#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dlk n SER 2 N 0.00 2.26 -0.06 1.61 2.88 -1.26 -4.69 113.62 114.36 2dlk n SER 2 Ca 0.00 -0.07 -0.17 0.00 -1.33 0.00 0.00 58.87 57.30 2dlk n SER 2 Cb 0.00 0.02 -0.13 0.00 -0.75 0.00 0.00 64.21 63.35 2dlk n SER 2 CO 0.00 0.00 0.00 -1.28 -1.23 0.00 0.00 175.04 172.53 2dlk h SER 3 N 0.00 0.07 0.00 -3.46 0.87 -2.10 -3.49 113.55 105.44 2dlk h SER 3 Ca -0.41 -0.87 0.00 0.00 -1.23 0.00 0.00 61.79 59.29 2dlk h SER 3 Cb 1.71 -0.02 0.00 0.00 -0.44 0.00 0.00 62.40 63.64 2dlk h SER 3 CO -0.04 1.20 0.00 0.61 -0.53 0.00 0.00 176.83 178.07 2dlk n GLY 4 N 1.58 0.64 2.61 5.77 0.00 -1.26 -5.14 105.19 109.39 2dlk n GLY 4 Ca -0.17 -0.56 -0.26 0.00 0.00 0.00 0.00 46.02 45.04 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 2.64 -0.50 1.61 0.15 -1.26 -5.11 113.70 111.23 2dlk s SER 5 Ca 0.00 -0.84 -0.22 0.00 0.70 0.00 0.00 55.95 55.59 2dlk s SER 5 Cb 0.00 -0.15 0.04 0.00 -1.71 0.00 0.00 66.02 64.20 2dlk s SER 5 CO 0.00 -0.39 0.77 -0.44 1.20 0.00 0.00 173.24 174.39 2dlk s SER 6 N 2.16 6.31 -0.29 5.45 0.01 -1.26 -4.98 113.70 121.11 2dlk s SER 6 Ca 0.06 -0.48 -0.33 0.00 1.31 0.00 0.00 55.95 56.51 2dlk s SER 6 Cb -0.16 -2.36 0.18 0.00 0.21 0.00 0.00 66.02 63.89 2dlk s SER 6 CO -0.22 -1.00 1.38 -0.83 0.41 0.00 0.00 173.24 172.98 2dlk s GLY 7 N 2.54 -0.02 -0.22 3.44 0.00 -1.26 -4.64 107.32 107.15 2dlk s GLY 7 Ca 0.24 2.46 -0.06 0.00 0.00 0.00 0.00 44.72 47.36 2dlk s GLY 7 CO 0.18 0.91 0.03 1.06 0.00 0.00 0.00 173.10 175.27 2dlk s MET 8 N -1.46 3.64 0.67 2.90 1.00 0.02 -4.83 119.30 121.24 2dlk s MET 8 Ca 0.10 -0.50 -0.15 0.00 0.00 0.00 0.00 55.69 55.15 2dlk s MET 8 Cb -0.01 -3.19 0.00 0.00 0.00 0.00 0.00 34.83 31.64 2dlk s MET 8 CO -0.06 -0.07 1.11 -1.25 0.00 0.00 0.00 175.02 174.75 2dlk s PRO 9 N 1.25 2.75 0.82 2.03 0.04 -1.26 -2.25 135.00 138.39 2dlk s PRO 9 Ca 0.04 1.37 -0.11 0.00 0.04 0.00 0.00 61.00 62.34 2dlk s PRO 9 Cb -0.15 -1.95 0.08 0.00 0.04 0.00 0.00 34.50 32.53 2dlk s PRO 9 CO 0.02 -1.28 1.09 0.00 0.04 0.00 0.00 177.00 176.87 2dlk h ASP 11 N -1.23 -0.14 -3.04 0.00 3.58 -1.96 -3.45 116.42 110.18 2dlk h ASP 11 Ca -0.47 -0.33 -0.58 0.00 0.42 0.00 0.00 57.03 56.07 2dlk h ASP 11 Cb 1.26 0.04 0.10 0.00 1.72 0.00 0.00 39.33 42.46 2dlk h ASP 11 CO 0.56 0.27 0.48 0.49 -2.88 0.00 0.00 179.24 178.16 2dlk n PHE 12 N -4.98 2.11 0.01 0.28 3.72 -1.26 -4.93 117.46 112.42 2dlk n PHE 12 Ca -0.09 