#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dlk s SER 2 N 0.00 0.74 -1.10 1.61 0.15 -1.26 -4.87 113.70 108.98 2dlk s SER 2 Ca 0.00 -1.14 -0.07 0.00 0.70 0.00 0.00 55.95 55.45 2dlk s SER 2 Cb 0.00 0.20 0.01 0.00 -1.71 0.00 0.00 66.02 64.51 2dlk s SER 2 CO 0.00 -0.62 0.95 -0.24 1.20 0.00 0.00 173.24 174.53 2dlk n SER 3 N -0.10 -5.26 0.00 5.45 2.88 -1.26 -4.86 113.62 110.46 2dlk n SER 3 Ca -0.08 -0.45 0.00 0.00 -1.33 0.00 0.00 58.87 57.01 2dlk n SER 3 Cb 0.63 -4.20 0.00 0.00 -0.75 0.00 0.00 64.21 59.88 2dlk n SER 3 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2dlk n GLY 4 N -1.68 1.84 3.96 0.46 0.00 -1.26 -5.11 105.19 103.40 2dlk n GLY 4 Ca -0.01 -2.03 -0.23 0.00 0.00 0.00 0.00 46.02 43.75 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 6.32 -0.25 1.61 0.15 -1.26 -4.49 113.70 115.77 2dlk s SER 5 Ca 0.00 0.22 -0.01 0.00 0.70 0.00 0.00 55.95 56.87 2dlk s SER 5 Cb 0.00 -1.93 0.07 0.00 -1.71 0.00 0.00 66.02 62.45 2dlk s SER 5 CO 0.00 -0.14 0.03 -0.44 1.20 0.00 0.00 173.24 173.89 2dlk s SER 6 N -3.92 3.65 0.90 5.45 0.01 -1.26 -4.93 113.70 113.59 2dlk s SER 6 Ca 0.36 -1.26 -0.14 0.00 1.31 0.00 0.00 55.95 56.23 2dlk s SER 6 Cb -0.09 -0.91 0.01 0.00 0.21 0.00 0.00 66.02 65.24 2dlk s SER 6 CO 0.31 -0.32 0.39 0.61 0.41 0.00 0.00 173.24 174.64 2dlk n GLY 7 N 4.83 -2.00 2.70 3.44 0.00 -1.26 -4.88 105.19 108.01 2dlk n GLY 7 Ca -0.07 -0.66 -0.20 0.00 0.00 0.00 0.00 46.02 45.09 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 -3.35 0.03 0.60 1.61 1.00 -0.16 -4.91 119.30 114.12 2dlk s MET 8 Ca 0.58 0.32 -0.17 0.00 0.00 0.00 0.00 55.69 56.42 2dlk s MET 8 Cb -0.24 -0.55 -0.03 0.00 0.00 0.00 0.00 34.83 34.01 2dlk s MET 8 CO 0.66 -0.31 1.12 -1.25 0.00 0.00 0.00 175.02 175.24 2dlk s PRO 9 N 2.03 3.06 -0.01 2.03 0.04 -1.26 -1.95 135.00 138.94 2dlk s PRO 9 Ca 0.03 1.49 -0.30 0.00 0.04 0.00 0.00 61.00 62.26 2dlk s PRO 9 Cb -0.12 -1.98 -0.05 0.00 0.04 0.00 0.00 34.50 32.39 2dlk s PRO 9 CO -0.03 -1.06 1.35 0.00 0.04 0.00 0.00 177.00 177.30 2dlk h ASP 11 N 7.70 0.08 -2.54 0.00 3.32 -1.93 -3.41 116.42 119.64 2dlk h ASP 11 Ca -0.37 0.15 -0.58 0.00 0.02 0.00 0.00 57.03 56.25 2dlk h ASP 11 Cb 1.18 0.19 0.07 0.00 0.22 0.00 0.00 39.33 40.99 2dlk h ASP 11 CO 0.89 -0.04 0.73 0.33 -1.72 0.00 0.00 179.24 179.43 2dlk n PHE 12 N -5.14 2.29 -1.69 4.55 -0.00 -1.26 -4.95 117.46 111.26 2dlk n PHE 12 Ca 0.17 0.33 -0.33 0.00 -0.00 