#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 -0.52 0.42 1.61 0.01 -1.26 -5.18 113.70 108.78 2dlk s SER 2 Ca 0.00 0.64 0.07 0.00 1.31 0.00 0.00 55.95 57.97 2dlk s SER 2 Cb 0.00 0.61 -0.05 0.00 0.21 0.00 0.00 66.02 66.79 2dlk s SER 2 CO 0.00 -0.48 0.14 -0.44 0.41 0.00 0.00 173.24 172.87 2dlk s SER 3 N -0.92 4.30 0.00 2.44 0.01 -1.26 -5.12 113.70 113.15 2dlk s SER 3 Ca -0.09 -1.17 0.00 0.00 1.31 0.00 0.00 55.95 55.99 2dlk s SER 3 Cb -0.02 -0.39 0.00 0.00 0.21 0.00 0.00 66.02 65.81 2dlk s SER 3 CO 0.07 -0.55 0.00 0.61 0.41 0.00 0.00 173.24 173.77 2dlk n GLY 4 N -1.20 0.97 3.98 3.44 0.00 -1.26 -5.18 105.19 105.95 2dlk n GLY 4 Ca -0.03 0.42 -0.20 0.00 0.00 0.00 0.00 46.02 46.22 2dlk n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dlk s SER 5 N 0.00 5.96 0.19 1.61 0.01 -1.26 -5.01 113.70 115.20 2dlk s SER 5 Ca 0.00 -0.10 -0.15 0.00 1.31 0.00 0.00 55.95 57.01 2dlk s SER 5 Cb 0.00 -1.30 0.18 0.00 0.21 0.00 0.00 66.02 65.11 2dlk s SER 5 CO 0.00 -0.47 1.65 0.77 0.41 0.00 0.00 173.24 175.60 2dlk h SER 6 N 0.82 -0.47 -4.66 2.44 4.64 -2.00 -3.48 113.55 110.84 2dlk h SER 6 Ca -0.46 0.16 0.00 0.00 -0.47 0.00 0.00 61.79 61.02 2dlk h SER 6 Cb 1.26 0.32 0.00 0.00 -0.31 0.00 0.00 62.40 63.67 2dlk h SER 6 CO 0.54 -0.17 0.00 0.61 -0.87 0.00 0.00 176.83 176.94 2dlk n GLY 7 N -1.37 0.37 3.31 -0.77 0.00 -1.26 -4.96 105.19 100.51 2dlk n GLY 7 Ca 0.05 -1.80 -0.35 0.00 0.00 0.00 0.00 46.02 43.93 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 -2.41 3.36 0.62 1.61 1.00 0.55 -4.86 119.30 119.18 2dlk s MET 8 Ca 0.00 -0.64 -0.17 0.00 0.00 0.00 0.00 55.69 54.89 2dlk s MET 8 Cb 0.00 -3.04 -0.02 0.00 0.00 0.00 0.00 34.83 31.77 2dlk s MET 8 CO 0.00 -0.21 1.12 -1.25 0.00 0.00 0.00 175.02 174.67 2dlk s PRO 9 N 1.48 3.00 -0.40 2.03 0.04 -1.26 -1.02 135.00 138.87 2dlk s PRO 9 Ca 0.06 1.47 -0.29 0.00 0.04 0.00 0.00 61.00 62.28 2dlk s PRO 9 Cb -0.14 -1.97 0.01 0.00 0.04 0.00 0.00 34.50 32.43 2dlk s PRO 9 CO -0.03 -1.11 1.42 0.00 0.04 0.00 0.00 177.00 177.32 2dlk h ASP 11 N 10.65 0.18 -2.82 0.00 3.58 -1.92 -3.39 116.42 122.69 2dlk h ASP 11 Ca -0.28 0.13 -0.52 0.00 0.42 0.00 0.00 57.03 56.78 2dlk h ASP 11 Cb 1.11 0.14 0.05 0.00 1.72 0.00 0.00 39.33 42.35 2dlk h ASP 11 CO 1.08 -0.22 0.93 0.12 -2.88 0.00 0.00 179.24 178.27 2dlk s PHE 12 N -5.22 2.98 0.58 0.28 2.19 -1.26 -4.97 117.98 112.56 2dlk s PHE 12 Ca -0.07 0.55 -0.18 0.00 0.33 0.00 