#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 -0.31 -0.15 1.61 7.64 -1.26 -4.85 113.62 116.30 2dl3 n SER 2 Ca 0.00 -1.10 -0.09 0.00 1.01 0.00 0.00 58.87 58.69 2dl3 n SER 2 Cb 0.00 -2.54 -0.00 0.00 -1.01 0.00 0.00 64.21 60.66 2dl3 n SER 2 CO 0.00 0.00 0.00 0.77 -3.01 0.00 0.00 175.04 172.80 2dl3 h SER 3 N -1.75 0.64 0.00 6.43 4.64 -2.12 -3.44 113.55 117.95 2dl3 h SER 3 Ca -0.63 -0.20 0.00 0.00 -0.47 0.00 0.00 61.79 60.48 2dl3 h SER 3 Cb 1.38 -0.17 0.00 0.00 -0.31 0.00 0.00 62.40 63.31 2dl3 h SER 3 CO 0.68 0.67 0.00 0.61 -0.87 0.00 0.00 176.83 177.92 2dl3 n GLY 4 N -0.68 0.47 3.86 -0.77 0.00 -1.26 -4.81 105.19 102.00 2dl3 n GLY 4 Ca 0.00 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.75 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 -0.21 -4.36 1.61 7.64 -1.26 -4.86 113.62 112.18 2dl3 n SER 5 Ca 0.00 -0.96 -0.37 0.00 1.01 0.00 0.00 58.87 58.54 2dl3 n SER 5 Cb 0.00 -1.21 -0.12 0.00 -1.01 0.00 0.00 64.21 61.86 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 -3.46 5.18 0.14 6.43 0.15 -1.26 -5.09 113.70 115.78 2dl3 s SER 6 Ca 0.28 -0.68 0.05 0.00 0.70 0.00 0.00 55.95 56.30 2dl3 s SER 6 Cb -0.16 -1.90 -0.04 0.00 -1.71 0.00 0.00 66.02 62.21 2dl3 s SER 6 CO 0.77 -0.19 -0.12 -0.83 1.20 0.00 0.00 173.24 174.07 2dl3 s GLY 7 N 1.51 1.08 -0.01 9.45 0.00 -1.26 -4.40 107.32 113.69 2dl3 s GLY 7 Ca 0.03 -1.39 0.01 0.00 0.00 0.00 0.00 44.72 43.37 2dl3 s GLY 7 CO 0.03 -1.47 -0.02 0.50 0.00 0.00 0.00 173.10 172.14 2dl3 s ARG 8 N -3.19 2.75 0.35 2.90 0.52 -0.20 -4.75 118.95 117.34 2dl3 s ARG 8 Ca 0.13 -0.61 -0.28 0.00 -0.52 0.00 0.00 55.73 54.45 2dl3 s ARG 8 Cb -0.01 -2.64 -0.09 0.00 0.52 0.00 0.00 34.95 32.72 2dl3 s ARG 8 CO 0.02 0.63 1.21 -1.25 0.02 0.00 0.00 175.30 175.93 2dl3 s PRO 9 N -1.42 4.30 -0.15 3.54 0.04 -1.26 -0.62 135.00 139.43 2dl3 s PRO 9 Ca 0.18 1.99 -0.08 0.00 0.04 0.00 0.00 61.00 63.13 2dl3 s PRO 9 Cb -0.11 -2.95 0.06 0.00 0.04 0.00 0.00 34.50 31.54 2dl3 s PRO 9 CO 0.08 -0.16 0.35 0.00 0.04 0.00 0.00 177.00 177.32 2dl3 s ALA 10 N -1.24 -0.88 -0.23 8.56 0.00 -0.45 -2.54 121.76 124.96 2dl3 s ALA 10 Ca 0.51 1.35 -0.12 0.00 0.00 0.00 0.00 51.96 53.70 2dl3 s ALA 10 Cb -0.35 -0.84 -0.05 0.00 0.00 0.00 0.00 23.12 21.88 2dl3 s ALA 10 CO 0.45 -0.26 0.23 0.50 0.00 0.00 0.00 175.76 176.68 2dl3 s ARG 11 N 1.39 4.09 -0.26 0.00 3.52 -0.18 -1.73 118.95 125.78 2dl3 s ARG 11 Ca -0.09 -0.14 -0.29 0.00 -0.13 0.00 0.00 55.73 55.08 2dl3 s ARG 11 Cb -0.09 -3.55 -0.02 0.00 -1.56 0.00 0.00 34.95 29.73 2dl3 s ARG 11 CO -0.11 0.01 1.58 0.00 -0.81 0.00 0.00 175.30 175.97 2dl3 s ALA 12 N 1.18 3.21 0.26 6.12 0.00 -0.64 0.35 121.76 132.25 2dl3 s ALA 12 Ca 0.11 0.33 0.04 0.00 0.00 0.00 0.00 51.96 52.44 2dl3 s ALA 12 Cb -0.14 -3.87 0.34 0.00 0.00 0.00 0.00 23.12 19.45 2dl3 s ALA 12 CO 0.06 -2.05 1.63 0.87 0.00 0.00 0.00 175.76 176.27 2dl3 h LYS 13 N 10.80 0.32 -4.12 0.00 1.79 0.62 0.37 116.57 126.35 2dl3 h LYS 13 Ca -0.32 -0.17 -0.14 0.00 -2.18 0.00 0.00 60.65 57.84 2dl3 h LYS 13 Cb 1.14 0.01 -0.18 0.00 -1.58 0.00 0.00 32.23 31.62 2dl3 h LYS 13 CO 1.02 0.72 -0.68 -0.06 -1.08 0.00 0.00 179.45 179.37 2dl3 s PHE 14 N -4.06 0.40 0.10 -1.35 0.40 -1.04 -4.70 117.98 107.73 2dl3 s PHE 14 Ca -0.05 -0.83 -0.31 0.00 -0.60 0.00 0.00 56.93 55.14 2dl3 s PHE 14 Cb 0.13 -0.30 -0.08 0.00 0.51 0.00 0.00 43.02 43.28 2dl3 s PHE 14 CO 0.79 -0.30 1.49 0.16 0.70 0.00 0.00 175.22 178.07 2dl3 s ASP 15 N -2.28 6.72 -0.05 1.36 1.47 -1.26 -4.25 116.67 118.37 2dl3 s ASP 15 Ca -0.03 2.41 0.02 0.00 1.18 0.00 0.00 52.55 56.12 2dl3 s ASP 15 Cb 0.00 -2.58 -0.03 0.00 -0.34 0.00 0.00 42.92 39.97 2dl3 s ASP 15 CO -0.06 -0.76 -0.08 0.12 0.68 0.00 0.00 175.17 175.08 2dl3 s PHE 16 N 1.61 2.90 -0.25 2.11 2.19 0.10 -4.90 117.98 121.74 2dl3 s PHE 16 Ca 0.68 -0.01 -0.02 0.00 0.33 0.00 0.00 56.93 57.92 2dl3 s PHE 16 Cb -0.39 -1.68 0.03 0.00 -1.31 0.00 0.00 43.02 39.67 2dl3 s PHE 16 CO 0.30 0.33 -0.06 0.15 1.83 0.00 0.00 175.22 177.77 2dl3 s LYS 17 N -0.93 2.83 -0.39 10.12 1.02 -1.26 -0.34 119.74 130.78 2dl3 s LYS 17 Ca 0.13 -0.98 -0.26 0.00 0.02 0.00 0.00 55.97 54.88 2dl3 s LYS 17 Cb -0.11 -2.98 0.02 0.00 -0.52 0.00 0.00 37.83 34.24 2dl3 s LYS 17 CO 0.03 -0.40 0.92 0.00 -0.92 0.00 0.00 175.35 174.98 2dl3 s ALA 18 N 1.32 3.36 0.20 5.17 0.00 -1.26 -4.90 121.76 125.65 2dl3 s ALA 18 Ca 0.00 -0.55 -0.05 0.00 0.00 0.00 0.00 51.96 