#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dlk h SER 2 N 0.00 0.36 -0.85 1.61 0.02 -2.12 -1.77 113.55 110.79 2dlk h SER 2 Ca 0.00 0.12 0.14 0.00 -0.84 0.00 0.00 61.79 61.21 2dlk h SER 2 Cb 0.00 0.08 -0.15 0.00 0.14 0.00 0.00 62.40 62.47 2dlk h SER 2 CO 0.00 0.11 -0.35 0.77 -1.14 0.00 0.00 176.83 176.22 2dlk h SER 3 N 0.48 -1.29 0.00 3.07 4.64 -2.08 -3.46 113.55 114.92 2dlk h SER 3 Ca 0.47 0.28 0.00 0.00 -0.47 0.00 0.00 61.79 62.06 2dlk h SER 3 Cb 0.74 0.68 0.00 0.00 -0.31 0.00 0.00 62.40 63.51 2dlk h SER 3 CO -0.43 -0.29 0.00 0.61 -0.87 0.00 0.00 176.83 175.85 2dlk n GLY 4 N -1.47 2.38 3.78 -0.77 0.00 -0.67 -5.04 105.19 103.39 2dlk n GLY 4 Ca 0.09 -0.76 -0.03 0.00 0.00 0.00 0.00 46.02 45.31 2dlk n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2dlk s SER 5 N 0.00 -0.12 0.24 1.61 0.15 -1.26 -4.96 113.70 109.36 2dlk s SER 5 Ca 0.00 -0.48 -0.30 0.00 0.70 0.00 0.00 55.95 55.87 2dlk s SER 5 Cb 0.00 0.49 -0.09 0.00 -1.71 0.00 0.00 66.02 64.71 2dlk s SER 5 CO 0.00 -0.92 0.96 -0.44 1.20 0.00 0.00 173.24 174.04 2dlk s SER 6 N -3.05 7.60 0.00 5.45 0.01 -1.26 -4.98 113.70 117.47 2dlk s SER 6 Ca 0.15 1.98 0.00 0.00 1.31 0.00 0.00 55.95 59.39 2dlk s SER 6 Cb -0.01 -2.61 0.00 0.00 0.21 0.00 0.00 66.02 63.60 2dlk s SER 6 CO 0.03 0.12 0.00 0.61 0.41 0.00 0.00 173.24 174.41 2dlk n GLY 7 N 1.47 4.10 3.49 3.44 0.00 -1.26 -4.86 105.19 111.57 2dlk n GLY 7 Ca -0.02 -1.30 -0.40 0.00 0.00 0.00 0.00 46.02 44.31 2dlk n GLY 7 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2dlk s MET 8 N -2.80 3.44 0.71 1.61 1.00 0.13 -4.82 119.30 118.57 2dlk s MET 8 Ca 0.00 -0.67 -0.13 0.00 0.00 0.00 0.00 55.69 54.89 2dlk s MET 8 Cb 0.00 -3.70 0.02 0.00 0.00 0.00 0.00 34.83 31.15 2dlk s MET 8 CO 0.00 -0.42 1.10 -1.25 0.00 0.00 0.00 175.02 174.45 2dlk s PRO 9 N 1.68 2.57 -0.18 2.03 0.04 -1.26 -0.05 135.00 139.83 2dlk s PRO 9 Ca 0.05 1.30 -0.29 0.00 0.04 0.00 0.00 61.00 62.10 2dlk s PRO 9 Cb -0.17 -1.93 -0.01 0.00 0.04 0.00 0.00 34.50 32.43 2dlk s PRO 9 CO 0.09 -1.42 1.18 0.00 0.04 0.00 0.00 177.00 176.89 2dlk h ASP 11 N 7.89 0.64 -2.69 0.00 5.19 -1.93 -3.41 116.42 122.11 2dlk h ASP 11 Ca -0.25 0.14 -0.52 0.00 -0.62 0.00 0.00 57.03 55.78 2dlk h ASP 11 Cb 1.09 0.04 0.06 0.00 0.18 0.00 0.00 39.33 40.70 2dlk h ASP 11 CO 0.96 0.07 0.99 0.12 -3.12 0.00 0.00 179.24 178.27 2dlk s PHE 12 N -5.74 2.92 0.62 4.55 5.36 -1.26 -4.97 117.98 119.46 2dlk s PHE 12 Ca -0.10 