0.00 56.93 57.56 2dlk s PHE 12 Cb 0.30 -4.01 -0.04 0.00 -1.31 0.00 0.00 43.02 37.96 2dlk s PHE 12 CO 0.83 -3.74 1.12 -1.25 1.83 0.00 0.00 175.22 174.02 2dlk s PRO 13 N 0.98 3.16 0.00 10.12 0.04 -1.26 -3.62 135.00 144.42 2dlk s PRO 13 Ca 0.71 1.53 0.00 0.00 0.04 0.00 0.00 61.00 63.28 2dlk s PRO 13 Cb -0.46 -1.99 0.00 0.00 0.04 0.00 0.00 34.50 32.09 2dlk s PRO 13 CO 0.33 -0.99 0.00 0.41 0.04 0.00 0.00 177.00 176.80 2dlk n GLY 14 N -0.08 1.49 0.33 0.56 0.00 -1.26 -4.77 105.19 101.46 2dlk n GLY 14 Ca 0.11 -0.04 -0.09 0.00 0.00 0.00 0.00 46.02 46.00 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 -1.20 -0.16 3.34 0.00 0.00 -1.26 -5.03 105.19 100.87 2dlk n GLY 16 Ca 0.02 -0.02 -0.26 0.00 0.00 0.00 0.00 46.02 45.75 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 -5.33 1.26 -0.01 1.61 0.52 -1.26 -4.99 118.95 110.75 2dlk s ARG 17 Ca 0.14 -1.25 0.03 0.00 -0.52 0.00 0.00 55.73 54.14 2dlk s ARG 17 Cb -0.06 -1.63 -0.01 0.00 0.52 0.00 0.00 34.95 33.76 2dlk s ARG 17 CO 0.55 0.38 -0.11 0.42 0.02 0.00 0.00 175.30 176.56 2dlk s ILE 18 N -1.11 0.85 0.04 1.52 1.01 -1.26 0.62 121.20 122.87 2dlk s ILE 18 Ca 0.10 -0.46 0.05 0.00 0.00 0.00 0.00 60.65 60.34 2dlk s ILE 18 Cb -0.10 -0.71 -0.02 0.00 0.01 0.00 0.00 42.46 41.64 2dlk s ILE 18 CO 0.05 0.24 -0.14 -0.36 0.00 0.00 0.00 174.94 174.73 2dlk s PHE 19 N -0.25 1.21 -0.01 3.97 0.40 -0.19 -4.84 117.98 118.27 2dlk s PHE 19 Ca 0.04 -0.35 -0.22 0.00 -0.60 0.00 0.00 56.93 55.80 2dlk s PHE 19 Cb -0.04 -0.72 -0.13 0.00 0.51 0.00 0.00 43.02 42.64 2dlk s PHE 19 CO -0.00 0.03 0.94 0.77 0.70 0.00 0.00 175.22 177.66 2dlk h SER 20 N 4.97 -0.57 -3.04 1.36 0.02 -1.94 0.16 113.55 114.51 2dlk h SER 20 Ca -0.38 -0.04 -0.45 0.00 -0.84 0.00 0.00 61.79 60.09 2dlk h SER 20 Cb 1.18 0.15 0.07 0.00 0.14 0.00 0.00 62.40 63.94 2dlk h SER 20 CO 0.44 -0.16 0.12 0.21 -1.14 0.00 0.00 176.83 176.30 2dlk s ASN 21 N -4.80 4.81 -0.14 3.07 2.47 -1.26 -4.63 114.94 114.46 2dlk s ASN 21 Ca -0.12 0.13 -0.14 0.00 0.42 0.00 0.00 52.86 53.16 2dlk s ASN 21 Cb 0.01 -0.79 -0.11 0.00 -1.45 0.00 0.00 41.25 38.92 2dlk s ASN 21 CO 0.38 -1.54 0.17 0.03 -3.72 0.00 0.00 177.10 172.42 2dlk h ARG 22 N -0.40 0.00 -0.84 0.43 2.47 -2.01 -3.32 114.38 110.72 2dlk h ARG 22 Ca -0.42 0.00 0.34 0.00 -1.26 0.00 0.00 59.98 58.64 2dlk h ARG 22 Cb 1.30 0.00 -0.15 0.00 -1.65 0.00 0.00 29.97 29.46 2dlk h ARG 22 CO 0.53 0.44 0.41 1.04 0.56 0.00 