0.55 -0.13 0.00 -0.05 0.00 0.00 57.45 57.73 2dlk n PHE 12 Cb 0.24 -2.40 -0.09 0.00 -0.94 0.00 0.00 39.48 36.28 2dlk n PHE 12 CO 0.00 0.00 0.00 -1.00 -0.05 0.00 0.00 176.76 175.71 2dlk h PRO 13 N 2.86 -0.07 -0.57 -1.08 0.13 -2.03 -3.27 132.00 127.96 2dlk h PRO 13 Ca -0.45 0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 64.62 2dlk h PRO 13 Cb 1.29 0.02 -0.02 0.00 0.13 0.00 0.00 31.00 32.41 2dlk h PRO 13 CO 0.65 0.39 0.12 0.78 -0.23 0.00 0.00 178.00 179.71 2dlk h GLY 14 N -0.56 1.00 -0.63 1.56 0.00 -1.98 -3.14 103.07 99.31 2dlk h GLY 14 Ca -0.01 -0.64 0.12 0.00 0.00 0.00 0.00 47.33 46.80 2dlk h GLY 14 CO 0.01 0.60 -0.35 0.00 0.00 0.00 0.00 176.54 176.81 2dlk n GLY 16 N -1.45 -0.70 3.32 0.00 0.00 -1.19 -4.97 105.19 100.20 2dlk n GLY 16 Ca 0.07 0.33 -0.31 0.00 0.00 0.00 0.00 46.02 46.10 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 -6.45 2.37 -0.01 1.61 0.52 -1.26 -4.95 118.95 110.79 2dlk s ARG 17 Ca 0.32 -0.88 0.08 0.00 -0.52 0.00 0.00 55.73 54.73 2dlk s ARG 17 Cb -0.13 -2.15 -0.02 0.00 0.52 0.00 0.00 34.95 33.17 2dlk s ARG 17 CO 0.89 0.49 -0.25 0.42 0.02 0.00 0.00 175.30 176.87 2dlk s ILE 18 N -0.43 1.99 0.22 1.52 1.01 -1.26 0.96 121.20 125.21 2dlk s ILE 18 Ca 0.04 -1.12 0.03 0.00 0.00 0.00 0.00 60.65 59.61 2dlk s ILE 18 Cb -0.12 -1.66 -0.05 0.00 0.01 0.00 0.00 42.46 40.64 2dlk s ILE 18 CO 0.01 0.52 -0.01 -0.36 0.00 0.00 0.00 174.94 175.10 2dlk s PHE 19 N -0.62 1.50 -0.15 3.97 0.40 -0.95 -4.89 117.98 117.23 2dlk s PHE 19 Ca 0.10 -0.92 -0.12 0.00 -0.60 0.00 0.00 56.93 55.39 2dlk s PHE 19 Cb -0.10 -0.86 -0.08 0.00 0.51 0.00 0.00 43.02 42.49 2dlk s PHE 19 CO -0.00 -0.04 -0.01 1.03 0.70 0.00 0.00 175.22 176.89 2dlk h SER 20 N 2.52 0.00 -2.59 1.36 0.87 -1.89 0.09 113.55 113.90 2dlk h SER 20 Ca -0.38 -0.18 -0.45 0.00 -1.23 0.00 0.00 61.79 59.55 2dlk h SER 20 Cb 1.22 0.00 0.03 0.00 -0.44 0.00 0.00 62.40 63.21 2dlk h SER 20 CO 0.64 0.92 -0.11 0.21 -0.53 0.00 0.00 176.83 177.97 2dlk s ASN 21 N -6.02 5.73 -0.12 6.23 2.47 -1.26 -4.73 114.94 117.25 2dlk s ASN 21 Ca -0.17 0.17 -0.19 0.00 0.42 0.00 0.00 52.86 53.10 2dlk s ASN 21 Cb 0.02 -1.36 -0.16 0.00 -1.45 0.00 0.00 41.25 38.30 2dlk s ASN 21 CO 0.31 -0.76 0.53 0.03 -3.72 0.00 0.00 177.10 173.48 2dlk h ARG 22 N 0.38 -0.02 -0.88 0.43 -0.00 -1.99 -3.19 114.38 109.10 2dlk h ARG 22 Ca -0.45 0.00 0.32 0.00 -0.50 0.00 0.00 59.98 59.35 2dlk h ARG 22 Cb 1.26 0.00 -0.16 0.00 