0.39 -0.16 0.00 -0.96 0.00 0.00 56.93 56.09 2dlk s PHE 12 Cb 0.27 -4.10 -0.02 0.00 -0.34 0.00 0.00 43.02 38.83 2dlk s PHE 12 CO 0.80 -4.17 1.12 -1.25 -1.46 0.00 0.00 175.22 170.26 2dlk s PRO 13 N 1.21 2.98 0.00 10.12 0.04 -1.26 -3.65 135.00 144.44 2dlk s PRO 13 Ca 0.74 1.46 0.00 0.00 0.04 0.00 0.00 61.00 63.24 2dlk s PRO 13 Cb -0.49 -1.97 0.00 0.00 0.04 0.00 0.00 34.50 32.09 2dlk s PRO 13 CO 0.32 -1.12 0.00 0.41 0.04 0.00 0.00 177.00 176.65 2dlk n GLY 14 N -0.31 1.33 0.09 0.56 0.00 -1.26 -4.76 105.19 100.83 2dlk n GLY 14 Ca 0.11 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.10 2dlk n GLY 14 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dlk n GLY 16 N -1.05 0.78 3.75 0.00 0.00 -1.26 -5.06 105.19 102.34 2dlk n GLY 16 Ca 0.00 -0.61 -0.31 0.00 0.00 0.00 0.00 46.02 45.11 2dlk n GLY 16 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2dlk s ARG 17 N -5.05 2.79 -0.01 1.61 1.81 -1.26 -4.95 118.95 113.89 2dlk s ARG 17 Ca 0.05 -0.72 0.01 0.00 -1.72 0.00 0.00 55.73 53.35 2dlk s ARG 17 Cb -0.02 -2.68 0.00 0.00 -0.45 0.00 0.00 34.95 31.80 2dlk s ARG 17 CO 0.06 0.57 -0.04 0.42 -0.68 0.00 0.00 175.30 175.63 2dlk s ILE 18 N -1.34 0.31 -0.03 1.52 1.01 -1.26 0.13 121.20 121.54 2dlk s ILE 18 Ca 0.27 -0.14 -0.01 0.00 0.00 0.00 0.00 60.65 60.77 2dlk s ILE 18 Cb -0.12 -0.28 0.02 0.00 0.01 0.00 0.00 42.46 42.09 2dlk s ILE 18 CO 0.20 0.10 0.06 -0.36 0.00 0.00 0.00 174.94 174.93 2dlk s PHE 19 N 0.05 -0.04 0.06 3.97 0.40 0.92 -4.85 117.98 118.50 2dlk s PHE 19 Ca -0.00 0.18 -0.37 0.00 -0.60 0.00 0.00 56.93 56.14 2dlk s PHE 19 Cb -0.03 -0.09 -0.20 0.00 0.51 0.00 0.00 43.02 43.20 2dlk s PHE 19 CO -0.00 -0.07 1.57 0.77 0.70 0.00 0.00 175.22 178.19 2dlk h SER 20 N 6.72 -1.15 -3.71 1.36 0.02 -1.89 0.37 113.55 115.26 2dlk h SER 20 Ca -0.35 0.05 -0.49 0.00 -0.84 0.00 0.00 61.79 60.15 2dlk h SER 20 Cb 1.16 0.31 -0.00 0.00 0.14 0.00 0.00 62.40 64.01 2dlk h SER 20 CO 0.47 -0.79 0.12 0.21 -1.14 0.00 0.00 176.83 175.70 2dlk s ASN 21 N -4.07 6.57 0.07 3.07 3.84 -1.26 -4.44 114.94 118.73 2dlk s ASN 21 Ca -0.20 1.17 -0.15 0.00 0.21 0.00 0.00 52.86 53.90 2dlk s ASN 21 Cb 0.02 -2.34 -0.20 0.00 -0.55 0.00 0.00 41.25 38.19 2dlk s ASN 21 CO 0.60 -0.36 1.22 -0.09 -2.79 0.00 0.00 177.10 175.68 2dlk h ARG 22 N 1.45 0.67 -0.78 0.43 2.43 -1.99 -3.24 114.38 113.36 2dlk h ARG 22 Ca -0.47 -0.63 0.15 0.00 -0.81 0.00 0.00 59.98 58.23 2dlk h ARG 22 Cb 1.18 0.16 -0.15 0.00 -0.42 0.00 0.00 29.97 30.74 2dlk h ARG 22 CO 0.64 1.23 -0.20 0.37 -1.51 0.00 0.00 179.97 180.50 2dlk h GLN 23 N 0.33 -0.01 -0.51 0.20 5.75 -1.98 0.20 115.11 119.11 2dlk h GLN 23 Ca -0.08 0.00 -0.01 0.00 -0.15 0.00 0.00 58.65 58.41 2dlk h GLN 23 Cb 1.46 0.00 -0.02 0.00 1.07 0.00 0.00 27.48 29.98 2dlk h GLN 23 CO 0.16 -0.00 0.29 1.88 -2.65 0.00 0.00 178.83 178.51 2dlk h TYR 24 N -0.01 0.68 0.35 3.99 0.05 -1.98 -2.00 116.97 118.05 2dlk h TYR 24 Ca 0.37 -0.01 -0.00 0.00 0.05 0.00 0.00 58.73 59.14 2dlk h TYR 24 Cb 0.57 -0.22 -0.03 0.00 1.01 0.00 0.00 36.73 38.06 2dlk h TYR 24 CO -0.62 0.48 -0.48 1.25 -1.05 0.00 0.00 178.16 177.74 2dlk h LEU 25 N 0.68 -1.37 -0.66 3.88 5.85 -0.69 0.19 115.31 123.19 2dlk h LEU 25 Ca 0.18 0.12 0.13 0.00 0.84 0.00 0.00 57.88 59.15 2dlk h LEU 25 Cb 0.01 0.47 -0.09 0.00 0.37 0.00 0.00 40.66 41.43 2dlk h LEU 25 CO -0.03 -0.59 0.18 -1.13 -0.34 0.00 0.00 178.44 176.53 2dlk h ASN 26 N -0.86 0.09 -0.78 1.25 -0.73 -1.15 0.87 115.58 114.26 2dlk h ASN 26 Ca -0.04 0.11 0.05 0.00 1.87 0.00 0.00 56.30 58.29 2dlk h ASN 26 Cb 0.78 0.14 -0.05 0.00 0.27 0.00 0.00 38.32 39.46 2dlk h ASN 26 CO -0.13 0.03 0.51 -0.74 -0.37 0.00 0.00 177.43 176.74 2dlk h HIS 27 N 0.32 0.89 0.04 0.67 2.76 -0.90 0.20 115.15 119.12 2dlk h HIS 27 Ca 0.35 0.02 -0.00 0.00 -2.20 0.00 0.00 60.37 58.54 2dlk h HIS 27 Cb 0.54 -0.29 0.00 0.00 1.55 0.00 0.00 27.41 29.20 2dlk h HIS 27 CO -0.23 0.49 -0.02 1.25 -1.30 0.00 0.00 177.93 178.13 2dlk h HIS 28 N 0.90 -0.05 0.00 5.26 -0.00 0.12 0.17 115.15 121.55 2dlk h HIS 28 Ca 0.33 -0.00 -0.05 0.00 -0.00 0.00 0.00 60.37 60.64 2dlk h HIS 28 Cb 0.16 0.02 -0.01 0.00 -0.00 0.00 0.00 27.41 27.58 2dlk h HIS 28 CO -0.00 0.31 -0.25 0.87 -0.00 0.00 0.00 177.93 178.86 2dlk h LYS 29 N -0.42 0.00 0.00 5.26 1.57 -0.86 0.94 116.57 123.07 2dlk h LYS 29 Ca -0.01 0.00 -0.10 0.00 -1.87 0.00 0.00 60.65 58.68 2dlk h LYS 29 Cb 0.38 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.68 2dlk h LYS 29 CO 0.01 0.25 -0.60 -0.22 -0.57 0.00 0.00 179.45 178.32 2dlk h LYS 30 N 0.00 0.00 0.00 3.15 3.64 -0.51 -2.83 116.57 120.02 2dlk h LYS 30 Ca -0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 2dlk h LYS 30 Cb 0.45 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.27 2dlk h LYS 30 CO 0.03 0.39 -0.35 0.66 -2.27 0.00 0.00 179.45 177.92 2dlk n TYR 31 N -3.14 0.07 0.50 1.91 4.02 0.58 -3.78 117.16 117.33 2dlk n TYR 31 Ca 0.00 0.03 -0.20 0.00 -0.01 0.00 0.00 57.90 57.73 2dlk n TYR 31 Cb 0.72 -0.24 -0.09 0.00 -0.02 0.00 0.00 39.34 39.70 2dlk n TYR 31 CO 0.00 0.00 0.00 1.96 -1.01 0.00 0.00 176.86 177.81 2dlk h GLN 32 N -0.39 -1.23 -0.50 -0.72 1.08 0.71 -2.48 115.11 111.58 2dlk h GLN 32 Ca 0.00 0.08 0.00 0.00 -1.45 0.00 0.00 58.65 57.28 2dlk h GLN 32 Cb 0.35 0.28 0.00 0.00 -0.05 0.00 0.00 27.48 28.06 2dlk h GLN 32 CO 0.00 -0.82 0.00 0.72 -0.95 0.00 0.00 178.83 177.78 2dlk n HIS 33 N -5.59 0.00 -1.60 2.96 8.25 -1.11 -4.90 115.22 113.22 2dlk n HIS 33 Ca -0.16 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 56.88 2dlk n HIS 33 Cb 0.50 -0.05 0.00 0.00 1.12 0.00 0.00 29.99 31.57 2dlk n HIS 33 CO 0.00 0.00 0.00 1.51 0.64 0.00 0.00 176.34 178.49 2dlk n ILE 34 N -0.22 2.28 -0.28 1.59 3.06 -0.94 -4.81 119.36 120.04 2dlk n ILE 34 Ca 0.00 -0.50 0.07 0.00 -2.50 0.00 0.00 62.75 59.82 2dlk n ILE 34 Cb 0.13 -1.12 0.16 0.00 0.54 0.00 0.00 39.64 39.34 2dlk n ILE 34 CO 0.00 0.00 0.00 1.57 -2.50 0.00 0.00 176.55 175.62 2dlk n HIS 35 N -0.30 0.37 -1.67 9.51 -0.00 -1.26 -4.17 115.22 117.70 2dlk n HIS 35 Ca 0.09 0.97 -0.42 0.00 -0.00 0.00 0.00 57.72 58.36 2dlk n HIS 35 Cb 0.37 -1.01 -0.03 0.00 -0.00 0.00 0.00 29.99 29.32 2dlk n HIS 35 CO 0.00 0.00 0.00 -1.14 -0.00 0.00 0.00 176.34 175.20 2dlk s GLN 36 N -5.91 3.93 0.20 1.57 2.00 -1.26 -4.95 119.66 115.24 2dlk s GLN 36 Ca -0.11 2.48 -0.15 0.00 -2.00 0.00 0.00 55.36 55.58 2dlk s GLN 36 Cb 0.22 -4.20 0.01 0.00 0.80 0.00 0.00 33.01 29.84 2dlk s GLN 36 CO 0.62 -1.19 0.47 0.15 -0.50 0.00 0.00 175.29 174.84 2dlk s LYS 37 N 4.85 1.38 -0.15 1.67 1.02 -1.26 -4.97 119.74 122.27 2dlk s LYS 37 Ca 0.91 -1.01 -0.29 0.00 0.02 0.00 0.00 55.97 55.60 2dlk s LYS 37 Cb -0.40 0.48 -0.05 0.00 -0.52 0.00 0.00 37.83 37.34 2dlk s LYS 37 CO 0.40 -0.57 1.79 0.45 -0.92 0.00 0.00 175.35 176.51 2dlk s SER 38 N -2.92 6.27 -0.12 2.83 0.15 -1.26 -4.91 113.70 113.74 2dlk s SER 38 Ca 0.13 1.95 -0.29 0.00 0.70 0.00 0.00 55.95 58.45 2dlk s SER 38 Cb -0.00 -2.53 -0.06 0.00 -1.71 0.00 0.00 66.02 61.72 2dlk s SER 38 CO 0.00 -1.30 1.99 -0.36 1.20 0.00 0.00 173.24 174.77 2dlk s PHE 39 N 5.45 1.41 0.16 3.44 0.08 -0.99 -4.94 117.98 122.59 2dlk s PHE 39 Ca 0.80 0.14 0.10 0.00 0.12 0.00 0.00 56.93 58.09 2dlk s PHE 39 Cb -0.31 -4.07 -0.04 0.00 -0.57 0.00 0.00 43.02 38.03 2dlk s PHE 39 CO 0.33 -4.44 -0.22 -1.54 -0.10 0.00 0.00 175.22 169.24 2dlk s SER 40 N 5.86 3.08 0.18 1.36 1.04 -1.26 -1.30 