0.00 179.97 182.95 2dlk n GLN 23 N -4.62 -0.05 -0.10 0.04 6.02 -1.26 0.19 117.38 117.60 2dlk n GLN 23 Ca -0.11 1.17 -0.11 0.00 -0.01 0.00 0.00 57.00 57.94 2dlk n GLN 23 Cb 0.32 -2.07 -0.03 0.00 1.02 0.00 0.00 30.24 29.48 2dlk n GLN 23 CO 0.00 0.00 0.00 1.88 -1.01 0.00 0.00 177.06 177.93 2dlk h TYR 24 N 0.00 0.52 0.98 1.08 -1.99 -1.99 -1.21 116.97 114.36 2dlk h TYR 24 Ca 0.70 -0.08 -0.05 0.00 2.00 0.00 0.00 58.73 61.30 2dlk h TYR 24 Cb 1.81 -0.14 0.01 0.00 2.00 0.00 0.00 36.73 40.41 2dlk h TYR 24 CO -0.05 0.59 -0.47 1.25 -0.00 0.00 0.00 178.16 179.48 2dlk h LEU 25 N 0.30 -1.13 -0.16 3.88 5.85 0.20 -0.02 115.31 124.24 2dlk h LEU 25 Ca 0.09 0.04 0.05 0.00 0.84 0.00 0.00 57.88 58.90 2dlk h LEU 25 Cb 0.35 0.29 -0.06 0.00 0.37 0.00 0.00 40.66 41.61 2dlk h LEU 25 CO 0.01 -0.80 -0.27 -1.13 -0.34 0.00 0.00 178.44 175.90 2dlk h ASN 26 N -1.32 -0.85 -0.82 1.25 -0.73 -1.33 0.79 115.58 112.57 2dlk h ASN 26 Ca -0.13 0.14 0.13 0.00 1.87 0.00 0.00 56.30 58.30 2dlk h ASN 26 Cb 1.02 0.38 -0.06 0.00 0.27 0.00 0.00 38.32 39.92 2dlk h ASN 26 CO 0.22 -0.31 0.54 -0.74 -0.37 0.00 0.00 177.43 176.76 2dlk h HIS 27 N -0.33 0.71 -0.31 0.67 2.76 -1.19 0.71 115.15 118.17 2dlk h HIS 27 Ca 0.11 0.02 -0.11 0.00 -2.20 0.00 0.00 60.37 58.19 2dlk h HIS 27 Cb 0.49 -0.23 -0.01 0.00 1.55 0.00 0.00 27.41 29.22 2dlk h HIS 27 CO -0.38 0.28 -0.23 1.25 -1.30 0.00 0.00 177.93 177.55 2dlk h HIS 28 N 0.62 0.84 0.00 5.26 -0.00 0.69 0.14 115.15 122.70 2dlk h HIS 28 Ca 0.40 -0.23 -0.05 0.00 -0.00 0.00 0.00 60.37 60.49 2dlk h HIS 28 Cb 0.68 -0.18 -0.01 0.00 -0.00 0.00 0.00 27.41 27.90 2dlk h HIS 28 CO -0.00 0.97 -0.24 0.87 -0.00 0.00 0.00 177.93 179.52 2dlk h LYS 29 N 0.47 0.00 0.00 5.26 1.57 0.34 0.59 116.57 124.80 2dlk h LYS 29 Ca 0.06 0.00 -0.06 0.00 -1.87 0.00 0.00 60.65 58.78 2dlk h LYS 29 Cb 0.79 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.09 2dlk h LYS 29 CO 0.06 0.24 -1.15 1.17 -0.57 0.00 0.00 179.45 179.20 2dlk n LYS 30 N -3.53 0.61 -0.07 3.15 0.00 0.12 -2.91 118.16 115.53 2dlk n LYS 30 Ca -0.01 0.15 -0.07 0.00 0.00 0.00 0.00 58.31 58.39 2dlk n LYS 30 Cb 0.40 -1.82 -0.02 0.00 0.00 0.00 0.00 35.03 33.59 2dlk n LYS 30 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.40 178.06 2dlk n TYR 31 N -2.74 0.17 0.21 5.64 4.02 0.48 -3.72 117.16 121.23 2dlk n TYR 31 Ca -0.03 0.07 -0.13 0.00 -0.01 0.00 0.00 57.90 57.80 2dlk n TYR 31 Cb 0.65 -0.47 -0.07 