#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 0.04 -4.45 1.61 4.64 -2.13 -3.44 113.55 109.82 2dlk h SER 2 Ca 0.00 0.06 -0.29 0.00 -0.47 0.00 0.00 61.79 61.09 2dlk h SER 2 Cb 0.00 0.07 -0.15 0.00 -0.31 0.00 0.00 62.40 62.02 2dlk h SER 2 CO 0.00 0.06 -0.67 -0.94 -0.87 0.00 0.00 176.83 174.41 2dlk s SER 3 N -5.32 1.27 0.79 4.97 1.04 -1.26 -5.17 113.70 110.02 2dlk s SER 3 Ca -0.13 -1.15 -0.07 0.00 0.48 0.00 0.00 55.95 55.08 2dlk s SER 3 Cb 0.13 0.10 0.13 0.00 0.10 0.00 0.00 66.02 66.47 2dlk s SER 3 CO 0.71 -0.54 1.10 -0.83 0.98 0.00 0.00 173.24 174.66 2dlk s GLY 4 N -3.17 1.75 0.32 7.32 0.00 -1.26 -5.11 107.32 107.17 2dlk s GLY 4 Ca 0.22 -1.30 0.10 0.00 0.00 0.00 0.00 44.72 43.74 2dlk s GLY 4 CO 0.03 -0.73 -0.04 -0.45 0.00 0.00 0.00 173.10 171.91 2dlk s SER 5 N -4.71 4.05 0.69 1.64 0.15 -1.26 -5.12 113.70 109.14 2dlk s SER 5 Ca 0.66 -0.99 -0.14 0.00 0.70 0.00 0.00 55.95 56.18 2dlk s SER 5 Cb -0.07 -0.50 0.01 0.00 -1.71 0.00 0.00 66.02 63.75 2dlk s SER 5 CO 0.47 -0.15 1.12 -0.44 1.20 0.00 0.00 173.24 175.44 2dlk s SER 6 N -3.66 4.87 0.48 5.45 0.01 -1.26 -4.83 113.70 114.76 2dlk s SER 6 Ca 0.33 2.03 0.00 0.00 1.31 0.00 0.00 55.95 59.63 2dlk s SER 6 Cb -0.01 -2.55 0.00 0.00 0.21 0.00 0.00 66.02 63.66 2dlk s SER 6 CO 0.18 -1.80 0.00 0.61 0.41 0.00 0.00 173.24 172.65 2dlk n GLY 7 N -0.45 -2.53 3.15 3.44 0.00 -1.26 -4.81 105.19 102.73 2dlk n GLY 7 Ca 0.11 -0.86 -0.34 0.00 0.00 0.00 0.00 46.02 44.93 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 -3.96 2.50 0.58 1.61 1.00 0.12 -4.87 119.30 116.28 2dlk s MET 8 Ca 0.00 -1.20 -0.18 0.00 0.00 0.00 0.00 55.69 54.31 2dlk s MET 8 Cb 0.00 -3.05 -0.04 0.00 0.00 0.00 0.00 34.83 31.74 2dlk s MET 8 CO 0.00 -0.54 1.12 -1.25 0.00 0.00 0.00 175.02 174.35 2dlk s PRO 9 N 1.24 3.19 0.88 2.03 0.04 -1.26 -0.89 135.00 140.23 2dlk s PRO 9 Ca -0.05 1.55 -0.12 0.00 0.04 0.00 0.00 61.00 62.42 2dlk s PRO 9 Cb -0.19 -1.99 0.12 0.00 0.04 0.00 0.00 34.50 32.48 2dlk s PRO 9 CO -0.03 -0.96 1.10 0.00 0.04 0.00 0.00 177.00 177.15 2dlk h ASP 11 N -1.43 0.12 -2.97 0.00 5.19 -1.96 -3.46 116.42 111.91 2dlk h ASP 11 Ca -0.50 -0.87 -0.58 0.00 -0.62 0.00 0.00 57.03 54.47 2dlk h ASP 11 Cb 1.29 -0.04 