113.70 122.66 2dlk s SER 40 Ca 0.89 -0.83 -0.30 0.00 0.48 0.00 0.00 55.95 56.20 2dlk s SER 40 Cb -0.35 -0.21 -0.08 0.00 0.10 0.00 0.00 66.02 65.49 2dlk s SER 40 CO 0.36 0.08 1.07 0.00 0.98 0.00 0.00 173.24 175.73 2dlk n PRO 42 N 2.28 0.49 -4.63 0.00 -0.04 -1.26 -4.62 135.00 127.22 2dlk n PRO 42 Ca 0.02 0.00 -0.33 0.00 -0.04 0.00 0.00 63.50 63.15 2dlk n PRO 42 Cb 0.46 -1.28 -0.14 0.00 -0.04 0.00 0.00 33.50 32.50 2dlk n PRO 42 CO 0.00 0.00 0.00 -2.00 -0.04 0.00 0.00 175.50 173.46 2dlk s GLU 43 N -2.00 3.37 -0.02 0.54 2.12 -1.26 -5.03 118.70 116.41 2dlk s GLU 43 Ca 0.13 -0.68 -0.25 0.00 0.36 0.00 0.00 54.97 54.53 2dlk s GLU 43 Cb 0.06 -2.68 -0.19 0.00 0.26 0.00 0.00 34.13 31.58 2dlk s GLU 43 CO 0.10 0.14 1.21 -1.00 -0.54 0.00 0.00 175.26 175.17 2dlk h PRO 44 N 6.95 -0.08 -0.37 4.30 0.13 -2.02 -3.29 132.00 137.62 2dlk h PRO 44 Ca -0.29 0.01 0.07 0.00 -0.87 0.00 0.00 66.00 64.91 2dlk h PRO 44 Cb 1.20 0.02 -0.06 0.00 0.13 0.00 0.00 31.00 32.29 2dlk h PRO 44 CO 0.57 0.37 0.02 0.00 -0.23 0.00 0.00 178.00 178.73 2dlk h ALA 45 N 0.30 0.36 -0.94 -0.56 0.00 -1.98 -1.96 119.26 114.48 2dlk h ALA 45 Ca -0.01 0.10 0.27 0.00 0.00 0.00 0.00 54.91 55.27 2dlk h ALA 45 Cb 0.49 0.16 -0.17 0.00 0.00 0.00 0.00 17.79 18.28 2dlk h ALA 45 CO 0.01 -0.38 0.13 0.00 0.00 0.00 0.00 179.25 179.02 2dlk n GLY 47 N -1.44 -0.82 2.68 0.00 0.00 -0.74 -4.99 105.19 99.88 2dlk n GLY 47 Ca 0.23 0.39 -0.23 0.00 0.00 0.00 0.00 46.02 46.41 2dlk n GLY 47 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2dlk s LYS 48 N -6.06 0.14 0.14 1.61 1.02 -1.26 -5.14 119.74 110.19 2dlk s LYS 48 Ca 0.37 0.13 0.05 0.00 0.02 0.00 0.00 55.97 56.54 2dlk s LYS 48 Cb -0.13 -1.11 -0.04 0.00 -0.52 0.00 0.00 37.83 36.03 2dlk s LYS 48 CO 0.86 -0.45 0.09 -1.12 -0.92 0.00 0.00 175.35 173.81 2dlk s SER 49 N 2.10 5.35 -0.00 2.83 0.01 -1.26 -3.36 113.70 119.36 2dlk s SER 49 Ca 0.04 -0.15 -0.01 0.00 1.31 0.00 0.00 55.95 57.14 2dlk s SER 49 Cb -0.14 -1.36 -0.00 0.00 0.21 0.00 0.00 66.02 64.74 2dlk s SER 49 CO -0.06 0.11 0.02 -0.36 0.41 0.00 0.00 173.24 173.36 2dlk s PHE 50 N -1.62 0.02 0.01 2.43 0.08 -0.42 -5.03 117.98 113.44 2dlk s PHE 50 Ca 0.29 -0.02 -0.09 0.00 0.12 0.00 0.00 56.93 57.23 2dlk s PHE 50 Cb -0.11 -0.02 -0.31 0.00 -0.57 0.00 0.00 43.02 42.01 2dlk s PHE 50 CO 0.22 -0.04 0.90 -0.91 -0.10 0.00 0.00 175.22 175.28 2dlk h ASN 51 N 5.88 0.59 -3.29 1.36 2.35 -1.96 -2.64 115.58 117.88 2dlk h ASN 51 