0.00 0.00 0.00 29.97 31.07 2dlk h ARG 22 CO 0.56 0.59 0.28 1.04 0.00 0.00 0.00 179.97 182.43 2dlk n GLN 23 N -4.70 -0.06 -0.02 0.04 1.13 -1.26 0.96 117.38 113.47 2dlk n GLN 23 Ca -0.06 1.27 -0.13 0.00 -1.94 0.00 0.00 57.00 56.13 2dlk n GLN 23 Cb 0.30 -2.16 -0.08 0.00 0.11 0.00 0.00 30.24 28.41 2dlk n GLN 23 CO 0.00 0.00 0.00 1.88 -1.44 0.00 0.00 177.06 177.50 2dlk h TYR 24 N 0.00 0.13 -0.20 1.08 -1.99 -1.99 -1.02 116.97 112.97 2dlk h TYR 24 Ca 0.66 -0.03 0.02 0.00 2.00 0.00 0.00 58.73 61.38 2dlk h TYR 24 Cb 1.61 -0.03 -0.02 0.00 2.00 0.00 0.00 36.73 40.29 2dlk h TYR 24 CO -0.20 0.50 0.07 1.25 -0.00 0.00 0.00 178.16 179.78 2dlk h LEU 25 N -0.27 0.07 0.07 3.88 5.85 0.61 -1.59 115.31 123.93 2dlk h LEU 25 Ca 0.01 0.02 -0.00 0.00 0.84 0.00 0.00 57.88 58.75 2dlk h LEU 25 Cb 0.46 0.02 0.00 0.00 0.37 0.00 0.00 40.66 41.51 2dlk h LEU 25 CO 0.01 0.07 -0.03 -1.13 -0.34 0.00 0.00 178.44 177.01 2dlk h ASN 26 N 0.16 -0.08 -0.93 1.25 -0.73 -0.60 -0.50 115.58 114.15 2dlk h ASN 26 Ca 0.09 -0.05 0.19 0.00 1.87 0.00 0.00 56.30 58.40 2dlk h ASN 26 Cb 0.06 0.02 -0.08 0.00 0.27 0.00 0.00 38.32 38.60 2dlk h ASN 26 CO -0.09 -0.00 0.60 -0.74 -0.37 0.00 0.00 177.43 176.82 2dlk h HIS 27 N -0.16 0.72 -0.07 0.67 2.76 -0.99 0.11 115.15 118.19 2dlk h HIS 27 Ca -0.01 0.02 -0.25 0.00 -2.20 0.00 0.00 60.37 57.93 2dlk h HIS 27 Cb 0.13 -0.22 0.02 0.00 1.55 0.00 0.00 27.41 28.89 2dlk h HIS 27 CO -0.05 0.20 -0.92 1.25 -1.30 0.00 0.00 177.93 177.10 2dlk h HIS 28 N 0.54 1.05 0.00 5.26 -0.00 -0.85 0.24 115.15 121.40 2dlk h HIS 28 Ca 0.49 -0.52 0.00 0.00 -0.00 0.00 0.00 60.37 60.34 2dlk h HIS 28 Cb 1.03 -0.14 0.00 0.00 -0.00 0.00 0.00 27.41 28.30 2dlk h HIS 28 CO -0.00 1.36 0.00 1.63 -0.00 0.00 0.00 177.93 180.92 2dlk n LYS 29 N -3.89 0.19 -0.08 5.26 5.02 -0.13 -0.40 118.16 124.12 2dlk n LYS 29 Ca -0.09 0.47 -0.10 0.00 -2.02 0.00 0.00 58.31 56.57 2dlk n LYS 29 Cb 0.82 -1.91 -0.10 0.00 -0.02 0.00 0.00 35.03 33.82 2dlk n LYS 29 CO 0.00 0.00 0.00 1.17 -0.52 0.00 0.00 177.40 178.05 2dlk n LYS 30 N -2.28 1.05 -0.05 1.97 4.81 -0.28 -3.94 118.16 119.43 2dlk n LYS 30 Ca 0.01 0.05 -0.01 0.00 -0.87 0.00 0.00 58.31 57.49 2dlk n LYS 30 Cb 0.19 -1.38 -0.00 0.00 0.02 0.00 0.00 35.03 33.86 2dlk n LYS 30 CO 0.00 0.00 0.00 1.88 1.17 0.00 0.00 177.40 180.45 2dlk h TYR 31 N 0.00 0.00 0.14 5.64 -1.99 -0.35 -3.41 116.97 117.00 2dlk h TYR 31 Ca -0.41 0.00 -0.01 0.00 2.00 0.00 0.00 