51.37 2dl3 s ALA 18 Cb -0.17 -3.57 0.13 0.00 0.00 0.00 0.00 23.12 19.52 2dl3 s ALA 18 CO -0.05 -1.73 1.57 1.96 0.00 0.00 0.00 175.76 177.51 2dl3 h GLN 19 N 8.65 0.73 -4.90 0.00 4.20 -1.96 -3.46 115.11 118.37 2dl3 h GLN 19 Ca -0.23 -0.35 -0.46 0.00 0.06 0.00 0.00 58.65 57.66 2dl3 h GLN 19 Cb 1.08 -0.00 -0.13 0.00 0.30 0.00 0.00 27.48 28.72 2dl3 h GLN 19 CO 0.99 0.97 -0.52 0.95 -0.67 0.00 0.00 178.83 180.56 2dl3 s THR 20 N -4.38 0.15 0.21 -0.54 -4.23 -1.26 -5.05 115.64 100.54 2dl3 s THR 20 Ca -0.09 -2.00 -0.09 0.00 -1.18 0.00 0.00 61.69 58.33 2dl3 s THR 20 Cb 0.12 -2.47 0.15 0.00 1.34 0.00 0.00 72.50 71.64 2dl3 s THR 20 CO 0.84 0.00 1.78 0.25 -0.54 0.00 0.00 174.62 176.95 2dl3 h LEU 21 N 2.12 0.43 -0.98 4.79 5.85 -1.97 -1.98 115.31 123.58 2dl3 h LEU 21 Ca -0.29 0.05 0.30 0.00 0.84 0.00 0.00 57.88 58.78 2dl3 h LEU 21 Cb 1.24 -0.02 -0.18 0.00 0.37 0.00 0.00 40.66 42.07 2dl3 h LEU 21 CO 0.44 0.26 0.19 0.50 -0.34 0.00 0.00 178.44 179.49 2dl3 h LYS 22 N 0.57 0.04 -6.53 1.25 3.64 -1.97 -3.40 116.57 110.17 2dl3 h LYS 22 Ca 0.31 -0.00 -0.46 0.00 -1.27 0.00 0.00 60.65 59.23 2dl3 h LYS 22 Cb 0.29 -0.01 0.02 0.00 -0.41 0.00 0.00 32.23 32.12 2dl3 h LYS 22 CO -0.24 0.02 -0.20 -1.21 -2.27 0.00 0.00 179.45 175.56 2dl3 s GLU 23 N -5.87 3.21 -0.06 1.90 2.02 -0.74 -0.82 118.70 118.33 2dl3 s GLU 23 Ca -0.12 -0.59 0.04 0.00 0.02 0.00 0.00 54.97 54.32 2dl3 s GLU 23 Cb 0.30 -2.67 0.00 0.00 0.10 0.00 0.00 34.13 31.86 2dl3 s GLU 23 CO 0.78 -0.04 -0.17 -1.17 0.02 0.00 0.00 175.26 174.68 2dl3 s LEU 24 N -4.37 1.85 0.49 1.80 2.96 -0.62 -4.59 118.68 116.20 2dl3 s LEU 24 Ca 0.44 -0.37 -0.22 0.00 -0.22 0.00 0.00 54.13 53.77 2dl3 s LEU 24 Cb -0.10 -1.00 -0.07 0.00 0.50 0.00 0.00 46.19 45.53 2dl3 s LEU 24 CO 0.35 0.11 1.15 -2.16 -1.32 0.00 0.00 176.35 174.49 2dl3 s PRO 25 N 0.32 3.62 0.17 0.98 0.04 -1.26 -4.43 135.00 134.43 2dl3 s PRO 25 Ca -0.10 1.72 -0.08 0.00 0.04 0.00 0.00 61.00 62.57 2dl3 s PRO 25 Cb -0.14 -2.27 -0.01 0.00 0.04 0.00 0.00 34.50 32.12 2dl3 s PRO 25 CO 0.04 -0.66 0.27 -0.51 0.04 0.00 0.00 177.00 176.19 2dl3 s LEU 26 N -3.29 0.99 0.09 -3.56 1.43 0.54 -4.92 118.68 109.94 2dl3 s LEU 26 Ca 0.67 -0.91 0.03 0.00 -1.03 0.00 0.00 54.13 52.89 2dl3 s LEU 26 Cb -0.27 1.14 -0.04 0.00 0.03 0.00 0.00 46.19 47.05 2dl3 s LEU 26 CO 0.32 -0.89 -0.09 -1.10 0.23 0.00 0.00 176.35 174.82 2dl3 s GLN 27 N -3.98 0.78 -0.52 1.70 -0.21 -1.26 0.02 119.66 116.19 2dl3 s GLN 27 Ca 0.18 -1.13 -0.27 0.00 0.02 0.00 0.00 55.36 54.16 2dl3 s GLN 27 Cb 0.03 -0.40 -0.09 0.00 1.00 0.00 0.00 33.01 33.56 2dl3 s GLN 27 CO 0.01 0.05 2.42 1.17 -2.12 0.00 0.00 175.29 176.82 2dl3 n LYS 28 N 0.57 1.01 -0.13 2.91 4.81 -1.26 -1.93 118.16 124.15 2dl3 n LYS 28 Ca -0.16 0.07 0.00 0.00 -0.87 0.00 0.00 58.31 57.34 2dl3 n LYS 28 Cb 0.58 -3.14 0.00 0.00 0.02 0.00 0.00 35.03 32.49 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 6.07 0.79 3.53 3.14 0.00 0.13 -4.97 105.19 113.88 2dl3 n GLY 29 Ca 0.40 -0.03 -0.34 0.00 0.00 0.00 0.00 46.02 46.05 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 -1.66 4.52 -0.29 1.61 1.11 -0.81 -4.85 116.67 116.30 2dl3 s ASP 30 Ca 0.00 -0.10 -0.17 0.00 0.18 0.00 0.00 52.55 52.46 2dl3 s ASP 30 Cb 0.00 -1.29 -0.02 0.00 1.07 0.00 0.00 42.92 42.68 2dl3 s ASP 30 CO 0.00 0.30 0.46 -0.63 1.18 0.00 0.00 175.17 176.49 2dl3 s ILE 31 N -0.45 5.09 0.19 0.77 -1.09 -1.26 -1.63 121.20 122.82 2dl3 s ILE 31 Ca 0.06 0.59 0.08 0.00 -2.23 0.00 0.00 60.65 59.15 2dl3 s ILE 31 Cb -0.12 -3.83 -0.04 0.00 -1.58 0.00 0.00 42.46 36.89 2dl3 s ILE 31 CO 0.02 0.01 -0.16 0.68 -1.23 0.00 0.00 174.94 174.26 2dl3 s VAL 32 N 2.25 1.81 -0.28 2.92 -7.23 -0.71 -4.95 120.40 114.21 2dl3 s VAL 32 Ca 0.18 -2.10 -0.03 0.00 -1.81 0.00 0.00 61.98 58.22 2dl3 s VAL 32 Cb -0.16 -1.97 0.04 0.00 0.56 0.00 0.00 36.38 34.85 2dl3 s VAL 32 CO 0.11 -0.47 -0.00 -0.31 -0.31 0.00 0.00 175.10 174.11 2dl3 s TYR 33 N -2.57 3.18 -0.31 2.82 2.02 -1.25 -1.35 117.35 119.89 2dl3 s TYR 33 Ca 0.20 -1.63 -0.25 0.00 -0.37 0.00 0.00 57.07 55.02 2dl3 s TYR 33 Cb -0.03 -2.12 0.01 0.00 -0.40 0.00 0.00 41.96 39.42 2dl3 s TYR 33 CO 0.07 -0.75 0.87 0.42 -1.57 0.00 0.00 175.55 174.60 2dl3 s ILE 34 N 1.32 4.71 -0.06 2.71 1.01 0.21 -2.87 121.20 128.23 2dl3 s ILE 34 Ca -0.02 1.36 -0.13 0.00 0.00 0.00 0.00 60.65 61.86 2dl3 s ILE 34 Cb -0.18 -4.22 -0.30 0.00 0.01 0.00 0.00 42.46 37.76 2dl3 