Ca -0.25 -0.74 -0.65 0.00 -0.55 0.00 0.00 56.30 54.11 2dlk h ASN 51 Cb 1.21 -0.19 -0.12 0.00 0.05 0.00 0.00 38.32 39.27 2dlk h ASN 51 CO 0.48 1.60 -0.63 -0.36 -1.65 0.00 0.00 177.43 176.87 2dlk s PHE 52 N -2.61 3.10 0.16 1.19 0.40 -1.26 -4.41 117.98 114.54 2dlk s PHE 52 Ca -0.10 0.06 -0.11 0.00 -0.60 0.00 0.00 56.93 56.17 2dlk s PHE 52 Cb 0.06 -1.62 0.04 0.00 0.51 0.00 0.00 43.02 42.00 2dlk s PHE 52 CO 0.89 0.49 1.63 1.57 0.70 0.00 0.00 175.22 180.49 2dlk h LYS 53 N 3.76 0.93 -0.91 0.44 2.10 -1.96 -3.08 116.57 117.85 2dlk h LYS 53 Ca -0.48 -0.28 0.23 0.00 -2.00 0.00 0.00 60.65 58.12 2dlk h LYS 53 Cb 1.17 -0.09 -0.17 0.00 -0.90 0.00 0.00 32.23 32.24 2dlk h LYS 53 CO 0.61 0.93 -0.06 0.36 -2.00 0.00 0.00 179.45 179.29 2dlk n LYS 54 N -4.30 -0.08 -0.13 0.07 2.85 -1.26 0.16 118.16 115.48 2dlk n LYS 54 Ca 0.02 1.38 -0.11 0.00 -1.05 0.00 0.00 58.31 58.55 2dlk n LYS 54 Cb 0.31 -2.16 0.01 0.00 -0.65 0.00 0.00 35.03 32.54 2dlk n LYS 54 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 177.40 177.80 2dlk h HIS 55 N 0.00 1.08 -0.58 5.58 3.86 -1.97 -2.89 115.15 120.23 2dlk h HIS 55 Ca 0.52 -0.28 0.07 0.00 -1.16 0.00 0.00 60.37 59.52 2dlk h HIS 55 Cb 1.00 -0.24 -0.06 0.00 1.06 0.00 0.00 27.41 29.16 2dlk h HIS 55 CO -0.54 1.09 0.26 1.25 0.86 0.00 0.00 177.93 180.85 2dlk h LEU 56 N 0.78 0.32 0.53 2.43 5.85 0.16 -0.23 115.31 125.15 2dlk h LEU 56 Ca 0.09 0.05 -0.03 0.00 0.84 0.00 0.00 57.88 58.83 2dlk h LEU 56 Cb 0.86 0.00 0.01 0.00 0.37 0.00 0.00 40.66 41.90 2dlk h LEU 56 CO 0.08 0.21 -0.25 0.50 -0.34 0.00 0.00 178.44 178.63 2dlk h LYS 57 N 0.48 -0.68 -0.95 1.25 3.64 -1.08 -0.74 116.57 118.49 2dlk h LYS 57 Ca 0.27 0.05 0.28 0.00 -1.27 0.00 0.00 60.65 59.98 2dlk h LYS 57 Cb 0.26 0.16 -0.04 0.00 -0.41 0.00 0.00 32.23 32.20 2dlk h LYS 57 CO -0.23 -0.45 0.78 1.05 -2.27 0.00 0.00 179.45 178.32 2dlk h GLU 58 N -0.77 0.00 -0.02 1.90 -0.00 -1.42 0.42 114.58 114.69 2dlk h GLU 58 Ca -0.07 0.00 -0.24 0.00 -0.00 0.00 0.00 59.36 59.04 2dlk h GLU 58 Cb 0.54 0.00 0.02 0.00 -0.00 0.00 0.00 28.75 29.31 2dlk h GLU 58 CO 0.12 0.00 -0.94 1.25 -0.00 0.00 0.00 179.01 179.44 2dlk h HIS 59 N 0.00 0.98 -0.84 2.06 2.76 -0.74 -3.27 115.15 116.10 2dlk h HIS 59 Ca 0.45 -0.52 0.03 0.00 -2.20 0.00 0.00 60.37 58.13 2dlk h HIS 59 Cb 2.01 -0.12 -0.05 0.00 1.55 0.00 0.00 27.41 30.80 2dlk h HIS 59 CO 0.00 1.36 0.54 0.52 -1.30 0.00 0.00 177.93 179.05 2dlk h MET 60 N 0.33 1.03 -0.72 