0.00 -0.02 0.00 0.00 39.34 39.43 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 -0.81 -0.56 -0.32 -0.72 1.08 -0.03 -3.01 115.11 110.74 2dlk h GLN 32 Ca 0.00 0.04 0.00 0.00 -1.45 0.00 0.00 58.65 57.24 2dlk h GLN 32 Cb 0.72 0.13 0.00 0.00 -0.05 0.00 0.00 27.48 28.28 2dlk h GLN 32 CO 0.00 -0.25 0.00 0.72 -0.95 0.00 0.00 178.83 178.35 2dlk n HIS 33 N -5.20 0.05 -0.33 2.96 8.25 -1.07 -4.30 115.22 115.59 2dlk n HIS 33 Ca -0.10 -0.02 0.19 0.00 -0.26 0.00 0.00 57.72 57.53 2dlk n HIS 33 Cb 0.29 -0.04 0.37 0.00 1.12 0.00 0.00 29.99 31.73 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 -0.28 -0.41 -4.70 1.59 0.13 -1.14 -4.53 119.36 110.02 2dlk n ILE 34 Ca 0.01 2.08 -0.32 0.00 -1.10 0.00 0.00 62.75 63.42 2dlk n ILE 34 Cb 0.10 -3.13 -0.08 0.00 -0.84 0.00 0.00 39.64 35.70 2dlk n ILE 34 CO 0.00 0.00 0.00 -1.38 2.80 0.00 0.00 176.55 177.97 2dlk s HIS 35 N -5.82 1.93 -0.05 9.51 -3.43 -1.26 -5.00 115.29 111.17 2dlk s HIS 35 Ca -0.11 -0.92 -0.30 0.00 -0.80 0.00 0.00 55.06 52.93 2dlk s HIS 35 Cb 0.30 -1.65 -0.03 0.00 -1.43 0.00 0.00 32.58 29.77 2dlk s HIS 35 CO 0.75 0.22 1.10 -0.65 -2.00 0.00 0.00 174.74 174.16 2dlk s GLN 36 N -3.88 4.42 0.38 -0.38 -1.52 -1.26 -5.04 119.66 112.38 2dlk s GLN 36 Ca 0.10 1.55 0.08 0.00 -1.95 0.00 0.00 55.36 55.14 2dlk s GLN 36 Cb 0.02 -3.51 -0.02 0.00 -0.22 0.00 0.00 33.01 29.29 2dlk s GLN 36 CO 0.05 -0.31 0.40 -1.59 -0.25 0.00 0.00 175.29 173.59 2dlk s LYS 37 N 1.79 2.71 0.32 2.91 0.00 -1.26 -5.14 119.74 121.07 2dlk s LYS 37 Ca 0.53 -1.35 0.10 0.00 0.00 0.00 0.00 55.97 55.24 2dlk s LYS 37 Cb -0.23 -2.52 -0.05 0.00 0.00 0.00 0.00 37.83 35.03 2dlk s LYS 37 CO 0.23 -0.09 -0.03 -1.12 0.00 0.00 0.00 175.35 174.33 2dlk s SER 38 N -4.13 4.09 0.61 0.03 0.01 -1.26 -5.10 113.70 107.95 2dlk s SER 38 Ca 0.47 -0.98 -0.15 0.00 1.31 0.00 0.00 55.95 56.60 2dlk s SER 38 Cb -0.06 -0.52 -0.03 0.00 0.21 0.00 0.00 66.02 65.63 2dlk s SER 38 CO 0.29 -0.16 1.05 -0.36 0.41 0.00 0.00 173.24 174.47 2dlk s PHE 39 N -2.50 3.04 0.07 2.43 0.08 -1.24 -4.97 117.98 114.88 2dlk s PHE 39 Ca 0.33 1.49 0.04 0.00 0.12 0.00 0.00 56.93 58.91 2dlk s PHE 39 Cb -0.01 -2.97 -0.03 0.00 -0.57 0.00 0.00 43.02 39.44 2dlk s PHE 39 CO 0.18 -1.11 -0.11 -1.12 -0.10 0.00 0.00 175.22 172.96 2dlk s SER 40 N -3.04 1.38 -0.04 1.36 0.01 -1.26 -3.39 113.70 108.71 2dlk s SER 40 Ca 0.62 -0.63 -0.30 0.00 1.31 0.00 0.00 55.95 56.95 2dlk s SER 40 Cb -0.15 -0.01 -0.03 0.00 0.21 0.00 0.00 66.02 66.03 2dlk s SER 40 CO 0.41 -0.15 1.15 0.00 0.41 0.00 0.00 173.24 175.06 2dlk n PRO 42 N 4.91 0.24 -2.61 0.00 -0.04 -1.26 -4.40 135.00 131.83 2dlk n PRO 42 Ca 0.10 0.13 -0.42 0.00 -0.04 0.00 0.00 63.50 63.27 2dlk n PRO 42 Cb 0.47 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 32.40 2dlk n PRO 42 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 2dlk s GLU 43 N -2.51 4.53 -0.02 0.54 0.41 -1.26 -4.95 118.70 115.43 2dlk s GLU 43 Ca 0.15 1.54 -0.25 0.00 -0.41 0.00 0.00 54.97 56.00 2dlk s GLU 43 Cb 0.10 -3.42 -0.19 0.00 -1.78 0.00 0.00 34.13 28.84 2dlk s GLU 43 CO 0.22 -0.10 1.21 -1.00 -0.49 0.00 0.00 175.26 175.10 2dlk h PRO 44 N 6.71 -0.08 -0.23 0.39 0.13 -1.98 0.99 132.00 137.94 2dlk h PRO 44 Ca -0.41 0.01 -0.01 0.00 -0.87 0.00 0.00 66.00 64.72 2dlk h PRO 44 Cb 1.22 0.02 -0.01 0.00 0.13 0.00 0.00 31.00 32.35 2dlk h PRO 44 CO 0.77 0.38 0.11 0.00 -0.23 0.00 0.00 178.00 179.03 2dlk h ALA 45 N 0.32 0.29 0.08 -0.56 0.00 -1.98 -3.30 119.26 114.11 2dlk h ALA 45 Ca -0.01 -0.08 -0.00 0.00 0.00 0.00 0.00 54.91 54.82 2dlk h ALA 45 Cb 0.49 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.19 2dlk h ALA 45 CO 0.01 -0.16 -0.04 0.00 0.00 0.00 0.00 179.25 179.06 2dlk n GLY 47 N 1.29 -0.29 3.95 0.00 0.00 0.34 -4.90 105.19 105.57 2dlk n GLY 47 Ca -0.05 0.18 -0.23 0.00 0.00 0.00 0.00 46.02 45.92 2dlk n GLY 47 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2dlk s LYS 48 N -6.62 2.64 0.18 1.61 2.20 -1.26 -4.86 119.74 113.63 2dlk s LYS 48 Ca 0.14 -0.51 0.07 0.00 -0.36 0.00 0.00 55.97 55.31 2dlk s LYS 48 Cb -0.08 -2.41 -0.04 0.00 -1.51 0.00 0.00 37.83 33.78 2dlk s LYS 48 CO 0.77 -0.71 -0.14 -1.54 -0.36 0.00 0.00 175.35 173.37 2dlk s SER 49 N -4.38 2.35 -0.24 1.43 1.04 -1.26 -1.58 113.70 111.06 2dlk s SER 49 Ca 0.55 -0.98 -0.08 0.00 0.48 0.00 0.00 55.95 55.92 2dlk s SER 49 Cb -0.10 -0.10 0.11 0.00 0.10 0.00 0.00 66.02 66.02 2dlk s SER 49 CO 0.40 -0.19 0.52 -0.36 0.98 0.00 0.00 173.24 174.60 2dlk s PHE 50 N -2.85 -1.04 0.16 5.02 0.40 -1.22 -5.02 117.98 113.43 2dlk s PHE 50 Ca 0.19 1.88 -0.13 0.00 -0.60 0.00 0.00 56.93 58.27 2dlk s PHE 50 Cb -0.01 0.53 0.06 0.00 0.51 0.00 0.00 43.02 44.10 2dlk s PHE 50 CO 0.05 -0.56 1.73 -0.91 0.70 0.00 0.00 175.22 176.23 2dlk h ASN 51 N 8.09 0.74 -4.08 1.36 -0.26 -1.96 -3.30 115.58 116.17 2dlk h ASN 51 Ca -0.17 -0.15 -0.48 0.00 -0.56 0.00 0.00 