s ILE 34 CO -0.01 -0.31 0.65 1.88 0.00 0.00 0.00 174.94 177.15 2dl3 h TYR 35 N 8.08 0.66 -4.65 3.97 0.05 -0.95 -0.51 116.97 123.62 2dl3 h TYR 35 Ca -0.23 -0.48 -0.33 0.00 0.05 0.00 0.00 58.73 57.74 2dl3 h TYR 35 Cb 1.09 -0.03 -0.14 0.00 1.01 0.00 0.00 36.73 38.66 2dl3 h TYR 35 CO 0.79 1.64 -0.52 -1.59 -1.05 0.00 0.00 178.16 177.43 2dl3 s LYS 36 N -2.55 1.48 -0.31 4.88 -2.85 -1.19 -4.84 119.74 114.36 2dl3 s LYS 36 Ca -0.17 -1.78 -0.01 0.00 -1.00 0.00 0.00 55.97 53.02 2dl3 s LYS 36 Cb 0.05 0.31 0.06 0.00 -2.06 0.00 0.00 37.83 36.19 2dl3 s LYS 36 CO 0.83 -0.53 0.01 -1.14 0.10 0.00 0.00 175.35 174.62 2dl3 s GLN 37 N -3.80 2.26 0.06 1.78 0.74 -1.26 -2.07 119.66 117.38 2dl3 s GLN 37 Ca 0.39 -1.40 -0.34 0.00 0.05 0.00 0.00 55.36 54.05 2dl3 s GLN 37 Cb 0.04 -3.18 -0.18 0.00 1.10 0.00 0.00 33.01 30.79 2dl3 s GLN 37 CO 0.19 -0.69 1.52 0.82 -0.55 0.00 0.00 175.29 176.57 2dl3 h ILE 38 N 6.52 0.00 -4.73 -2.34 1.08 -1.79 -3.47 117.51 112.78 2dl3 h ILE 38 Ca -0.18 0.00 -0.40 0.00 -0.39 0.00 0.00 64.86 63.89 2dl3 h ILE 38 Cb 1.05 0.00 -0.14 0.00 -3.07 0.00 0.00 36.82 34.66 2dl3 h ILE 38 CO 0.54 0.00 -0.53 -1.81 -0.69 0.00 0.00 178.15 175.65 2dl3 s ASP 39 N -3.96 1.20 0.10 1.72 1.01 -1.23 -4.96 116.67 110.57 2dl3 s ASP 39 Ca -0.18 -1.63 0.11 0.00 0.71 0.00 0.00 52.55 51.56 2dl3 s ASP 39 Cb 0.03 0.49 0.53 0.00 1.01 0.00 0.00 42.92 44.98 2dl3 s ASP 39 CO 0.55 -0.98 1.35 0.00 0.21 0.00 0.00 175.17 176.29 2dl3 n GLN 40 N -0.51 0.06 -0.31 8.23 1.13 -1.26 -1.64 117.38 123.06 2dl3 n GLN 40 Ca 0.05 0.46 0.04 0.00 -1.94 0.00 0.00 57.00 55.62 2dl3 n GLN 40 Cb 0.64 -1.65 0.06 0.00 0.11 0.00 0.00 30.24 29.40 2dl3 n GLN 40 CO 0.00 0.00 0.00 0.09 -1.44 0.00 0.00 177.06 175.71 2dl3 n ASN 41 N -1.76 1.00 -4.14 1.08 4.13 -1.26 -4.99 115.26 109.32 2dl3 n ASN 41 Ca 0.01 -2.46 -0.11 0.00 1.68 0.00 0.00 54.58 53.69 2dl3 n ASN 41 Cb 0.08 -0.30 -0.09 0.00 -1.54 0.00 0.00 39.78 37.93 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 -1.22 1.00 0.34 3.10 0.52 -0.65 -2.73 118.94 119.28 2dl3 s TRP 42 Ca 0.14 -1.24 -0.08 0.00 0.02 0.00 0.00 56.10 54.93 2dl3 s TRP 42 Cb 0.12 -0.40 0.02 0.00 -1.15 0.00 0.00 33.47 32.05 2dl3 s TRP 42 