5.26 2.86 0.14 -2.74 114.93 121.08 2dlk h MET 60 Ca -0.11 -0.06 0.21 0.00 -2.06 0.00 0.00 59.70 57.67 2dlk h MET 60 Cb 1.60 -0.23 -0.13 0.00 0.06 0.00 0.00 31.60 32.90 2dlk h MET 60 CO 0.19 0.68 0.05 1.63 1.06 0.00 0.00 176.91 180.52 2dlk n LYS 61 N -4.55 -0.06 0.22 1.72 5.02 -0.94 0.82 118.16 120.40 2dlk n LYS 61 Ca 0.10 1.08 -0.15 0.00 -2.02 0.00 0.00 58.31 57.32 2dlk n LYS 61 Cb 0.08 -1.73 -0.08 0.00 -0.02 0.00 0.00 35.03 33.28 2dlk n LYS 61 CO 0.00 0.00 0.00 -0.07 -0.52 0.00 0.00 177.40 176.81 2dlk h LEU 62 N 0.00 -0.47 -0.81 -0.35 3.38 -1.68 -3.08 115.31 112.30 2dlk h LEU 62 Ca 0.46 -0.08 0.12 0.00 0.09 0.00 0.00 57.88 58.46 2dlk h LEU 62 Cb 0.97 0.12 -0.08 0.00 0.09 0.00 0.00 40.66 41.76 2dlk h LEU 62 CO -0.67 -0.20 0.43 0.45 0.09 0.00 0.00 178.44 178.54 2dlk h HIS 63 N -0.75 0.76 -3.13 1.13 3.86 0.32 -3.43 115.15 113.92 2dlk h HIS 63 Ca -0.06 0.03 -0.42 0.00 -1.16 0.00 0.00 60.37 58.77 2dlk h HIS 63 Cb 0.52 -0.22 0.22 0.00 1.06 0.00 0.00 27.41 28.99 2dlk h HIS 63 CO -0.01 0.25 -0.04 0.45 0.86 0.00 0.00 177.93 179.44 2dlk s SER 64 N -5.50 0.24 -1.38 2.45 0.15 0.64 -3.83 113.70 106.46 2dlk s SER 64 Ca -0.12 1.34 -0.09 0.00 0.70 0.00 0.00 55.95 57.78 2dlk s SER 64 Cb 0.20 -2.06 0.02 0.00 -1.71 0.00 0.00 66.02 62.47 2dlk s SER 64 CO 0.78 -4.63 1.15 -0.67 1.20 0.00 0.00 173.24 171.06 2dlk n ASP 65 N -5.19 -5.98 -4.51 5.45 2.03 -1.26 -4.97 116.55 102.11 2dlk n ASP 65 Ca 0.05 -0.58 -0.33 0.00 0.52 0.00 0.00 54.79 54.44 2dlk n ASP 65 Cb 0.56 -4.86 -0.12 0.00 -0.72 0.00 0.00 41.12 35.97 2dlk n ASP 65 CO 0.00 0.00 0.00 0.28 -1.92 0.00 0.00 177.20 175.56 2dlk s THR 66 N -3.32 3.50 -0.19 5.18 -1.32 -1.25 -5.03 115.64 113.21 2dlk s THR 66 Ca 0.58 -0.54 -0.18 0.00 -1.21 0.00 0.00 61.69 60.34 2dlk s THR 66 Cb -0.26 -2.45 -0.14 0.00 -1.51 0.00 0.00 72.50 68.14 2dlk s THR 66 CO 0.75 0.57 0.08 -1.14 -2.21 0.00 0.00 174.62 172.66 2dlk n ARG 67 N 2.66 0.53 -0.28 7.08 3.00 -1.26 -4.47 116.66 123.93 2dlk n ARG 67 Ca -0.18 0.55 -0.10 0.00 -0.00 0.00 0.00 57.85 58.12 2dlk n ARG 67 Cb 0.53 -1.72 -0.09 0.00 0.00 0.00 0.00 32.46 31.18 2dlk n ARG 67 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.63 177.19 2dlk h ASP 68 N -1.00 -1.79 -3.48 6.15 5.19 -2.01 -3.40 116.42 116.07 2dlk h ASP 68 Ca -0.27 0.26 -0.49 0.00 -0.62 0.00 0.00 57.03 55.91 2dlk h ASP 68 Cb 1.10 0.77 0.02 0.00 0.18 0.00 0.00 39.33 41.41 2dlk h ASP 68 CO -0.16 -0.25 0.06 -0.31 -3.12 