0.10 0.00 0.18 0.00 0.00 39.33 40.86 2dlk h ASP 11 CO 0.58 0.98 0.55 0.49 -3.12 0.00 0.00 179.24 178.72 2dlk n PHE 12 N -4.55 2.20 0.01 4.55 3.72 -1.26 -4.93 117.46 117.20 2dlk n PHE 12 Ca -0.10 0.49 -0.13 0.00 -0.05 0.00 0.00 57.45 57.66 2dlk n PHE 12 Cb 0.50 -2.44 -0.09 0.00 -0.94 0.00 0.00 39.48 36.51 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 3.39 -0.07 -0.57 -1.08 0.13 -2.03 -3.27 132.00 128.50 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 1.28 0.01 -0.02 0.00 0.13 0.00 0.00 31.00 32.40 2dlk h PRO 13 CO 0.69 0.40 0.13 0.78 -0.23 0.00 0.00 178.00 179.77 2dlk h GLY 14 N -0.56 1.00 -0.16 1.56 0.00 -2.00 -3.27 103.07 99.65 2dlk h GLY 14 Ca -0.01 -0.64 0.02 0.00 0.00 0.00 0.00 47.33 46.70 2dlk h GLY 14 CO 0.01 0.59 -0.14 0.00 0.00 0.00 0.00 176.54 177.00 2dlk n GLY 16 N -1.08 -0.13 3.81 0.00 0.00 -1.23 -5.03 105.19 101.53 2dlk n GLY 16 Ca -0.00 -0.04 -0.27 0.00 0.00 0.00 0.00 46.02 45.71 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 2.95 -0.01 1.61 1.81 -1.26 -4.94 118.95 113.78 2dlk s ARG 17 Ca 0.16 -0.83 0.01 0.00 -1.72 0.00 0.00 55.73 53.35 2dlk s ARG 17 Cb -0.07 -2.68 0.00 0.00 -0.45 0.00 0.00 34.95 31.75 2dlk s ARG 17 CO 0.52 0.49 -0.04 0.42 -0.68 0.00 0.00 175.30 176.02 2dlk s ILE 18 N -1.72 0.37 -0.04 1.52 1.01 -1.26 0.75 121.20 121.82 2dlk s ILE 18 Ca 0.31 -0.16 -0.01 0.00 0.00 0.00 0.00 60.65 60.79 2dlk s ILE 18 Cb -0.10 -0.34 0.03 0.00 0.01 0.00 0.00 42.46 42.06 2dlk s ILE 18 CO 0.24 0.12 0.07 -0.36 0.00 0.00 0.00 174.94 175.01 2dlk s PHE 19 N 0.14 -0.00 0.05 3.97 0.40 -0.07 -4.85 117.98 117.61 2dlk s PHE 19 Ca -0.01 0.26 -0.21 0.00 -0.60 0.00 0.00 56.93 56.37 2dlk s PHE 19 Cb -0.05 -0.30 -0.10 0.00 0.51 0.00 0.00 43.02 43.09 2dlk s PHE 19 CO -0.00 -0.15 1.32 1.03 0.70 0.00 0.00 175.22 178.12 2dlk h SER 20 N 7.75 -0.84 -3.83 1.36 0.87 -1.91 0.38 113.55 117.33 2dlk h SER 20 Ca -0.32 0.07 -0.48 0.00 -1.23 0.00 0.00 61.79 59.83 2dlk h SER 20 Cb 1.12 0.28 -0.01 0.00 -0.44 0.00 0.00 62.40 63.35 2dlk h SER 20 CO 0.34 -0.38 0.36 0.20 -0.53 0.00 0.00 176.83 176.82 2dlk s ASN 21 N -3.52 7.42 0.07 6.23 -0.87 -1.26 -4.38 114.94 118.64 2dlk s ASN 21 Ca -0.10 1.93 -0.19 0.00 -1.57 0.00 