0.00 0.00 57.45 57.62 2dlk n PHE 12 Cb 0.53 -2.52 0.05 0.00 -0.00 0.00 0.00 39.48 37.54 2dlk n PHE 12 CO 0.00 0.00 0.00 -1.25 -0.00 0.00 0.00 176.76 175.51 2dlk s PRO 13 N 0.23 2.73 0.00 -7.13 0.04 -1.26 -3.66 135.00 125.94 2dlk s PRO 13 Ca 0.73 1.36 0.00 0.00 0.04 0.00 0.00 61.00 63.12 2dlk s PRO 13 Cb -0.65 -1.94 0.00 0.00 0.04 0.00 0.00 34.50 31.95 2dlk s PRO 13 CO 0.44 -1.30 0.00 0.41 0.04 0.00 0.00 177.00 176.58 2dlk n GLY 14 N -0.63 1.17 0.34 0.56 0.00 -1.26 -4.68 105.19 100.69 2dlk n GLY 14 Ca 0.10 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.26 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 -1.49 -0.54 3.20 0.00 0.00 -1.26 -4.96 105.19 100.14 2dlk n GLY 16 Ca 0.23 0.27 -0.29 0.00 0.00 0.00 0.00 46.02 46.23 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 -6.70 2.28 0.01 1.61 0.52 -1.26 -4.96 118.95 110.45 2dlk s ARG 17 Ca 0.23 -0.77 0.09 0.00 -0.52 0.00 0.00 55.73 54.76 2dlk s ARG 17 Cb -0.10 -1.91 -0.02 0.00 0.52 0.00 0.00 34.95 33.43 2dlk s ARG 17 CO 0.91 0.29 -0.26 0.42 0.02 0.00 0.00 175.30 176.68 2dlk s ILE 18 N 0.01 2.07 0.10 1.52 1.01 -1.26 0.15 121.20 124.80 2dlk s ILE 18 Ca -0.06 -1.23 0.05 0.00 0.00 0.00 0.00 60.65 59.41 2dlk s ILE 18 Cb -0.13 -1.74 -0.03 0.00 0.01 0.00 0.00 42.46 40.56 2dlk s ILE 18 CO 0.04 0.47 -0.13 -0.36 0.00 0.00 0.00 174.94 174.96 2dlk s PHE 19 N -0.70 1.24 -0.03 3.97 0.40 -0.82 -4.87 117.98 117.17 2dlk s PHE 19 Ca 0.11 -0.56 -0.02 0.00 -0.60 0.00 0.00 56.93 55.85 2dlk s PHE 19 Cb -0.10 -0.67 -0.27 0.00 0.51 0.00 0.00 43.02 42.50 2dlk s PHE 19 CO 0.00 0.08 0.74 0.66 0.70 0.00 0.00 175.22 177.39 2dlk h SER 20 N 3.72 0.35 -3.52 1.36 4.64 -1.90 -0.39 113.55 117.81 2dlk h SER 20 Ca -0.39 -0.55 -0.64 0.00 -0.47 0.00 0.00 61.79 59.74 2dlk h SER 20 Cb 1.19 -0.11 -0.20 0.00 -0.31 0.00 0.00 62.40 62.97 2dlk h SER 20 CO 0.49 1.47 -0.60 0.20 -0.87 0.00 0.00 176.83 177.52 2dlk s ASN 21 N -6.88 5.32 0.10 4.97 0.01 -1.26 -4.73 114.94 112.48 2dlk s ASN 21 Ca -0.11 -0.09 -0.28 0.00 -0.71 0.00 0.00 52.86 51.67 2dlk s ASN 21 Cb 0.07 -1.94 -0.12 0.00 0.41 0.00 0.00 41.25 39.68 2dlk s ASN 21 CO 0.83 0.05 1.65 -0.09 -1.51 0.00 0.00 177.10 178.03 2dlk h ARG 22 N 7.60 -0.50 -0.88 -0.60 1.12 -1.97 -2.47 114.38 116.68 2dlk h ARG 22 Ca -0.37 0.03 0.14 0.00 -1.11 0.00 0.00 59.98 58.68 2dlk h ARG 22 Cb 1.18 0.11 -0.15 0.00 -0.01 0.00 0.00 29.97 31.10 2dlk h ARG 22 CO 0.62 -0.33 -0.33 0.94 -3.11 0.00 0.00 179.97 177.76 2dlk n GLN 23 N -5.37 -0.19 -0.00 0.20 0.00 -1.26 0.40 117.38 111.16 2dlk n GLN 23 Ca -0.08 1.36 -0.11 0.00 -0.00 0.00 0.00 57.00 58.17 2dlk n GLN 23 Cb 0.28 -2.03 -0.05 0.00 0.00 0.00 0.00 30.24 28.44 2dlk n GLN 23 CO 0.00 0.00 0.00 1.88 0.00 0.00 0.00 177.06 178.94 2dlk h TYR 24 N 0.00 0.12 -0.45 3.69 0.05 -1.93 -2.72 116.97 115.72 2dlk h TYR 24 Ca 0.33 0.00 0.09 0.00 0.05 0.00 0.00 58.73 59.20 2dlk h TYR 24 Cb 0.55 -0.04 -0.10 0.00 1.01 0.00 0.00 36.73 38.15 2dlk h TYR 24 CO -0.76 0.08 -0.31 1.25 -1.05 0.00 0.00 178.16 177.37 2dlk h LEU 25 N 0.13 -1.05 -0.75 3.88 5.85 0.40 0.30 115.31 124.07 2dlk h LEU 25 Ca 0.04 0.20 0.12 0.00 0.84 0.00 0.00 57.88 59.08 2dlk h LEU 25 Cb -0.01 0.51 -0.09 0.00 0.37 0.00 0.00 40.66 41.44 2dlk h LEU 25 CO -0.01 -0.31 0.35 -1.13 -0.34 0.00 0.00 178.44 177.00 2dlk h ASN 26 N -0.21 0.39 0.46 1.25 -1.24 -1.03 -1.72 115.58 113.48 2dlk h ASN 26 Ca 0.19 0.09 -0.01 0.00 0.71 0.00 0.00 56.30 57.28 2dlk h ASN 26 Cb 0.53 0.03 -0.02 0.00 0.73 0.00 0.00 38.32 39.60 2dlk h ASN 26 CO -0.57 0.19 -0.37 -0.74 -1.29 0.00 0.00 177.43 174.64 2dlk h HIS 27 N 0.54 -0.99 -0.03 0.67 2.76 -0.67 -1.64 115.15 115.77 2dlk h HIS 27 Ca 0.40 0.00 0.03 0.00 -2.20 0.00 0.00 60.37 58.59 2dlk h HIS 27 Cb 0.53 0.37 -0.06 0.00 1.55 0.00 0.00 27.41 29.81 2dlk h HIS 27 CO -0.13 -0.53 -0.50 1.25 -1.30 0.00 0.00 177.93 176.71 2dlk h HIS 28 N -0.82 -1.47 -0.63 5.26 -0.00 -0.75 0.26 115.15 117.00 2dlk h HIS 28 Ca -0.05 0.05 0.11 0.00 -0.00 0.00 0.00 60.37 60.49 2dlk h HIS 28 Cb 0.71 0.65 -0.12 0.00 -0.00 0.00 0.00 27.41 28.64 2dlk h HIS 28 CO -0.17 -0.55 -0.31 0.87 -0.00 0.00 0.00 177.93 177.78 2dlk h LYS 29 N -0.63 -0.12 0.79 5.26 1.57 -1.26 0.89 116.57 123.07 2dlk h LYS 29 Ca 0.03 0.01 -0.04 0.00 -1.87 0.00 0.00 60.65 58.78 2dlk h LYS 29 Cb 0.70 0.03 0.01 0.00 0.08 0.00 0.00 32.23 33.04 2dlk h LYS 29 CO -0.37 -0.08 -0.40 -0.22 -0.57 0.00 0.00 179.45 177.82 2dlk h LYS 30 N -0.13 -1.04 0.10 3.15 3.64 -0.65 0.56 116.57 122.20 2dlk h LYS 30 Ca 0.26 0.07 -0.00 0.00 -1.27 0.00 0.00 60.65 59.71 2dlk h LYS 30 Cb 0.55 0.24 -0.01 0.00 -0.41 0.00 0.00 32.23 32.60 2dlk h LYS 30 CO -0.70 -0.69 -0.12 1.88 -2.27 0.00 0.00 179.45 177.55 2dlk h TYR 31 N -1.08 -0.33 0.08 1.91 -1.99 0.01 -3.30 116.97 112.27 2dlk h TYR 31 Ca -0.11 0.00 -0.00 0.00 2.00 0.00 0.00 58.73 60.62 2dlk h TYR 31 Cb 0.83 0.13 -0.00 0.00 2.00 0.00 0.00 36.73 39.69 2dlk h TYR 31 CO 0.02 -0.15 -0.07 1.96 -0.00 0.00 0.00 178.16 179.92 2dlk h GLN 32 N -0.22 -0.14 -6.36 4.88 1.08 0.70 -3.37 115.11 111.68 2dlk h GLN 32 Ca -0.01 0.01 -0.57 0.00 -1.45 0.00 0.00 58.65 56.63 2dlk h GLN 32 Cb 0.20 0.03 -0.09 0.00 -0.05 0.00 0.00 27.48 27.57 2dlk h GLN 32 CO -0.03 -0.09 0.87 -1.01 -0.95 0.00 0.00 178.83 177.62 2dlk s HIS 33 N -3.39 2.63 -0.15 2.96 3.76 0.20 -4.98 115.29 116.32 2dlk s HIS 33 Ca -0.02 0.25 -0.09 0.00 -0.15 0.00 0.00 55.06 55.04 2dlk s HIS 33 Cb 0.01 -4.41 0.05 0.00 1.11 0.00 0.00 32.58 29.34 2dlk s HIS 33 CO 0.08 -1.57 0.37 -1.50 -0.85 0.00 0.00 174.74 171.27 2dlk s ILE 34 N 4.75 -0.02 -0.13 0.60 2.07 -1.24 -3.89 121.20 123.33 2dlk s ILE 34 Ca 0.39 0.08 -0.11 0.00 -1.41 0.00 0.00 60.65 59.60 2dlk s ILE 34 Cb -0.09 -0.54 0.04 0.00 0.13 0.00 0.00 42.46 42.00 2dlk s ILE 34 CO 0.23 0.03 0.34 -2.28 -1.91 0.00 0.00 174.94 171.35 2dlk s HIS 35 N 1.06 -0.40 0.65 3.50 2.46 -1.26 -5.14 115.29 116.15 2dlk s HIS 35 Ca -0.07 0.96 -0.11 0.00 0.47 0.00 0.00 55.06 56.31 2dlk s HIS 35 Cb -0.07 0.14 -0.02 0.00 -0.13 0.00 0.00 32.58 32.50 2dlk s HIS 35 CO -0.08 -0.21 1.05 1.14 -2.47 0.00 0.00 174.74 174.17 2dlk s GLN 36 N 0.44 3.28 0.06 2.88 1.03 -1.26 -5.01 119.66 121.08 2dlk s GLN 36 Ca -0.02 0.61 -0.31 0.00 0.04 0.00 0.00 55.36 55.68 2dlk s GLN 36 Cb -0.04 -2.06 -0.06 0.00 0.03 0.00 0.00 33.01 30.87 2dlk s GLN 36 CO -0.02 -0.76 1.31 0.21 -2.54 0.00 0.00 175.29 173.49 2dlk s LYS 37 N -5.24 4.35 0.36 9.60 2.47 -1.26 -5.02 119.74 125.00 2dlk s LYS 37 Ca 0.56 1.92 0.04 0.00 -1.56 0.00 0.00 55.97 56.93 2dlk s LYS 37 Cb -0.11 -3.38 -0.05 0.00 -1.46 0.00 0.00 37.83 32.83 2dlk s LYS 37 CO 0.53 -0.41 0.06 -1.54 0.16 0.00 0.00 175.35 174.15 2dlk s SER 38 N 1.29 2.76 -0.40 1.43 1.04 -1.26 -5.11 113.70 113.46 2dlk s SER 38 Ca 0.62 -1.45 -0.26 0.00 0.48 0.00 0.00 55.95 55.33 2dlk s SER 38 Cb -0.32 0.03 0.02 0.00 0.10 0.00 0.00 66.02 65.85 2dlk s SER 38 CO 0.28 -0.67 0.94 -0.36 0.98 0.00 0.00 173.24 174.42 2dlk s PHE 39 N -3.18 3.02 0.16 5.02 0.08 -0.74 -4.97 117.98 117.37 2dlk s PHE 39 Ca 0.32 0.68 0.09 0.00 0.12 0.00 0.00 56.93 58.14 2dlk s PHE 39 Cb 0.07 -3.78 -0.04 0.00 -0.57 0.00 0.00 43.02 38.70 2dlk s PHE 39 CO 0.15 -0.92 -0.10 0.45 -0.10 0.00 0.00 175.22 174.69 2dlk s SER 40 N 2.01 4.24 0.12 1.36 0.15 -1.26 -0.22 113.70 120.11 2dlk s SER 40 Ca 0.39 -0.54 -0.30 0.00 0.70 0.00 0.00 55.95 56.20 2dlk s SER 40 Cb -0.11 -0.73 -0.06 0.00 -1.71 0.00 0.00 66.02 63.41 2dlk s SER 40 CO 0.21 0.13 1.08 0.00 1.20 0.00 0.00 173.24 175.86 2dlk h PRO 42 N 5.69 0.00 -6.67 0.00 0.13 -1.99 -3.45 132.00 125.72 2dlk h PRO 42 Ca -0.43 0.00 -0.53 0.00 -0.87 0.00 0.00 66.00 64.17 2dlk h PRO 42 Cb 1.21 0.00 0.04 0.00 0.13 0.00 0.00 31.00 32.39 2dlk h PRO 42 CO 0.74 0.15 0.76 -1.21 -0.23 0.00 0.00 178.00 178.21 2dlk s GLU 43 N -3.76 4.29 -0.02 0.86 8.01 -1.26 -4.95 118.70 121.87 2dlk s GLU 43 Ca -0.00 2.23 -0.25 0.00 0.01 0.00 0.00 54.97 56.95 2dlk s GLU 43 Cb 0.10 -3.16 -0.19 0.00 -4.31 0.00 0.00 34.13 26.57 2dlk s GLU 43 CO 0.60 -0.43 1.22 -1.00 0.01 0.00 0.00 175.26 175.66 2dlk h PRO 44 N 5.81 -0.06 -0.16 0.39 0.13 -2.02 -3.28 132.00 132.81 2dlk h PRO 44 Ca -0.44 0.00 0.01 0.00 -0.87 0.00 0.00 66.00 64.70 2dlk h PRO 44 Cb 1.21 0.01 -0.01 0.00 0.13 0.00 0.00 31.00 32.34 2dlk h PRO 44 CO 0.82 0.40 0.07 0.00 -0.23 0.00 0.00 178.00 179.06 2dlk h ALA 45 N 0.35 0.18 -0.98 -0.56 0.00 -1.92 -2.92 119.26 113.41 2dlk h ALA 45 Ca -0.01 0.01 0.15 0.00 0.00 0.00 0.00 54.91 55.07 2dlk h ALA 45 Cb 0.49 -0.01 -0.16 0.00 0.00 0.00 0.00 17.79 18.11 2dlk h ALA 45 CO 0.01 -0.37 -0.38 0.00 0.00 0.00 0.00 179.25 178.52 2dlk n GLY 47 N -1.47 -0.28 2.93 0.00 0.00 -1.11 -4.98 105.19 100.29 2dlk n GLY 47 Ca 0.10 0.14 -0.12 0.00 0.00 0.00 0.00 46.02 46.15 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 -6.46 0.19 0.12 1.61 1.02 -1.26 -5.11 119.74 109.85 2dlk s LYS 48 Ca 0.12 -0.27 0.08 0.00 0.02 0.00 0.00 55.97 55.92 2dlk s LYS 48 Cb -0.06 -0.04 -0.04 0.00 -0.52 0.00 0.00 37.83 37.17 2dlk s LYS 48 CO 0.87 0.00 -0.19 -1.12 -0.92 0.00 0.00 175.35 174.00 2dlk s SER 49 N -0.58 2.45 -0.00 2.83 0.01 -1.26 -2.50 113.70 114.65 2dlk s SER 49 Ca -0.05 -0.76 0.03 0.00 1.31 0.00 0.00 55.95 56.48 2dlk s SER 49 Cb -0.04 -0.13 -0.01 0.00 0.21 0.00 0.00 66.02 66.05 2dlk s SER 49 CO -0.00 -0.01 -0.11 -0.36 0.41 0.00 0.00 173.24 173.17 2dlk s PHE 50 N -1.61 0.96 -0.10 2.43 0.40 0.69 -5.00 117.98 115.76 2dlk s PHE 50 Ca 0.09 -0.19 -0.24 0.00 -0.60 0.00 0.00 56.93 55.99 2dlk s PHE 50 Cb -0.08 -0.61 -0.28 0.00 0.51 0.00 0.00 43.02 42.56 2dlk s PHE 50 CO 0.05 -0.01 0.78 -0.97 0.70 0.00 0.00 175.22 175.76 2dlk h ASN 51 N 5.80 0.24 -4.07 1.36 -1.24 -1.97 -1.97 115.58 113.74 2dlk h ASN 51 Ca -0.32 -0.94 -0.50 0.00 0.71 0.00 0.00 56.30 