CO 0.01 -0.72 0.56 0.71 0.02 0.00 0.00 176.95 177.54 2dl3 s TYR 43 N -4.11 0.66 -0.09 -1.98 2.02 0.80 -3.49 117.35 111.15 2dl3 s TYR 43 Ca 0.35 -1.04 -0.04 0.00 -0.37 0.00 0.00 57.07 55.98 2dl3 s TYR 43 Cb 0.05 0.23 0.05 0.00 -0.40 0.00 0.00 41.96 41.89 2dl3 s TYR 43 CO 0.12 -1.23 0.19 -2.00 -1.57 0.00 0.00 175.55 171.06 2dl3 s GLU 44 N -3.06 0.09 0.00 -0.62 2.12 -0.88 -1.55 118.70 114.81 2dl3 s GLU 44 Ca 0.25 0.54 0.00 0.00 0.36 0.00 0.00 54.97 56.12 2dl3 s GLU 44 Cb -0.02 -0.18 0.00 0.00 0.26 0.00 0.00 34.13 34.19 2dl3 s GLU 44 CO 0.16 -0.25 0.00 0.41 -0.54 0.00 0.00 175.26 175.04 2dl3 n GLY 45 N 4.88 3.49 3.31 -1.50 0.00 -0.83 -0.42 105.19 114.12 2dl3 n GLY 45 Ca -0.14 -1.05 -0.24 0.00 0.00 0.00 0.00 46.02 44.60 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 0.25 1.20 -0.28 1.61 2.12 -1.14 -2.01 118.70 120.46 2dl3 s GLU 46 Ca 0.00 -1.25 -0.01 0.00 0.36 0.00 0.00 54.97 54.07 2dl3 s GLU 46 Cb 0.00 -1.45 0.17 0.00 0.26 0.00 0.00 34.13 33.11 2dl3 s GLU 46 CO 0.00 0.33 0.53 -1.58 -0.54 0.00 0.00 175.26 173.99 2dl3 s HIS 47 N -1.37 -1.38 -1.06 5.30 2.46 0.16 -3.90 115.29 115.50 2dl3 s HIS 47 Ca 0.10 1.32 -0.02 0.00 0.47 0.00 0.00 55.06 56.92 2dl3 s HIS 47 Cb -0.09 0.34 -0.03 0.00 -0.13 0.00 0.00 32.58 32.68 2dl3 s HIS 47 CO 0.05 -0.86 0.90 1.58 -2.47 0.00 0.00 174.74 173.94 2dl3 n HIS 48 N 5.41 -2.14 -2.07 3.88 -0.00 -1.26 -2.34 115.22 116.69 2dl3 n HIS 48 Ca -0.01 0.84 -0.20 0.00 -0.00 0.00 0.00 57.72 58.36 2dl3 n HIS 48 Cb 0.51 -4.53 -0.04 0.00 -0.00 0.00 0.00 29.99 25.93 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 -1.17 0.45 2.91 1.57 0.00 -1.26 -4.97 105.19 102.72 2dl3 n GLY 49 Ca -0.19 -0.05 -0.25 0.00 0.00 0.00 0.00 46.02 45.54 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 -4.50 1.35 -0.13 1.61 3.52 -0.99 -5.13 118.95 114.68 2dl3 s ARG 50 Ca 0.00 -0.22 -0.04 0.00 -0.13 0.00 0.00 55.73 55.34 2dl3 s ARG 50 Cb 0.00 -1.35 -0.03 0.00 -1.56 0.00 0.00 34.95 32.00 2dl3 s ARG 50 CO 0.00 -0.17 0.00 0.08 -0.81 0.00 0.00 175.30 174.40 2dl3 s VAL 51 N 1.38 4.29 0.00 7.11 1.01 -1.26 0.40 120.40 133.32 2dl3 s VAL 51 Ca -0.02 -0.23 0.00 0.00 0.00 0.00 0.00 61.98 61.73 2dl3 s VAL 