.00 0.00 0.00 0.00 46.02 44.58 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 -0.04 1.43 -0.29 1.61 2.12 -1.12 -2.21 118.70 120.20 2dl3 s GLU 46 Ca 0.00 -1.58 -0.14 0.00 0.36 0.00 0.00 54.97 53.61 2dl3 s GLU 46 Cb 0.00 -1.44 0.12 0.00 0.26 0.00 0.00 34.13 33.07 2dl3 s GLU 46 CO 0.00 0.27 0.76 -1.58 -0.54 0.00 0.00 175.26 174.17 2dl3 s HIS 47 N -2.45 -1.05 -1.63 5.30 2.46 0.15 -3.90 115.29 114.17 2dl3 s HIS 47 Ca 0.23 1.94 -0.10 0.00 0.47 0.00 0.00 55.06 57.59 2dl3 s HIS 47 Cb -0.04 0.63 0.10 0.00 -0.13 0.00 0.00 32.58 33.13 2dl3 s HIS 47 CO 0.09 -0.52 0.45 1.58 -2.47 0.00 0.00 174.74 173.87 2dl3 n HIS 48 N 4.75 -1.47 -1.67 3.88 -0.00 -1.26 0.15 115.22 119.60 2dl3 n HIS 48 Ca -0.15 0.71 -0.10 0.00 -0.00 0.00 0.00 57.72 58.18 2dl3 n HIS 48 Cb 0.54 -2.87 -0.03 0.00 -0.00 0.00 0.00 29.99 27.63 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 -1.79 0.63 2.92 1.57 0.00 -1.26 -5.01 105.19 102.25 2dl3 n GLY 49 Ca -0.12 -0.54 -0.28 0.00 0.00 0.00 0.00 46.02 45.08 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 -3.54 1.60 -0.23 1.61 3.52 0.40 -5.12 118.95 117.19 2dl3 s ARG 50 Ca 0.00 -0.49 -0.08 0.00 -0.13 0.00 0.00 55.73 55.03 2dl3 s ARG 50 Cb 0.00 -1.96 -0.04 0.00 -1.56 0.00 0.00 34.95 31.40 2dl3 s ARG 50 CO 0.00 -0.37 0.09 0.08 -0.81 0.00 0.00 175.30 174.29 2dl3 s VAL 51 N 1.61 4.72 0.13 7.11 1.01 -1.26 0.34 120.40 134.06 2dl3 s VAL 51 Ca 0.02 -0.04 -0.04 0.00 0.00 0.00 0.00 61.98 61.92 2dl3 s VAL 51 Cb -0.14 -3.19 0.02 0.00 0.00 0.00 0.00 36.38 33.07 2dl3 s VAL 51 CO -0.08 0.37 0.25 0.61 0.00 0.00 0.00 175.10 176.25 2dl3 n GLY 52 N 4.39 1.85 3.72 4.51 0.00 -0.94 -4.94 105.19 113.79 2dl3 n GLY 52 Ca -0.16 -1.16 -0.30 0.00 0.00 0.00 0.00 46.02 44.40 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 -2.67 4.20 0.04 -0.61 -4.36 -0.52 -2.43 121.20 114.85 2dl3 s ILE 53 Ca 0.06 -0.95 -0.22 0.00 -0.26 0.00 0.00 60.65 59.28 2dl3 s ILE 53 Cb -0.01 -3.03 0.05 0.00 1.25 0.00 0.00 42.46 40.72 2dl3 s ILE 53 CO 0.05 0.09 0.52 0.72 0.24 0.00 0.00 174.94 176.56 2dl3 s PHE 54 N -1.39 -0.42 0.26 1.37 -0.12 -0.92 -1.62 117.98 115.14 2dl3 s PHE 54 Ca 0.27 0.50 -0.29 0.00 -0.05 0.00 0.00 56.93 57.36 2dl3 s PHE 54 Cb -0.12 0.33 -0.09 0.00 -0.63 0.00 0.00 43.02 42.51 2dl3 s PHE 54 CO 0.20 -0.63 1.26 -1.25 -0.05 0.00 0.00 175.22 174.75 2dl3 s PRO 55 N -2.31 4.44 0.36 1.99 0.04 -1.26 0.35 135.00 138.61 2dl3 s PRO 55 Ca -0.06 2.05 0.17 0.00 0.04 0.00 0.00 61.00 63.20 2dl3 s PRO 55 Cb -0.01 -3.15 0.65 0.00 0.04 0.00 0.00 34.50 32.03 2dl3 s PRO 55 CO -0.01 -0.12 1.73 0.07 0.04 0.00 0.00 177.00 178.72 2dl3 h ARG 56 N 4.30 0.00 0.00 4.56 0.11 -1.83 -2.71 114.38 118.81 2dl3 h ARG 56 Ca -0.47 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.61 2dl3 h ARG 56 Cb 1.22 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.30 2dl3 h ARG 56 CO 0.71 0.41 0.00 0.25 0.10 0.00 0.00 179.97 181.44 2dl3 n THR 57 N -3.65 0.87 -0.10 0.08 -2.24 -1.26 -1.84 114.28 106.14 2dl3 n THR 57 Ca -0.01 0.22 -0.10 0.00 -2.27 0.00 0.00 64.05 61.90 2dl3 n THR 57 Cb 0.51 -1.06 -0.16 0.00 -2.10 0.00 0.00 70.33 67.52 2dl3 n THR 57 CO 0.00 0.00 0.00 -1.22 -0.57 0.00 0.00 175.07 173.28 2dl3 n TYR 58 N -1.32 0.00 -3.88 4.78 4.02 -1.02 -4.97 117.16 114.78 2dl3 n TYR 58 Ca 0.04 0.00 -0.22 0.00 -0.01 0.00 0.00 57.90 57.71 2dl3 n TYR 58 Cb 0.08 -0.99 -0.05 0.00 -0.02 0.00 0.00 39.34 38.36 2dl3 n TYR 58 CO 0.00 0.00 0.00 0.96 -1.01 0.00 0.00 176.86 176.81 2dl3 s ILE 59 N -2.51 2.75 -0.12 -0.72 -5.25 -0.77 -0.79 121.20 113.80 2dl3 s ILE 59 Ca -0.10 -1.53 -0.01 0.00 -0.99 0.00 0.00 60.65 58.02 2dl3 s ILE 59 Cb 0.06 -3.02 0.03 0.00 2.95 0.00 0.00 42.46 42.49 2dl3 s ILE 59 CO 0.83 -0.06 -0.04 -1.83 -1.79 0.00 0.00 174.94 172.04 2dl3 s GLU 60 N -3.98 1.21 -0.01 0.37 -1.05 0.13 -4.78 118.70 110.59 2dl3 s GLU 60 Ca 0.43 -0.21 -0.30 0.00 -0.15 0.00 0.00 54.97 54.74 2dl3 s GLU 60 Cb -0.01 -1.53 -0.08 0.00 -0.44 0.00 0.00 34.13 32.07 2dl3 s GLU 60 CO 0.25 -0.33 1.90 -0.51 0.95 0.00 0.00 175.26 177.52 2dl3 s LEU 61 N 1.78 4.31 0.31 1.83 1.43 -1.26 -0.66 118.68 126.42 2dl3 s LEU 61 Ca 0.04 2.47 -0.28 0.00 -1.03 0.00 0.00 54.13 55.32 2dl3 s LEU 61 Cb -0.13 -3.53 -0.10 0.00 0.03 0.00 0.00 46.19 42.46 2dl3 s LEU 61 CO -0.07 -1.10 1.15 -0.76 0.23 0.00 0.00 176.35 175.79 2dl3 s LEU 62 N 4.69 4.45 -0.49 1.79 1.43 -0.86 -4.92 118.68 124.77 2dl3 s LEU 62 Ca 0.85 2.35 -0.26 0.00 -1.03 0.00 0.00 54.13 56.04 2dl3 s LEU 62 Cb -0.39 -3.72 0.03 0.00 0.03 0.00 0.00 46.19 42.14 2dl3 s LEU 62 CO 0.38 -0.32 1.00 -0.94 0.23 0.00 0.00 176.35 176.70 2dl3 s SER 63 N -0.88 6.49 0.00 2.29 1.04 -1.26 -4.81 113.70 116.57 2dl3 s SER 63 Ca 0.48 0.11 0.00 0.00 0.48 0.00 0.00 55.95 57.02 2dl3 s SER 63 Cb -0.33 -2.48 0.00 0.00 0.10 0.00 0.00 66.02 63.31 2dl3 s SER 63 CO 0.42 -1.17 0.00 0.61 0.98 0.00 0.00 173.24 174.09 2dl3 n GLY 64 N 4.96 -3.14 3.77 7.32 0.00 -1.26 -4.92 105.19 111.92 2dl3 n GLY 64 Ca 0.07 -1.06 -0.38 0.00 0.00 0.00 0.00 46.02 44.65 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 0.00 3.93 0.53 1.61 0.04 -1.26 -5.06 135.00 134.79 2dl3 s PRO 65 Ca 0.00 1.84 0.01 0.00 0.04 0.00 0.00 61.00 62.89 2dl3 s PRO 65 Cb 0.00 -2.58 0.00 0.00 0.04 0.00 0.00 34.50 31.97 2dl3 s PRO 65 CO 0.00 -0.42 0.05 0.45 0.04 0.00 0.00 177.00 177.12 2dl3 s SER 66 N -1.19 4.22 -0.29 6.66 0.15 -1.26 -5.16 113.70 116.83 2dl3 s SER 66 Ca 0.60 -1.63 -0.17 0.00 0.70 0.00 0.00 55.95 55.44 2dl3 s SER 66 Cb -0.30 0.61 0.15 0.00 -1.71 0.00 0.00 66.02 64.77 2dl3 s SER 66 CO 0.38 -0.93 1.03 -0.55 1.20 0.00 0.00 173.24 174.36 2dl3 s SER 67 N -3.95 -0.43 0.00 5.45 0.15 -1.26 -5.33 113.70 108.32 2dl3 s SER 67 Ca 0.06 0.70 0.00 0.00 0.70 0.00 0.00 55.95 57.42 2dl3 s SER 67 Cb 0.00 1.14 0.00 0.00 -1.71 0.00 0.00 66.02 65.45 2dl3 s SER 67 CO 0.04 -0.11 0.00 0.61 1.20 0.00 0.00 173.24 174.98