55.25 2dlk h ASN 51 Cb 1.17 -0.08 0.05 0.00 0.73 0.00 0.00 38.32 40.20 2dlk h ASN 51 CO 0.49 1.26 0.30 -0.36 -1.29 0.00 0.00 177.43 177.83 2dlk s PHE 52 N -2.34 3.59 -0.15 0.67 0.40 -1.26 -4.42 117.98 114.47 2dlk s PHE 52 Ca -0.17 1.10 -0.22 0.00 -0.60 0.00 0.00 56.93 57.04 2dlk s PHE 52 Cb -0.00 -2.58 -0.24 0.00 0.51 0.00 0.00 43.02 40.70 2dlk s PHE 52 CO 0.75 -0.56 0.51 -0.22 0.70 0.00 0.00 175.22 176.40 2dlk h LYS 53 N -0.13 0.09 -0.81 0.44 3.11 -1.98 -3.31 116.57 113.98 2dlk h LYS 53 Ca -0.45 -0.16 0.15 0.00 -2.81 0.00 0.00 60.65 57.38 2dlk h LYS 53 Cb 1.20 0.06 -0.10 0.00 -1.00 0.00 0.00 32.23 32.39 2dlk h LYS 53 CO 0.62 1.08 0.37 1.57 -2.81 0.00 0.00 179.45 180.27 2dlk h LYS 54 N -0.74 0.49 -0.47 1.90 2.10 -2.00 -0.57 116.57 117.28 2dlk h LYS 54 Ca -0.23 -0.03 0.03 0.00 -2.00 0.00 0.00 60.65 58.42 2dlk h LYS 54 Cb 1.38 -0.11 -0.03 0.00 -0.90 0.00 0.00 32.23 32.57 2dlk h LYS 54 CO -0.05 0.33 0.26 1.25 -2.00 0.00 0.00 179.45 179.24 2dlk h HIS 55 N 0.51 0.49 -0.50 0.07 2.76 -1.99 -2.39 115.15 114.09 2dlk h HIS 55 Ca 0.45 0.02 0.04 0.00 -2.20 0.00 0.00 60.37 58.68 2dlk h HIS 55 Cb 0.70 -0.15 -0.04 0.00 1.55 0.00 0.00 27.41 29.46 2dlk h HIS 55 CO -0.13 0.27 0.26 1.25 -1.30 0.00 0.00 177.93 178.28 2dlk h LEU 56 N 0.53 0.38 -0.21 0.26 5.85 -1.21 0.12 115.31 121.03 2dlk h LEU 56 Ca 0.19 0.03 0.05 0.00 0.84 0.00 0.00 57.88 58.99 2dlk h LEU 56 Cb 0.05 -0.05 -0.05 0.00 0.37 0.00 0.00 40.66 40.99 2dlk h LEU 56 CO -0.11 0.26 -0.10 0.50 -0.34 0.00 0.00 178.44 178.66 2dlk h LYS 57 N 0.51 -0.07 -0.60 1.25 1.63 -0.94 -2.23 116.57 116.12 2dlk h LYS 57 Ca 0.22 0.00 -0.07 0.00 -0.85 0.00 0.00 60.65 59.95 2dlk h LYS 57 Cb 0.12 0.01 -0.02 0.00 -0.60 0.00 0.00 32.23 31.74 2dlk h LYS 57 CO -0.15 -0.04 0.10 0.93 -3.45 0.00 0.00 179.45 176.84 2dlk h GLU 58 N -0.07 1.00 -0.56 1.90 4.39 -1.06 -3.10 114.58 117.08 2dlk h GLU 58 Ca 0.11 -0.27 0.11 0.00 0.34 0.00 0.00 59.36 59.65 2dlk h GLU 58 Cb 0.24 -0.12 -0.11 0.00 -0.10 0.00 0.00 28.75 28.66 2dlk h GLU 58 CO -0.26 0.94 -0.26 1.25 -1.16 0.00 0.00 179.01 179.53 2dlk h HIS 59 N 0.90 -0.66 -0.98 4.33 -0.00 -0.18 0.93 115.15 119.50 2dlk h HIS 59 Ca 0.18 0.06 0.38 0.00 -0.00 0.00 0.00 60.37 60.99 2dlk h HIS 59 Cb 0.42 0.38 -0.18 0.00 -0.00 0.00 0.00 27.41 28.03 2dlk h HIS 59 CO 0.03 -0.34 0.41 -1.33 -0.00 0.00 0.00 177.93 176.70 2dlk n MET 60 N -5.43 -0.06 -0.32 5.26 2.81 -0.97 0.59 117.12 