56.30 54.94 2dlk h ASN 51 Cb 1.11 -0.19 0.01 0.00 -1.06 0.00 0.00 38.32 38.19 2dlk h ASN 51 CO 0.11 0.69 0.31 -0.36 -1.06 0.00 0.00 177.43 177.13 2dlk s PHE 52 N -5.61 3.46 -0.04 1.19 0.08 -1.26 -4.72 117.98 111.08 2dlk s PHE 52 Ca -0.13 1.36 -0.00 0.00 0.12 0.00 0.00 56.93 58.28 2dlk s PHE 52 Cb 0.12 -2.71 -0.26 0.00 -0.57 0.00 0.00 43.02 39.60 2dlk s PHE 52 CO 0.78 -0.31 0.68 0.87 -0.10 0.00 0.00 175.22 177.14 2dlk h LYS 53 N 0.98 0.19 -0.22 0.44 1.79 -2.00 -3.28 116.57 114.46 2dlk h LYS 53 Ca -0.47 -0.33 -0.12 0.00 -2.18 0.00 0.00 60.65 57.56 2dlk h LYS 53 Cb 1.19 0.12 -0.01 0.00 -1.58 0.00 0.00 32.23 31.94 2dlk h LYS 53 CO 0.62 0.99 -0.36 1.57 -1.08 0.00 0.00 179.45 181.19 2dlk h LYS 54 N 0.05 0.48 0.00 3.15 5.09 -1.98 -2.09 116.57 121.28 2dlk h LYS 54 Ca -0.30 -0.22 -0.04 0.00 0.09 0.00 0.00 60.65 60.18 2dlk h LYS 54 Cb 2.02 -0.01 -0.01 0.00 0.10 0.00 0.00 32.23 34.33 2dlk h LYS 54 CO 0.12 0.77 -0.19 1.25 -2.09 0.00 0.00 179.45 179.32 2dlk h HIS 55 N 0.41 0.00 0.05 0.07 2.76 -1.98 -2.98 115.15 113.48 2dlk h HIS 55 Ca 0.04 0.00 -0.10 0.00 -2.20 0.00 0.00 60.37 58.11 2dlk h HIS 55 Cb 0.81 0.00 0.00 0.00 1.55 0.00 0.00 27.41 29.77 2dlk h HIS 55 CO 0.03 0.19 -0.49 1.25 -1.30 0.00 0.00 177.93 177.61 2dlk h LEU 56 N 0.00 0.16 -0.56 0.26 7.12 -1.53 -3.22 115.31 117.53 2dlk h LEU 56 Ca -0.00 -0.92 0.10 0.00 0.13 0.00 0.00 57.88 57.19 2dlk h LEU 56 Cb 0.69 -0.05 -0.08 0.00 -0.53 0.00 0.00 40.66 40.68 2dlk h LEU 56 CO 0.02 1.22 0.11 0.50 -0.13 0.00 0.00 178.44 180.16 2dlk h LYS 57 N -0.77 0.24 0.00 1.25 3.64 -1.38 0.45 116.57 119.99 2dlk h LYS 57 Ca -0.11 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.26 2dlk h LYS 57 Cb 1.27 -0.05 0.00 0.00 -0.41 0.00 0.00 32.23 33.04 2dlk h LYS 57 CO 0.02 0.16 0.00 -0.85 -2.27 0.00 0.00 179.45 176.51 2dlk n GLU 58 N -5.13 0.16 0.10 1.90 0.28 -1.13 -1.62 120.64 115.19 2dlk n GLU 58 Ca 0.08 0.46 0.11 0.00 -0.16 0.00 0.00 57.16 57.65 2dlk n GLU 58 Cb 0.29 -1.85 -0.01 0.00 1.43 0.00 0.00 31.44 31.31 2dlk n GLU 58 CO 0.00 0.00 0.00 1.58 -0.16 0.00 0.00 177.13 178.55 2dlk n HIS 59 N -2.15 0.95 -0.00 -1.84 -0.00 0.15 -4.14 115.22 108.19 2dlk n HIS 59 Ca 0.01 0.28 -0.17 0.00 0.46 0.00 0.00 57.72 58.30 2dlk n HIS 59 Cb 0.17 -0.96 -0.14 0.00 -0.12 0.00 0.00 29.99 28.94 2dlk n HIS 59 CO 0.00 0.00 0.00 0.52 0.46 0.00 0.00 176.34 177.32 2dlk h MET 60 N 0.00 0.18 -0.47 1.57 2.86 -0.29 -3.34 