0.00 52.86 52.92 2dlk s ASN 21 Cb 0.03 -2.60 -0.10 0.00 -0.02 0.00 0.00 41.25 38.56 2dlk s ASN 21 CO 0.35 -0.01 1.50 0.03 -2.57 0.00 0.00 177.10 176.40 2dlk h ARG 22 N 3.57 0.38 -0.97 -0.60 3.08 -1.99 -3.13 114.38 114.72 2dlk h ARG 22 Ca -0.46 -0.13 0.22 0.00 0.07 0.00 0.00 59.98 59.68 2dlk h ARG 22 Cb 1.20 -0.03 -0.18 0.00 0.08 0.00 0.00 29.97 31.03 2dlk h ARG 22 CO 0.66 0.58 -0.14 -0.56 -1.07 0.00 0.00 179.97 179.44 2dlk h GLN 23 N 0.14 0.01 -0.29 0.04 3.07 -1.97 0.49 115.11 116.60 2dlk h GLN 23 Ca 0.06 -0.00 0.02 0.00 0.09 0.00 0.00 58.65 58.81 2dlk h GLN 23 Cb 0.41 -0.00 -0.02 0.00 0.08 0.00 0.00 27.48 27.95 2dlk h GLN 23 CO 0.01 0.00 0.15 1.88 0.09 0.00 0.00 178.83 180.97 2dlk h TYR 24 N 0.01 0.29 0.14 0.06 -1.99 -1.95 -2.25 116.97 111.27 2dlk h TYR 24 Ca 0.51 0.01 0.01 0.00 2.00 0.00 0.00 58.73 61.26 2dlk h TYR 24 Cb 0.90 -0.09 -0.03 0.00 2.00 0.00 0.00 36.73 39.51 2dlk h TYR 24 CO -0.65 0.16 -0.40 1.25 -0.00 0.00 0.00 178.16 178.52 2dlk h LEU 25 N 0.32 -1.20 -0.88 3.88 5.85 -0.06 0.26 115.31 123.48 2dlk h LEU 25 Ca 0.12 0.12 0.22 0.00 0.84 0.00 0.00 57.88 59.18 2dlk h LEU 25 Cb 0.02 0.44 -0.13 0.00 0.37 0.00 0.00 40.66 41.36 2dlk h LEU 25 CO -0.07 -0.44 0.35 -1.13 -0.34 0.00 0.00 178.44 176.81 2dlk h ASN 26 N -0.61 0.24 -0.66 1.25 -1.24 -1.29 0.27 115.58 113.54 2dlk h ASN 26 Ca -0.01 0.16 -0.07 0.00 0.71 0.00 0.00 56.30 57.09 2dlk h ASN 26 Cb 0.60 0.16 -0.03 0.00 0.73 0.00 0.00 38.32 39.78 2dlk h ASN 26 CO -0.19 -0.04 0.14 -0.74 -1.29 0.00 0.00 177.43 175.31 2dlk h HIS 27 N 0.35 1.13 -0.29 0.67 2.76 -0.72 -0.38 115.15 118.67 2dlk h HIS 27 Ca 0.55 -0.14 -0.01 0.00 -2.20 0.00 0.00 60.37 58.57 2dlk h HIS 27 Cb 1.05 -0.32 -0.01 0.00 1.55 0.00 0.00 27.41 29.68 2dlk h HIS 27 CO -0.17 0.94 0.15 1.25 -1.30 0.00 0.00 177.93 178.80 2dlk h HIS 28 N 1.00 0.41 -0.49 5.26 -0.00 0.29 0.19 115.15 121.81 2dlk h HIS 28 Ca 0.21 -0.01 -0.11 0.00 -0.00 0.00 0.00 60.37 60.46 2dlk h HIS 28 Cb 0.39 -0.13 -0.02 0.00 -0.00 0.00 0.00 27.41 27.65 2dlk h HIS 28 CO 0.03 0.35 -0.12 0.87 -0.00 0.00 0.00 177.93 179.07 2dlk h LYS 29 N 0.35 0.91 0.00 5.26 1.57 -0.99 0.72 116.57 124.39 2dlk h LYS 29 Ca 0.10 -0.32 -0.02 0.00 -1.87 0.00 