119.00 2dlk n MET 60 Ca 0.05 1.38 0.17 0.00 -1.81 0.00 0.00 57.70 57.48 2dlk n MET 60 Cb 0.34 -2.40 0.34 0.00 -0.71 0.00 0.00 33.22 30.79 2dlk n MET 60 CO 0.00 0.00 0.00 0.87 1.51 0.00 0.00 175.97 178.35 2dlk h LYS 61 N 0.00 0.09 -0.53 0.03 1.57 -0.95 0.56 116.57 117.34 2dlk h LYS 61 Ca 0.77 -0.01 0.06 0.00 -1.87 0.00 0.00 60.65 59.61 2dlk h LYS 61 Cb 1.96 -0.02 -0.05 0.00 0.08 0.00 0.00 32.23 34.20 2dlk h LYS 61 CO -0.79 0.06 0.24 -0.07 -0.57 0.00 0.00 179.45 178.31 2dlk h LEU 62 N 0.09 0.30 0.31 2.94 3.38 0.01 0.22 115.31 122.55 2dlk h LEU 62 Ca 0.62 0.05 -0.01 0.00 0.09 0.00 0.00 57.88 58.63 2dlk h LEU 62 Cb 1.35 -0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.10 2dlk h LEU 62 CO -0.79 0.20 -0.18 0.45 0.09 0.00 0.00 178.44 178.22 2dlk h HIS 63 N 0.45 -0.47 -0.35 1.13 3.86 -0.00 -2.98 115.15 116.79 2dlk h HIS 63 Ca 0.25 -0.01 0.01 0.00 -1.16 0.00 0.00 60.37 59.46 2dlk h HIS 63 Cb 0.21 0.17 -0.02 0.00 1.06 0.00 0.00 27.41 28.83 2dlk h HIS 63 CO -0.13 -0.28 0.21 0.66 0.86 0.00 0.00 177.93 179.25 2dlk h SER 64 N -0.47 0.35 -0.92 2.45 4.64 -1.05 -2.87 113.55 115.68 2dlk h SER 64 Ca -0.03 0.00 0.16 0.00 -0.47 0.00 0.00 61.79 61.44 2dlk h SER 64 Cb 0.38 -0.07 -0.16 0.00 -0.31 0.00 0.00 62.40 62.24 2dlk h SER 64 CO 0.04 0.25 -0.32 0.47 -0.87 0.00 0.00 176.83 176.41 2dlk n ASP 65 N -4.88 -0.51 -4.34 4.97 8.00 0.75 -3.79 116.55 116.74 2dlk n ASP 65 Ca 0.00 1.59 -0.37 0.00 0.71 0.00 0.00 54.79 56.72 2dlk n ASP 65 Cb 0.05 -0.40 -0.13 0.00 -0.02 0.00 0.00 41.12 40.62 2dlk n ASP 65 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 2dlk s THR 66 N -5.96 3.93 0.15 -3.53 2.01 -1.08 -4.99 115.64 106.17 2dlk s THR 66 Ca -0.13 -0.69 -0.17 0.00 0.31 0.00 0.00 61.69 61.01 2dlk s THR 66 Cb 0.21 -3.02 0.00 0.00 0.01 0.00 0.00 72.50 69.70 2dlk s THR 66 CO 0.67 0.09 1.80 -0.09 -0.69 0.00 0.00 174.62 176.40 2dlk h ARG 67 N 8.23 0.44 -7.06 4.92 2.43 -1.75 -3.43 114.38 118.15 2dlk h ARG 67 Ca -0.32 -0.03 -0.55 0.00 -0.81 0.00 0.00 59.98 58.28 2dlk h ARG 67 Cb 1.13 -0.10 0.13 0.00 -0.42 0.00 0.00 29.97 30.71 2dlk h ARG 67 CO 0.60 0.29 0.58 -0.51 -1.51 0.00 0.00 179.97 179.42 2dlk s ASP 68 N -5.49 5.19 0.25 -3.80 1.01 -1.26 -4.96 116.67 107.61 2dlk s ASP 68 Ca -0.13 2.69 -0.30 0.00 0.71 0.00 0.00 52.55 55.53 2dlk s ASP 68 Cb 0.11 -2.63 -0.09 0.00 1.01 0.00 0.00 42.92 41.32 2dlk s ASP 68 CO 0.72 -1.62 1.02 -0.31 0.21 0.00 0.00 