58.73 60.31 2dlk h TYR 31 Cb 1.79 0.00 0.00 0.00 2.00 0.00 0.00 36.73 40.52 2dlk h TYR 31 CO 0.01 0.00 -0.07 1.96 -0.00 0.00 0.00 178.16 180.06 2dlk h GLN 32 N -0.90 -0.19 -5.55 4.88 1.08 -0.92 -3.42 115.11 110.09 2dlk h GLN 32 Ca 0.00 0.01 -0.60 0.00 -1.45 0.00 0.00 58.65 56.62 2dlk h GLN 32 Cb 0.12 0.04 -0.10 0.00 -0.05 0.00 0.00 27.48 27.49 2dlk h GLN 32 CO 0.00 0.17 -0.04 -1.01 -0.95 0.00 0.00 178.83 177.00 2dlk s HIS 33 N -4.61 3.38 -0.06 2.96 3.76 -0.90 -5.04 115.29 114.78 2dlk s HIS 33 Ca -0.15 0.78 -0.29 0.00 -0.15 0.00 0.00 55.06 55.25 2dlk s HIS 33 Cb 0.02 -2.67 0.10 0.00 1.11 0.00 0.00 32.58 31.15 2dlk s HIS 33 CO 0.60 -0.09 0.86 -1.50 -0.85 0.00 0.00 174.74 173.77 2dlk s ILE 34 N 1.58 0.00 0.52 0.60 2.07 -1.26 -3.68 121.20 121.03 2dlk s ILE 34 Ca 0.24 0.00 -0.22 0.00 -1.41 0.00 0.00 60.65 59.26 2dlk s ILE 34 Cb -0.15 -1.00 -0.06 0.00 0.13 0.00 0.00 42.46 41.37 2dlk s ILE 34 CO 0.10 0.00 1.32 0.00 -1.91 0.00 0.00 174.94 174.44 2dlk n HIS 35 N 0.37 2.19 -0.48 3.50 1.44 -1.26 -4.96 115.22 116.02 2dlk n HIS 35 Ca -0.12 0.44 -0.27 0.00 -2.01 0.00 0.00 57.72 55.76 2dlk n HIS 35 Cb 0.59 -2.36 0.22 0.00 0.12 0.00 0.00 29.99 28.57 2dlk n HIS 35 CO 0.00 0.00 0.00 1.04 -2.81 0.00 0.00 176.34 174.57 2dlk n GLN 36 N -0.74 -2.85 -4.42 -1.40 6.02 -1.26 -5.05 117.38 107.68 2dlk n GLN 36 Ca 0.09 -0.83 -0.22 0.00 -0.01 0.00 0.00 57.00 56.03 2dlk n GLN 36 Cb 0.44 -1.80 -0.09 0.00 1.02 0.00 0.00 30.24 29.81 2dlk n GLN 36 CO 0.00 0.00 0.00 -1.59 -1.01 0.00 0.00 177.06 174.46 2dlk s LYS 37 N -4.07 1.78 -1.47 -1.09 0.00 -1.26 -4.86 119.74 108.77 2dlk s LYS 37 Ca 0.57 -2.05 -0.09 0.00 0.00 0.00 0.00 55.97 54.39 2dlk s LYS 37 Cb -0.14 -0.30 0.06 0.00 0.00 0.00 0.00 37.83 37.46 2dlk s LYS 37 CO 0.56 -0.49 0.86 -1.13 0.00 0.00 0.00 175.35 175.15 2dlk n SER 38 N -1.20 -3.45 -3.56 0.03 3.41 -1.26 -4.93 113.62 102.66 2dlk n SER 38 Ca -0.01 -0.82 -0.21 0.00 -0.26 0.00 0.00 58.87 57.57 2dlk n SER 38 Cb 0.65 -3.82 0.18 0.00 -0.26 0.00 0.00 64.21 60.96 2dlk n SER 38 CO 0.00 0.00 0.00 0.49 -0.16 0.00 0.00 175.04 175.37 2dlk n PHE 39 N -4.54 -2.62 -4.36 7.33 3.72 -1.26 -4.67 117.46 111.05 2dlk n PHE 39 Ca -0.07 -0.19 -0.24 0.00 -0.05 0.00 0.00 57.45 56.90 2dlk n PHE 39 Cb 0.58 -1.39 -0.12 0.00 -0.94 0.00 0.00 39.48 37.61 2dlk n PHE 39 CO 0.00 0.00 0.00 -1.54 -0.05 0.00 0.00 176.76 175.17 2dlk s SER 40 N -2.23 2.93 -0.00 4.37 1.04 -1.26 -4.18 