114.93 115.45 2dlk h MET 60 Ca -0.01 -0.30 0.14 0.00 -2.06 0.00 0.00 59.70 57.46 2dlk h MET 60 Cb 1.04 0.11 -0.02 0.00 0.06 0.00 0.00 31.60 32.80 2dlk h MET 60 CO 0.00 0.96 0.90 1.57 1.06 0.00 0.00 176.91 181.41 2dlk h LYS 61 N 0.05 0.00 0.00 1.72 2.10 -1.53 1.78 116.57 120.69 2dlk h LYS 61 Ca -0.37 0.00 -0.28 0.00 -2.00 0.00 0.00 60.65 58.01 2dlk h LYS 61 Cb 2.03 0.00 -0.05 0.00 -0.90 0.00 0.00 32.23 33.31 2dlk h LYS 61 CO 0.09 0.00 -2.09 1.47 -2.00 0.00 0.00 179.45 176.92 2dlk n LEU 62 N -3.03 0.25 -0.02 7.07 -0.00 -1.26 -3.19 117.00 116.83 2dlk n LEU 62 Ca 0.10 0.12 -0.16 0.00 -0.00 0.00 0.00 56.01 56.07 2dlk n LEU 62 Cb 1.06 0.32 -0.11 0.00 -0.00 0.00 0.00 43.42 44.69 2dlk n LEU 62 CO 0.15 0.36 0.37 0.45 -0.00 0.00 0.00 177.39 178.72 2dlk h HIS 63 N 0.00 0.35 -0.53 1.47 3.86 0.25 -3.26 115.15 117.29 2dlk h HIS 63 Ca -0.38 -0.18 0.00 0.00 -1.16 0.00 0.00 60.37 58.65 2dlk h HIS 63 Cb 1.94 -0.04 0.00 0.00 1.06 0.00 0.00 27.41 30.37 2dlk h HIS 63 CO 0.00 0.98 0.00 -1.13 0.86 0.00 0.00 177.93 178.64 2dlk n SER 64 N -4.44 4.55 -3.72 2.45 3.41 0.49 -4.69 113.62 111.67 2dlk n SER 64 Ca -0.10 -2.56 -0.30 0.00 -0.26 0.00 0.00 58.87 55.66 2dlk n SER 64 Cb 0.54 -0.59 0.27 0.00 -0.26 0.00 0.00 64.21 64.17 2dlk n SER 64 CO 0.00 0.00 0.00 1.51 -0.16 0.00 0.00 175.04 176.39 2dlk s ASP 65 N -0.76 -0.15 0.37 4.04 -4.77 -1.19 -4.85 116.67 109.35 2dlk s ASP 65 Ca 0.45 0.88 0.06 0.00 -3.30 0.00 0.00 52.55 50.65 2dlk s ASP 65 Cb 0.31 -1.28 0.71 0.00 -1.09 0.00 0.00 42.92 41.57 2dlk s ASP 65 CO 0.18 -4.81 1.92 0.74 0.70 0.00 0.00 175.17 173.90 2dlk h THR 66 N -3.04 1.17 -0.31 2.11 2.02 -1.90 -2.09 112.91 110.87 2dlk h THR 66 Ca -0.47 -0.67 0.09 0.00 0.77 0.00 0.00 66.41 66.13 2dlk h THR 66 Cb 1.33 0.94 -0.01 0.00 -1.74 0.00 0.00 68.15 68.67 2dlk h THR 66 CO 0.34 0.23 0.41 -0.09 0.37 0.00 0.00 175.52 176.77 2dlk h ARG 67 N 0.43 0.00 -6.36 6.66 9.65 -1.91 -3.36 114.38 119.49 2dlk h ARG 67 Ca 0.10 0.00 -0.56 0.00 -1.10 0.00 0.00 59.98 58.41 2dlk h ARG 67 Cb 0.27 0.00 -0.09 0.00 -1.39 0.00 0.00 29.97 28.76 2dlk h ARG 67 CO 0.01 0.00 0.90 0.34 2.80 0.00 0.00 179.97 184.01 2dlk s ASP 68 N -5.13 6.37 0.32 -3.80 2.15 -0.79 -4.96 116.67 110.82 2dlk s ASP 68 Ca -0.04 -0.12 -0.07 0.00 0.43 0.00 0.00 52.55 52.75 2dlk s ASP 68 Cb 0.14 -2.53 0.01 0.00 -0.30 0.00 0.00 42.92 40.24 2dlk s ASP 68 CO 0.49 -1.49 0.51 -0.72 -0.17 0.00 0.00 175.17 