0.00 60.65 58.54 2dlk h LYS 29 Cb 0.08 -0.06 -0.00 0.00 0.08 0.00 0.00 32.23 32.33 2dlk h LYS 29 CO -0.02 0.97 -0.08 -0.22 -0.57 0.00 0.00 179.45 179.53 2dlk h LYS 30 N 0.81 0.00 0.00 3.15 3.64 -0.82 0.10 116.57 123.45 2dlk h LYS 30 Ca 0.13 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.51 2dlk h LYS 30 Cb 0.65 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.47 2dlk h LYS 30 CO 0.04 0.08 -0.18 0.66 -2.27 0.00 0.00 179.45 177.79 2dlk n TYR 31 N -3.18 0.05 0.26 1.91 4.02 0.65 -3.62 117.16 117.25 2dlk n TYR 31 Ca 0.01 0.02 -0.15 0.00 -0.01 0.00 0.00 57.90 57.78 2dlk n TYR 31 Cb 0.41 -0.17 -0.08 0.00 -0.02 0.00 0.00 39.34 39.48 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 -0.20 -0.62 -0.49 -0.72 1.08 0.28 -2.80 115.11 111.63 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 0.18 0.14 0.00 0.00 -0.05 0.00 0.00 27.48 27.75 2dlk h GLN 32 CO 0.00 -0.33 0.00 0.72 -0.95 0.00 0.00 178.83 178.27 2dlk n HIS 33 N -5.29 0.34 -0.27 2.96 8.25 -0.74 -4.40 115.22 116.07 2dlk n HIS 33 Ca -0.11 -0.14 0.26 0.00 -0.26 0.00 0.00 57.72 57.47 2dlk n HIS 33 Cb 0.30 -0.09 0.49 0.00 1.12 0.00 0.00 29.99 31.81 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 0.06 -0.35 -0.49 1.59 0.13 -0.05 -4.42 119.36 115.83 2dlk n ILE 34 Ca 0.06 1.68 -0.29 0.00 -1.10 0.00 0.00 62.75 63.10 2dlk n ILE 34 Cb 0.29 -2.73 0.25 0.00 -0.84 0.00 0.00 39.64 36.60 2dlk n ILE 34 CO 0.00 0.00 0.00 0.00 2.80 0.00 0.00 176.55 179.35 2dlk n HIS 35 N -4.88 -1.71 -2.66 9.51 1.44 -1.26 -4.94 115.22 110.72 2dlk n HIS 35 Ca 0.31 -0.18 -0.41 0.00 -2.01 0.00 0.00 57.72 55.44 2dlk n HIS 35 Cb 1.06 -1.60 -0.05 0.00 0.12 0.00 0.00 29.99 29.52 2dlk n HIS 35 CO 0.00 0.00 0.00 1.14 -2.81 0.00 0.00 176.34 174.67 2dlk s GLN 36 N -4.18 4.73 1.05 -1.40 -2.07 -1.26 -5.02 119.66 111.50 2dlk s GLN 36 Ca 0.65 1.57 -0.13 0.00 -1.82 0.00 0.00 55.36 55.63 2dlk s GLN 36 Cb -0.20 -3.29 0.16 0.00 -1.09 0.00 0.00 33.01 28.58 2dlk s GLN 36 CO 0.64 0.31 0.70 1.17 -1.32 0.00 0.00 175.29 176.79 2dlk n LYS 37 N 1.95 -1.28 -4.26 9.60 4.81 -1.26 -5.05 118.16 122.67 2dlk n LYS 37 Ca 0.00 -0.33 -0.14 0.00 -0.87 0.00 0.00 58.31 56.96 2dlk n LYS 37 Cb 0.47 -2.06 -0.10 0.00 0.02 