113.70 114.37 2dlk s SER 40 Ca 0.44 -0.83 -0.30 0.00 0.48 0.00 0.00 55.95 55.74 2dlk s SER 40 Cb -0.08 -0.19 -0.04 0.00 0.10 0.00 0.00 66.02 65.81 2dlk s SER 40 CO 0.40 0.04 1.16 0.00 0.98 0.00 0.00 173.24 175.82 2dlk n PRO 42 N 4.51 0.49 -3.25 0.00 -0.04 -1.26 -4.69 135.00 130.76 2dlk n PRO 42 Ca 0.09 0.00 -0.39 0.00 -0.04 0.00 0.00 63.50 63.16 2dlk n PRO 42 Cb 0.47 -1.26 -0.07 0.00 -0.04 0.00 0.00 33.50 32.60 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 4.17 -0.02 0.54 2.56 -1.26 -4.98 118.70 117.71 2dlk s GLU 43 Ca 0.12 0.40 -0.25 0.00 0.00 0.00 0.00 54.97 55.24 2dlk s GLU 43 Cb 0.06 -3.57 -0.19 0.00 2.00 0.00 0.00 34.13 32.42 2dlk s GLU 43 CO 0.09 -0.17 1.20 -1.00 -0.56 0.00 0.00 175.26 174.82 2dlk h PRO 44 N 7.53 -0.10 -0.16 4.30 0.13 -2.00 0.03 132.00 141.73 2dlk h PRO 44 Ca -0.33 0.01 0.03 0.00 -0.87 0.00 0.00 66.00 64.84 2dlk h PRO 44 Cb 1.15 0.02 -0.03 0.00 0.13 0.00 0.00 31.00 32.27 2dlk h PRO 44 CO 0.74 0.34 -0.04 0.00 -0.23 0.00 0.00 178.00 178.80 2dlk h ALA 45 N 0.25 0.10 0.09 -0.56 0.00 -1.98 -3.00 119.26 114.17 2dlk h ALA 45 Ca -0.01 0.06 -0.00 0.00 0.00 0.00 0.00 54.91 54.96 2dlk h ALA 45 Cb 0.49 0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.42 2dlk h ALA 45 CO 0.02 -0.49 -0.04 0.00 0.00 0.00 0.00 179.25 178.74 2dlk n GLY 47 N -0.39 -0.99 2.98 0.00 0.00 -0.00 -4.95 105.19 101.84 2dlk n GLY 47 Ca -0.08 0.44 -0.26 0.00 0.00 0.00 0.00 46.02 46.12 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 -5.50 1.65 0.12 1.61 1.02 -1.26 -5.07 119.74 112.31 2dlk s LYS 48 Ca 0.15 -0.35 0.05 0.00 0.02 0.00 0.00 55.97 55.83 2dlk s LYS 48 Cb -0.09 -1.50 -0.04 0.00 -0.52 0.00 0.00 37.83 35.69 2dlk s LYS 48 CO 0.80 -0.10 0.08 0.45 -0.92 0.00 0.00 175.35 175.66 2dlk s SER 49 N 1.10 5.35 0.02 2.83 0.15 -1.26 -3.65 113.70 118.25 2dlk s SER 49 Ca -0.06 -0.13 -0.03 0.00 0.70 0.00 0.00 55.95 56.44 2dlk s SER 49 Cb -0.14 -1.37 -0.02 0.00 -1.71 0.00 0.00 66.02 62.78 2dlk s SER 49 CO -0.02 0.12 0.03 -0.36 1.20 0.00 0.00 173.24 174.21 2dlk s PHE 50 N -1.55 0.23 -0.12 3.44 0.08 -1.26 -5.06 117.98 113.74 2dlk s PHE 50 Ca 0.29 -0.50 -0.10 0.00 0.12 0.00 0.00 56.93 56.74 2dlk s PHE 50 Cb -0.11 -0.17 -0.26 0.00 -0.57 0.00 0.00 43.02 41.90 2dlk s PHE 50 CO 0.21 -0.26 0.42 -0.91 -0.10 0.00 0.00 175.22 174.59 2dlk h ASN 51 N 4.26 0.40 -3.50 1.36 4.21 -1.91 -3.40 115.58 117.01 2dlk h ASN 51 Ca -0.32 -0.89 -0.61 0.00 1.21 