51 Cb -0.14 -2.86 0.00 0.00 0.00 0.00 0.00 36.38 33.39 2dl3 s VAL 51 CO -0.04 0.54 0.00 0.61 0.00 0.00 0.00 175.10 176.21 2dl3 n GLY 52 N 2.92 1.13 3.76 4.51 0.00 -0.85 -4.88 105.19 111.78 2dl3 n GLY 52 Ca -0.18 -0.89 -0.22 0.00 0.00 0.00 0.00 46.02 44.73 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 -2.46 3.60 -0.09 -0.61 -4.36 0.00 -1.96 121.20 115.32 2dl3 s ILE 53 Ca 0.00 -1.59 -0.30 0.00 -0.26 0.00 0.00 60.65 58.50 2dl3 s ILE 53 Cb 0.00 -3.11 0.10 0.00 1.25 0.00 0.00 42.46 40.71 2dl3 s ILE 53 CO 0.00 -0.27 0.87 0.72 0.24 0.00 0.00 174.94 176.50 2dl3 s PHE 54 N -2.30 -0.46 0.32 1.37 -0.12 -0.60 -1.58 117.98 114.61 2dl3 s PHE 54 Ca 0.36 0.71 -0.29 0.00 -0.05 0.00 0.00 56.93 57.66 2dl3 s PHE 54 Cb -0.05 0.46 -0.10 0.00 -0.63 0.00 0.00 43.02 42.69 2dl3 s PHE 54 CO 0.24 -0.48 1.22 -1.25 -0.05 0.00 0.00 175.22 174.90 2dl3 s PRO 55 N -1.55 4.42 0.11 1.99 0.04 -1.26 -0.14 135.00 138.60 2dl3 s PRO 55 Ca -0.03 2.04 -0.14 0.00 0.04 0.00 0.00 61.00 62.90 2dl3 s PRO 55 Cb -0.00 -3.07 -0.08 0.00 0.04 0.00 0.00 34.50 31.39 2dl3 s PRO 55 CO 0.02 -0.07 1.43 -0.09 0.04 0.00 0.00 177.00 178.34 2dl3 h ARG 56 N 3.44 0.75 -0.03 4.56 1.12 -1.80 -2.87 114.38 119.55 2dl3 h ARG 56 Ca -0.48 -0.39 0.01 0.00 -1.11 0.00 0.00 59.98 58.01 2dl3 h ARG 56 Cb 1.22 0.01 -0.00 0.00 -0.01 0.00 0.00 29.97 31.19 2dl3 h ARG 56 CO 0.66 1.01 0.44 0.00 -3.11 0.00 0.00 179.97 178.97 2dl3 h THR 57 N 0.51 0.02 0.05 0.20 1.03 -1.93 0.53 112.91 113.32 2dl3 h THR 57 Ca 0.05 0.00 -0.28 0.00 -0.01 0.00 0.00 66.41 66.17 2dl3 h THR 57 Cb 0.87 0.57 -0.03 0.00 -1.07 0.00 0.00 68.15 68.49 2dl3 h THR 57 CO 0.07 0.00 -1.47 1.88 -0.01 0.00 0.00 175.52 175.99 2dl3 h TYR 58 N 0.00 0.17 -0.97 0.00 -1.99 -1.89 -3.47 116.97 108.82 2dl3 h TYR 58 Ca 0.02 -0.13 -0.57 0.00 2.00 0.00 0.00 58.73 60.05 2dl3 h TYR 58 Cb 0.89 -0.01 -0.06 0.00 2.00 0.00 0.00 36.73 39.56 2dl3 h TYR 58 CO 0.00 1.16 -0.37 0.96 -0.00 0.00 0.00 178.16 179.92 2dl3 s ILE 59 N -2.63 1.97 -0.06 -2.88 -5.25 0.19 0.12 121.20 112.66 2dl3 s ILE 59 Ca -0.05 -1.53 -0.02 0.00 -0.99 0.00 0.00 60.65 58.06 2dl3 s ILE 59 Cb 0.08 -2.50 0.03 0.00 2.95 0.00 0.00 42.46 43.02 2dl3 s ILE 59 CO 