173.78 2dlk s TYR 69 N 4.86 0.73 -0.06 -5.34 1.13 -1.26 -4.92 117.35 112.49 2dlk s TYR 69 Ca 0.38 -1.06 0.06 0.00 -1.41 0.00 0.00 57.07 55.04 2dlk s TYR 69 Cb -0.09 0.11 -0.01 0.00 -1.10 0.00 0.00 41.96 40.87 2dlk s TYR 69 CO 0.22 -1.14 -0.25 0.42 -2.51 0.00 0.00 175.55 172.29 2dlk s ILE 70 N -3.27 2.03 -0.03 -3.49 1.09 -1.26 -5.05 121.20 111.23 2dlk s ILE 70 Ca 0.26 -1.05 -0.20 0.00 -1.10 0.00 0.00 60.65 58.56 2dlk s ILE 70 Cb -0.01 -1.73 -0.13 0.00 -1.06 0.00 0.00 42.46 39.54 2dlk s ILE 70 CO 0.15 0.56 0.86 0.00 -0.10 0.00 0.00 174.94 176.42 2dlk n GLU 72 N -5.09 0.42 -0.39 0.00 4.07 -1.26 -4.89 120.64 113.50 2dlk n GLU 72 Ca -0.08 0.21 -0.09 0.00 -0.06 0.00 0.00 57.16 57.14 2dlk n GLU 72 Cb 0.26 -2.46 -0.08 0.00 -0.06 0.00 0.00 31.44 29.10 2dlk n GLU 72 CO 0.00 0.00 0.00 1.19 -0.06 0.00 0.00 177.13 178.26 2dlk n PHE 73 N -2.95 -0.37 -4.77 4.31 3.72 -1.26 -4.45 117.46 111.70 2dlk n PHE 73 Ca 0.14 1.17 -0.27 0.00 -0.05 0.00 0.00 57.45 58.44 2dlk n PHE 73 Cb 0.50 -0.60 -0.14 0.00 -0.94 0.00 0.00 39.48 38.29 2dlk n PHE 73 CO 0.00 0.00 0.00 -1.12 -0.05 0.00 0.00 176.76 175.59 2dlk s SER 74 N -5.46 2.65 0.00 4.37 0.01 -1.26 -5.05 113.70 108.96 2dlk s SER 74 Ca -0.11 -0.52 0.00 0.00 1.31 0.00 0.00 55.95 56.63 2dlk s SER 74 Cb 0.11 -0.24 0.00 0.00 0.21 0.00 0.00 66.02 66.11 2dlk s SER 74 CO 0.59 0.20 0.00 0.61 0.41 0.00 0.00 173.24 175.05 2dlk n GLY 75 N 1.93 -3.18 3.57 3.44 0.00 -1.26 -4.73 105.19 104.95 2dlk n GLY 75 Ca -0.17 -1.18 -0.27 0.00 0.00 0.00 0.00 46.02 44.41 2dlk n GLY 75 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2dlk s PRO 76 N 0.00 2.53 0.33 1.61 0.04 -1.26 -4.94 135.00 133.30 2dlk s PRO 76 Ca 0.00 -0.59 -0.29 0.00 0.04 0.00 0.00 61.00 60.16 2dlk s PRO 76 Cb 0.00 -5.12 -0.12 0.00 0.04 0.00 0.00 34.50 29.30 2dlk s PRO 76 CO 0.00 -3.59 1.53 0.43 0.04 0.00 0.00 177.00 175.41 2dlk n SER 77 N 14.13 3.73 -4.19 6.66 7.64 -1.26 -5.01 113.62 135.32 2dlk n SER 77 Ca 0.42 1.18 -0.20 0.00 1.01 0.00 0.00 58.87 61.28 2dlk n SER 77 Cb 0.47 -1.59 -0.12 0.00 -1.01 0.00 0.00 64.21 61.95 2dlk n SER 77 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 2dlk s SER 78 N 0.20 1.82 0.00 6.43 1.04 -1.26 -5.27 113.70 116.66 2dlk s SER 78 Ca 0.59 -0.61 0.00 0.00 0.48 0.00 0.00 55.95 56.42 2dlk s SER 78 Cb -0.50 -0.07 0.00 0.00 0.10 0.00 0.00 66.02 65.55 2dlk s SER 78 CO 0.55 -0.04 0.03 0.61 0.98 0.00 0.00 173.24 175.38