0.00 0.00 56.30 55.68 2dlk h ASN 51 Cb 1.20 -0.13 -0.12 0.00 -1.12 0.00 0.00 38.32 38.15 2dlk h ASN 51 CO 0.45 1.78 0.25 -0.36 -1.29 0.00 0.00 177.43 178.26 2dlk s PHE 52 N -2.53 3.20 0.28 1.19 0.08 -1.26 -4.08 117.98 114.85 2dlk s PHE 52 Ca -0.22 0.65 0.01 0.00 0.12 0.00 0.00 56.93 57.50 2dlk s PHE 52 Cb 0.06 -3.11 0.61 0.00 -0.57 0.00 0.00 43.02 40.01 2dlk s PHE 52 CO 0.76 -0.53 1.77 -0.22 -0.10 0.00 0.00 175.22 176.90 2dlk h LYS 53 N 8.20 0.66 -0.70 0.44 3.11 -1.99 0.19 116.57 126.47 2dlk h LYS 53 Ca -0.26 -0.04 0.20 0.00 -2.81 0.00 0.00 60.65 57.75 2dlk h LYS 53 Cb 1.11 -0.15 -0.03 0.00 -1.00 0.00 0.00 32.23 32.16 2dlk h LYS 53 CO 0.84 0.44 0.73 1.57 -2.81 0.00 0.00 179.45 180.22 2dlk h LYS 54 N 0.68 0.00 0.00 1.90 2.10 -2.00 -0.07 116.57 119.17 2dlk h LYS 54 Ca 0.51 0.00 -0.08 0.00 -2.00 0.00 0.00 60.65 59.07 2dlk h LYS 54 Cb 0.74 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 32.06 2dlk h LYS 54 CO -0.37 0.00 -0.49 0.45 -2.00 0.00 0.00 179.45 177.04 2dlk h HIS 55 N 0.00 0.00 -0.81 0.07 3.86 -1.04 -3.19 115.15 114.04 2dlk h HIS 55 Ca 0.33 0.00 0.18 0.00 -1.16 0.00 0.00 60.37 59.72 2dlk h HIS 55 Cb 1.80 0.00 -0.11 0.00 1.06 0.00 0.00 27.41 30.15 2dlk h HIS 55 CO 0.00 1.05 0.30 1.25 0.86 0.00 0.00 177.93 181.38 2dlk h LEU 56 N -1.00 0.20 0.50 2.43 6.46 -0.92 0.22 115.31 123.21 2dlk h LEU 56 Ca -0.13 0.14 -0.02 0.00 -0.12 0.00 0.00 57.88 57.75 2dlk h LEU 56 Cb 1.01 0.15 0.00 0.00 -0.73 0.00 0.00 40.66 41.09 2dlk h LEU 56 CO -0.08 0.01 -0.24 0.50 -0.62 0.00 0.00 178.44 178.01 2dlk h LYS 57 N 0.37 -0.65 -0.57 1.25 3.64 -1.45 -1.07 116.57 118.09 2dlk h LYS 57 Ca 0.48 0.04 0.16 0.00 -1.27 0.00 0.00 60.65 60.06 2dlk h LYS 57 Cb 0.83 0.15 -0.02 0.00 -0.41 0.00 0.00 32.23 32.78 2dlk h LYS 57 CO -0.50 -0.43 0.55 1.05 -2.27 0.00 0.00 179.45 177.85 2dlk h GLU 58 N -0.73 0.00 0.32 1.90 -0.00 -1.45 -1.60 114.58 113.02 2dlk h GLU 58 Ca -0.07 0.00 -0.02 0.00 -0.00 0.00 0.00 59.36 59.28 2dlk h GLU 58 Cb 0.52 0.00 0.00 0.00 -0.00 0.00 0.00 28.75 29.27 2dlk h GLU 58 CO 0.11 0.00 -0.15 1.25 -0.00 0.00 0.00 179.01 180.22 2dlk h HIS 59 N 0.00 -0.40 -0.94 2.06 2.76 -0.28 -3.27 115.15 115.08 2dlk h HIS 59 Ca 0.27 -0.01 0.28 0.00 -2.20 0.00 0.00 60.37 58.71 2dlk h HIS 59 Cb 1.36 0.13 -0.16 0.00 1.55 0.00 0.00 27.41 30.30 2dlk h HIS 59 CO 0.00 -0.10 0.28 0.52 -1.30 0.00 0.00 177.93 177.32 2dlk h MET 60 N -1.01 0.15 -0.95 5.26 2.86 -0.19 0.46 114.93 121.50 2dlk h MET 60 Ca -0.04 -0.01 0.28 0.00 -2.06 0.00 0.00 59.70 57.87 2dlk h MET 60 Cb 0.47 -0.03 -0.14 0.00 0.06 0.00 0.00 31.60 31.96 2dlk h MET 60 CO 0.07 0.10 0.44 0.87 1.06 0.00 0.00 176.91 179.45 2dlk h LYS 61 N 0.15 0.30 -1.00 1.72 1.57 -1.56 0.55 116.57 118.30 2dlk h LYS 61 Ca 0.63 -0.02 0.10 0.00 -1.87 0.00 0.00 60.65 59.49 2dlk h LYS 61 Cb 1.37 -0.07 -0.08 0.00 0.08 0.00 0.00 32.23 33.53 2dlk h LYS 61 CO -0.72 0.20 0.64 1.37 -0.57 0.00 0.00 179.45 180.36 2dlk h LEU 62 N 0.31 0.96 -0.51 2.94 8.10 -0.18 -1.66 115.31 125.27 2dlk h LEU 62 Ca 0.65 0.04 -0.01 0.00 0.11 0.00 0.00 57.88 58.67 2dlk h LEU 62 Cb 1.40 -0.16 -0.02 0.00 -0.44 0.00 0.00 40.66 41.44 2dlk h LEU 62 CO -0.61 0.54 0.28 0.45 -4.11 0.00 0.00 178.44 174.99 2dlk h HIS 63 N 1.05 0.70 -4.10 0.17 3.86 0.03 -3.43 115.15 113.42 2dlk h HIS 63 Ca 0.48 -0.02 -0.51 0.00 -1.16 0.00 0.00 60.37 59.16 2dlk h HIS 63 Cb 0.40 -0.22 0.08 0.00 1.06 0.00 0.00 27.41 28.73 2dlk h HIS 63 CO -0.00 0.51 0.43 -1.54 0.86 0.00 0.00 177.93 178.19 2dlk s SER 64 N -5.81 5.56 -0.06 2.45 1.04 -0.62 -5.00 113.70 111.26 2dlk s SER 64 Ca -0.13 2.20 -0.02 0.00 0.48 0.00 0.00 55.95 58.48 2dlk s SER 64 Cb 0.12 -2.58 -0.01 0.00 0.10 0.00 0.00 66.02 63.65 2dlk s SER 64 CO 0.76 -1.33 0.10 -0.78 0.98 0.00 0.00 173.24 172.96 2dlk h ASP 65 N 1.03 -0.06 -4.07 7.02 1.82 -1.84 -3.46 116.42 116.86 2dlk h ASP 65 Ca -0.50 0.00 -0.54 0.00 -0.39 0.00 0.00 57.03 55.61 2dlk h ASP 65 Cb 1.27 0.01 0.12 0.00 0.68 0.00 0.00 39.33 41.41 2dlk h ASP 65 CO 0.56 0.27 0.53 0.42 -1.61 0.00 0.00 179.24 179.41 2dlk s THR 66 N -1.63 2.39 0.42 2.25 -4.23 -1.26 -5.04 115.64 108.54 2dlk s THR 66 Ca -0.01 0.27 0.07 0.00 -1.18 0.00 0.00 61.69 60.84 2dlk s THR 66 Cb 0.00 -3.12 -0.03 0.00 1.34 0.00 0.00 72.50 70.69 2dlk s THR 66 CO 0.03 -0.03 0.28 0.00 -0.54 0.00 0.00 174.62 174.36 2dlk s ARG 67 N -3.12 2.37 0.51 3.99 1.70 -1.26 -5.04 118.95 118.10 2dlk s ARG 67 Ca 0.75 -1.72 -0.22 0.00 -0.47 0.00 0.00 55.73 54.07 2dlk s ARG 67 Cb -0.35 -2.16 -0.06 0.00 -0.57 0.00 0.00 34.95 31.81 2dlk s ARG 67 CO 0.39 -0.18 1.31 -0.51 -1.08 0.00 0.00 175.30 175.23 2dlk s ASP 68 N -4.03 5.58 0.27 -2.89 1.11 -1.26 -4.90 116.67 110.55 2dlk s ASP 68 Ca 0.44 2.64 -0.00 0.00 0.18 0.00 0.00 52.55 55.81 2dlk s ASP 68 Cb 0.00 -2.63 0.59 0.00 1.07 0.00 0.00 42.92 41.95 2dlk s ASP 68 CO 0.25 -1.35 1.72 1.88 1.18 0.00 0.00 175.17 