175.17 175.19 2dlk s TYR 69 N -1.35 3.78 0.21 4.23 1.51 -1.26 -5.01 117.35 119.46 2dlk s TYR 69 Ca 0.73 1.80 -0.30 0.00 -1.01 0.00 0.00 57.07 58.30 2dlk s TYR 69 Cb -0.39 -3.13 -0.08 0.00 -0.11 0.00 0.00 41.96 38.25 2dlk s TYR 69 CO 0.45 -0.05 1.14 -1.50 -1.11 0.00 0.00 175.55 174.48 2dlk s ILE 70 N -1.07 3.65 -0.09 2.71 1.10 -1.26 -5.03 121.20 121.20 2dlk s ILE 70 Ca 0.43 1.46 -0.05 0.00 -0.51 0.00 0.00 60.65 61.98 2dlk s ILE 70 Cb -0.29 -3.93 -0.04 0.00 0.15 0.00 0.00 42.46 38.35 2dlk s ILE 70 CO 0.36 0.27 0.13 0.00 -2.11 0.00 0.00 174.94 173.59 2dlk s GLU 72 N -1.23 0.87 0.39 0.00 0.41 -1.26 -5.13 118.70 112.75 2dlk s GLU 72 Ca 0.18 -1.37 0.08 0.00 -0.41 0.00 0.00 54.97 53.44 2dlk s GLU 72 Cb -0.12 -0.07 -0.02 0.00 -1.78 0.00 0.00 34.13 32.14 2dlk s GLU 72 CO 0.07 -0.10 0.36 -0.59 -0.49 0.00 0.00 175.26 174.52 2dlk s PHE 73 N -3.75 2.78 0.74 1.61 -0.12 -1.26 -5.13 117.98 112.84 2dlk s PHE 73 Ca 0.15 -0.42 -0.05 0.00 -0.05 0.00 0.00 56.93 56.56 2dlk s PHE 73 Cb 0.06 -2.06 0.11 0.00 -0.63 0.00 0.00 43.02 40.50 2dlk s PHE 73 CO -0.03 -0.04 1.04 -1.12 -0.05 0.00 0.00 175.22 175.02 2dlk s SER 74 N -4.10 4.40 0.00 1.98 0.01 -1.26 -5.03 113.70 109.70 2dlk s SER 74 Ca 0.46 0.08 0.00 0.00 1.31 0.00 0.00 55.95 57.81 2dlk s SER 74 Cb -0.04 -0.56 0.00 0.00 0.21 0.00 0.00 66.02 65.63 2dlk s SER 74 CO 0.28 -1.84 0.00 0.61 0.41 0.00 0.00 173.24 172.69 2dlk n GLY 75 N -2.98 0.91 2.00 3.44 0.00 -1.26 -5.12 105.19 102.19 2dlk n GLY 75 Ca 0.12 -1.86 -0.17 0.00 0.00 0.00 0.00 46.02 44.10 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 -2.24 -0.07 1.61 -0.04 -1.26 -5.02 135.00 127.99 2dlk n PRO 76 Ca 0.00 -1.00 -0.08 0.00 -0.04 0.00 0.00 63.50 62.38 2dlk n PRO 76 Cb 0.00 -0.94 -0.07 0.00 -0.04 0.00 0.00 33.50 32.46 2dlk n PRO 76 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2dlk h SER 77 N -2.00 0.00 -6.20 3.54 4.64 -2.03 -3.48 113.55 108.03 2dlk h SER 77 Ca -0.23 -0.46 -0.47 0.00 -0.47 0.00 0.00 61.79 60.16 2dlk h SER 77 Cb 0.72 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.77 2dlk h SER 77 CO 0.15 0.83 -0.74 -1.54 -0.87 0.00 0.00 176.83 174.66 2dlk n SER 78 N -4.66 -4.80 -0.83 4.97 3.41 -1.26 -5.22 113.62 105.23 2dlk n SER 78 Ca -0.08 -0.74 0.10 0.00 -0.26 0.00 0.00 58.87 57.89 2dlk n SER 78 Cb 0.29 -3.84 0.09 0.00 -0.26 0.00 0.00 64.21 60.49 2dlk n SER 78 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49