0.83 0.00 0.04 -0.70 -1.79 0.00 0.00 174.94 173.32 2dl3 s GLU 60 N -4.15 0.22 0.14 0.37 2.56 0.16 -4.72 118.70 113.27 2dl3 s GLU 60 Ca 0.37 0.25 -0.31 0.00 0.00 0.00 0.00 54.97 55.28 2dl3 s GLU 60 Cb -0.01 -0.73 -0.09 0.00 2.00 0.00 0.00 34.13 35.30 2dl3 s GLU 60 CO 0.22 -0.33 1.42 -0.51 -0.56 0.00 0.00 175.26 175.50 2dl3 s LEU 61 N 2.08 4.38 0.58 2.70 1.43 -1.26 -1.02 118.68 127.58 2dl3 s LEU 61 Ca 0.05 2.42 -0.00 0.00 -1.03 0.00 0.00 54.13 55.57 2dl3 s LEU 61 Cb -0.12 -3.59 0.04 0.00 0.03 0.00 0.00 46.19 42.55 2dl3 s LEU 61 CO -0.04 -0.68 0.82 -0.76 0.23 0.00 0.00 176.35 175.93 2dl3 s LEU 62 N 0.87 3.18 0.00 1.79 1.43 -1.05 -4.95 118.68 119.94 2dl3 s LEU 62 Ca 0.64 0.04 0.00 0.00 -1.03 0.00 0.00 54.13 53.79 2dl3 s LEU 62 Cb -0.39 -2.86 0.00 0.00 0.03 0.00 0.00 46.19 42.97 2dl3 s LEU 62 CO 0.32 -1.25 0.01 -1.54 0.23 0.00 0.00 176.35 174.11 2dl3 n SER 63 N -2.46 3.02 -4.20 2.29 3.41 -1.26 -4.88 113.62 109.54 2dl3 n SER 63 Ca 0.08 -2.62 -0.40 0.00 -0.26 0.00 0.00 58.87 55.67 2dl3 n SER 63 Cb 0.60 0.25 -0.05 0.00 -0.26 0.00 0.00 64.21 64.75 2dl3 n SER 63 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 2dl3 s GLY 64 N -3.04 2.96 0.00 5.00 0.00 -1.26 -4.87 107.32 106.10 2dl3 s GLY 64 Ca 0.00 -3.67 0.11 0.00 0.00 0.00 0.00 44.72 41.17 2dl3 s GLY 64 CO 0.00 1.22 1.11 -1.55 0.00 0.00 0.00 173.10 173.88 2dl3 n PRO 65 N 2.86 0.49 -1.61 2.90 -0.04 -1.26 -4.85 135.00 133.48 2dl3 n PRO 65 Ca 0.19 0.00 -0.42 0.00 -0.04 0.00 0.00 63.50 63.22 2dl3 n PRO 65 Cb 0.39 -1.36 0.00 0.00 -0.04 0.00 0.00 33.50 32.49 2dl3 n PRO 65 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 2dl3 n SER 66 N -0.86 1.42 0.34 3.54 3.41 -1.26 -4.93 113.62 115.27 2dl3 n SER 66 Ca 0.08 1.09 -0.14 0.00 -0.26 0.00 0.00 58.87 59.65 2dl3 n SER 66 Cb 0.04 -1.35 -0.07 0.00 -0.26 0.00 0.00 64.21 62.57 2dl3 n SER 66 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 2dl3 h SER 67 N 1.76 -0.76 0.00 4.04 0.02 -2.06 -3.56 113.55 113.00 2dl3 h SER 67 Ca -0.43 0.03 0.00 0.00 -0.84 0.00 0.00 61.79 60.54 2dl3 h SER 67 Cb 1.33 0.20 0.00 0.00 0.14 0.00 0.00 62.40 64.07 2dl3 h SER 67 CO 0.58 -0.40 0.00 0.61 -1.14 0.00 0.00 176.83 176.48