0.00 0.00 179.24 175.46 2dlk s TYR 69 N -5.21 3.54 0.01 4.55 2.02 -1.26 -5.10 117.35 115.89 2dlk s TYR 69 Ca -0.11 0.79 0.00 0.00 -0.37 0.00 0.00 57.07 57.38 2dlk s TYR 69 Cb 0.09 -2.27 -0.01 0.00 -0.40 0.00 0.00 41.96 39.37 2dlk s TYR 69 CO 0.54 -0.18 -0.02 -1.50 -1.57 0.00 0.00 175.55 172.81 2dlk s ILE 70 N -2.60 0.11 0.15 2.71 2.07 -1.26 -4.78 121.20 117.60 2dlk s ILE 70 Ca 0.47 -0.49 -0.02 0.00 -1.41 0.00 0.00 60.65 59.19 2dlk s ILE 70 Cb -0.10 -0.18 -0.04 0.00 0.13 0.00 0.00 42.46 42.27 2dlk s ILE 70 CO 0.41 -0.24 0.11 0.00 -1.91 0.00 0.00 174.94 173.30 2dlk s GLU 72 N -4.07 0.61 0.64 0.00 8.01 -1.26 -5.15 118.70 117.49 2dlk s GLU 72 Ca 0.27 -0.54 -0.16 0.00 0.01 0.00 0.00 54.97 54.56 2dlk s GLU 72 Cb 0.07 -0.52 -0.01 0.00 -4.31 0.00 0.00 34.13 29.36 2dlk s GLU 72 CO 0.04 0.13 1.11 -0.06 0.01 0.00 0.00 175.26 176.49 2dlk s PHE 73 N -0.75 2.64 0.30 1.61 0.08 -1.26 -5.05 117.98 115.55 2dlk s PHE 73 Ca -0.02 1.55 -0.19 0.00 0.12 0.00 0.00 56.93 58.38 2dlk s PHE 73 Cb -0.06 -3.18 0.04 0.00 -0.57 0.00 0.00 43.02 39.25 2dlk s PHE 73 CO 0.00 -1.66 0.80 -1.54 -0.10 0.00 0.00 175.22 172.73 2dlk s SER 74 N -2.47 -0.11 0.00 1.36 1.04 -1.26 -5.13 113.70 107.13 2dlk s SER 74 Ca 0.68 -0.83 0.00 0.00 0.48 0.00 0.00 55.95 56.28 2dlk s SER 74 Cb -0.21 0.74 0.00 0.00 0.10 0.00 0.00 66.02 66.65 2dlk s SER 74 CO 0.39 -1.42 0.00 0.61 0.98 0.00 0.00 173.24 173.80 2dlk n GLY 75 N -0.51 1.14 0.00 7.32 0.00 -1.26 -4.98 105.19 106.90 2dlk n GLY 75 Ca -0.06 -0.38 0.03 0.00 0.00 0.00 0.00 46.02 45.61 2dlk n GLY 75 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2dlk n PRO 76 N 0.00 0.49 -3.07 1.61 -0.04 -1.26 -4.81 135.00 127.92 2dlk n PRO 76 Ca 0.00 0.00 -0.13 0.00 -0.04 0.00 0.00 63.50 63.33 2dlk n PRO 76 Cb 0.00 -1.21 0.05 0.00 -0.04 0.00 0.00 33.50 32.30 2dlk n PRO 76 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 2dlk n SER 77 N -0.71 -3.73 -0.06 3.54 7.64 -1.26 -4.95 113.62 114.09 2dlk n SER 77 Ca 0.05 -0.35 -0.11 0.00 1.01 0.00 0.00 58.87 59.47 2dlk n SER 77 Cb 0.02 -3.34 -0.05 0.00 -1.01 0.00 0.00 64.21 59.83 2dlk n SER 77 CO 0.00 0.00 0.00 -1.28 -3.01 0.00 0.00 175.04 170.75 2dlk h SER 78 N -1.50 0.30 0.00 6.43 0.87 -2.03 -3.58 113.55 114.04 2dlk h SER 78 Ca -0.36 -0.21 0.00 0.00 -1.23 0.00 0.00 61.79 59.99 2dlk h SER 78 Cb 1.22 -0.08 0.00 0.00 -0.44 0.00 0.00 62.40 63.10 2dlk h SER 78 CO 0.33 0.44 0.00 0.61 -0.53 0.00 0.00 176.83 177.68