178.85 2dlk h TYR 69 N 1.70 0.62 -3.05 4.23 -1.99 -2.06 -3.43 116.97 112.99 2dlk h TYR 69 Ca -0.50 0.04 -0.44 0.00 2.00 0.00 0.00 58.73 59.82 2dlk h TYR 69 Cb 1.28 -0.15 -0.14 0.00 2.00 0.00 0.00 36.73 39.73 2dlk h TYR 69 CO 0.48 0.04 -0.61 0.96 -0.00 0.00 0.00 178.16 179.04 2dlk s ILE 70 N -5.95 1.05 0.24 -2.88 -5.25 -1.26 -5.17 121.20 101.97 2dlk s ILE 70 Ca -0.12 -2.00 0.08 0.00 -0.99 0.00 0.00 60.65 57.62 2dlk s ILE 70 Cb 0.23 -2.76 -0.04 0.00 2.95 0.00 0.00 42.46 42.84 2dlk s ILE 70 CO 0.77 0.00 0.06 0.00 -1.79 0.00 0.00 174.94 173.99 2dlk s GLU 72 N -3.55 4.60 0.02 0.00 2.56 -1.26 -5.05 118.70 116.02 2dlk s GLU 72 Ca 0.31 1.37 -0.00 0.00 0.00 0.00 0.00 54.97 56.65 2dlk s GLU 72 Cb -0.08 -3.42 -0.02 0.00 2.00 0.00 0.00 34.13 32.62 2dlk s GLU 72 CO 0.21 0.09 -0.03 0.12 -0.56 0.00 0.00 175.26 175.09 2dlk s PHE 73 N 0.49 0.30 0.04 5.30 5.36 -1.26 -5.17 117.98 123.04 2dlk s PHE 73 Ca 0.48 -0.59 0.00 0.00 -0.96 0.00 0.00 56.93 55.86 2dlk s PHE 73 Cb -0.22 -0.22 -0.03 0.00 -0.34 0.00 0.00 43.02 42.22 2dlk s PHE 73 CO 0.28 -0.21 -0.04 -1.12 -1.46 0.00 0.00 175.22 172.67 2dlk s SER 74 N -1.62 0.47 0.00 6.13 0.01 -1.26 -5.04 113.70 112.38 2dlk s SER 74 Ca -0.13 -0.66 0.00 0.00 1.31 0.00 0.00 55.95 56.47 2dlk s SER 74 Cb -0.08 0.11 0.00 0.00 0.21 0.00 0.00 66.02 66.26 2dlk s SER 74 CO -0.02 -0.36 0.00 0.61 0.41 0.00 0.00 173.24 173.88 2dlk n GLY 75 N 1.13 0.72 0.22 3.44 0.00 -1.26 -5.04 105.19 104.40 2dlk n GLY 75 Ca -0.21 -0.64 -0.13 0.00 0.00 0.00 0.00 46.02 45.05 2dlk n GLY 75 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dlk h PRO 76 N 0.00 0.74 -4.36 1.61 0.13 -2.08 -3.42 132.00 124.61 2dlk h PRO 76 Ca 0.00 -0.39 -0.56 0.00 -0.87 0.00 0.00 66.00 64.18 2dlk h PRO 76 Cb 0.00 0.01 -0.37 0.00 0.13 0.00 0.00 31.00 30.77 2dlk h PRO 76 CO 0.00 1.01 -0.81 -1.12 -0.23 0.00 0.00 178.00 176.85 2dlk s SER 77 N -6.58 2.56 -0.19 1.44 0.01 -1.26 -5.01 113.70 104.68 2dlk s SER 77 Ca -0.12 -0.48 -0.13 0.00 1.31 0.00 0.00 55.95 56.53 2dlk s SER 77 Cb 0.09 -0.98 -0.21 0.00 0.21 0.00 0.00 66.02 65.13 2dlk s SER 77 CO 0.84 -0.12 0.17 -0.24 0.41 0.00 0.00 173.24 174.30 2dlk n SER 78 N 4.86 1.99 0.00 2.44 2.88 -1.26 -5.27 113.62 119.26 2dlk n SER 78 Ca -0.14 0.28 0.00 0.00 -1.33 0.00 0.00 58.87 57.68 2dlk n SER 78 Cb 0.49 -0.86 0.00 0.00 -0.75 0.00 0.00 64.21 63.09 2dlk n SER 78 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42