0.00 0.00 35.03 33.36 2dlk n LYS 37 CO 0.00 0.00 0.00 -1.54 1.17 0.00 0.00 177.40 177.03 2dlk s SER 38 N -2.26 0.84 -0.09 3.14 1.04 -1.26 -4.98 113.70 110.13 2dlk s SER 38 Ca 0.63 -1.35 0.04 0.00 0.48 0.00 0.00 55.95 55.75 2dlk s SER 38 Cb -0.21 0.23 -0.01 0.00 0.10 0.00 0.00 66.02 66.13 2dlk s SER 38 CO 0.64 -0.74 -0.21 -0.36 0.98 0.00 0.00 173.24 173.55 2dlk s PHE 39 N -3.88 2.59 0.16 5.02 0.08 -0.92 -5.02 117.98 116.02 2dlk s PHE 39 Ca 0.35 -0.80 0.10 0.00 0.12 0.00 0.00 56.93 56.70 2dlk s PHE 39 Cb 0.07 -1.70 -0.04 0.00 -0.57 0.00 0.00 43.02 40.78 2dlk s PHE 39 CO 0.11 -0.27 -0.16 -1.54 -0.10 0.00 0.00 175.22 173.26 2dlk s SER 40 N 0.11 3.91 0.18 1.36 1.04 -1.26 -0.73 113.70 118.32 2dlk s SER 40 Ca -0.10 -0.65 -0.30 0.00 0.48 0.00 0.00 55.95 55.38 2dlk s SER 40 Cb -0.16 -0.54 -0.08 0.00 0.10 0.00 0.00 66.02 65.35 2dlk s SER 40 CO 0.06 0.13 1.06 0.00 0.98 0.00 0.00 173.24 175.47 2dlk n PRO 42 N 2.24 0.49 -4.24 0.00 -0.04 -1.26 -4.67 135.00 127.51 2dlk n PRO 42 Ca 0.02 0.00 -0.34 0.00 -0.04 0.00 0.00 63.50 63.13 2dlk n PRO 42 Cb 0.47 -1.25 -0.10 0.00 -0.04 0.00 0.00 33.50 32.57 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 3.57 -0.02 0.54 2.56 -1.26 -5.02 118.70 117.07 2dlk s GLU 43 Ca 0.12 -0.41 -0.26 0.00 0.00 0.00 0.00 54.97 54.42 2dlk s GLU 43 Cb 0.05 -2.99 -0.20 0.00 2.00 0.00 0.00 34.13 32.99 2dlk s GLU 43 CO 0.09 0.41 1.27 -1.00 -0.56 0.00 0.00 175.26 175.47 2dlk h PRO 44 N 6.19 0.02 -0.28 4.30 0.13 -2.01 -1.84 132.00 138.50 2dlk h PRO 44 Ca -0.40 -0.01 -0.04 0.00 -0.87 0.00 0.00 66.00 64.69 2dlk h PRO 44 Cb 1.18 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.30 2dlk h PRO 44 CO 0.63 0.50 0.02 0.00 -0.23 0.00 0.00 178.00 178.92 2dlk h ALA 45 N 0.52 1.51 0.14 -0.56 0.00 -1.97 -3.04 119.26 115.85 2dlk h ALA 45 Ca 0.00 -0.16 -0.01 0.00 0.00 0.00 0.00 54.91 54.75 2dlk h ALA 45 Cb 0.50 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.16 2dlk h ALA 45 CO 0.00 0.36 -0.07 0.00 0.00 0.00 0.00 179.25 179.54 2dlk n GLY 47 N 0.22 -0.47 3.90 0.00 0.00 -0.70 -4.92 105.19 103.22 2dlk n GLY 47 Ca -0.08 0.08 -0.29 0.00 0.00 0.00 0.00 46.02 45.73 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 -6.14 3.64 0.05 1.61 2.20 -1.26 -4.92 119.74 114.92 2dlk s LYS 48 Ca 0.44 0.02 0.02 0.00 -0.36 0.00 0.00 55.97 56.09 2dlk s LYS 48 Cb -0.24 -2.66 -0.03 0.00 -1.51 0.00 0.00 37.83 33.39 2dlk s LYS 48 CO 0.55 0.24 -0.08 -1.54 -0.36 0.00 0.00 175.35 174.16 2dlk s SER 49 N -3.05 0.88 -0.04 1.43 1.04 -1.26 -0.51 113.70 112.19 2dlk s SER 49 Ca 0.44 -0.58 -0.01 0.00 0.48 0.00 0.00 55.95 56.28 2dlk s SER 49 Cb -0.11 0.04 0.03 0.00 0.10 0.00 0.00 66.02 66.09 2dlk s SER 49 CO 0.29 -0.22 0.08 -0.36 0.98 0.00 0.00 173.24 174.01 2dlk s PHE 50 N -1.53 -0.06 -1.38 5.02 0.08 0.10 -5.01 117.98 115.19 2dlk s PHE 50 Ca -0.09 0.29 0.04 0.00 0.12 0.00 0.00 56.93 57.29 2dlk s PHE 50 Cb -0.09 -0.17 0.15 0.00 -0.57 0.00 0.00 43.02 42.34 2dlk s PHE 50 CO 0.00 -0.12 0.91 0.09 -0.10 0.00 0.00 175.22 176.00 2dlk n ASN 51 N 4.18 1.39 -3.79 1.36 4.13 -1.26 -2.15 115.26 119.12 2dlk n ASN 51 Ca -0.27 -2.10 -0.15 0.00 1.68 0.00 0.00 54.58 53.74 2dlk n ASN 51 Cb 0.51 -0.33 -0.16 0.00 -1.54 0.00 0.00 39.78 38.26 2dlk n ASN 51 CO 0.00 0.00 0.00 -0.36 0.28 0.00 0.00 177.26 177.18 2dlk s PHE 52 N -1.56 0.12 0.19 3.10 0.40 -1.26 -4.96 117.98 114.01 2dlk s PHE 52 Ca 0.10 0.08 -0.12 0.00 -0.60 0.00 0.00 56.93 56.39 2dlk s PHE 52 Cb 0.07 -0.28 0.17 0.00 0.51 0.00 0.00 43.02 43.49 2dlk s PHE 52 CO 0.05 -0.10 1.78 -0.22 0.70 0.00 0.00 175.22 177.43 2dlk h LYS 53 N 7.20 0.47 -0.99 0.44 3.64 -2.01 -1.77 116.57 123.56 2dlk h LYS 53 Ca -0.44 -0.03 0.01 0.00 -1.27 0.00 0.00 60.65 58.93 2dlk h LYS 53 Cb 1.13 -0.11 -0.05 0.00 -0.41 0.00 0.00 32.23 32.79 2dlk h LYS 53 CO 0.48 0.31 0.66 1.57 -2.27 0.00 0.00 179.45 180.20 2dlk h LYS 54 N 0.49 1.31 -0.31 1.90 2.10 -1.98 -2.54 116.57 117.53 2dlk h LYS 54 Ca 0.24 -0.08 0.04 0.00 -2.00 0.00 0.00 60.65 58.86 2dlk h LYS 54 Cb 0.19 -0.29 -0.04 0.00 -0.90 0.00 0.00 32.23 31.18 2dlk h LYS 54 CO -0.19 0.86 0.07 0.45 -2.00 0.00 0.00 179.45 178.64 2dlk h HIS 55 N 1.35 0.12 -0.31 0.07 3.86 -1.73 -0.98 115.15 117.51 2dlk h HIS 55 Ca 0.37 0.02 0.02 0.00 -1.16 0.00 0.00 60.37 59.62 2dlk h HIS 55 Cb -0.15 -0.01 -0.03 0.00 1.06 0.00 0.00 27.41 28.28 2dlk h HIS 55 CO -0.00 0.03 0.14 1.25 0.86 0.00 0.00 177.93 180.22 2dlk h LEU 56 N 0.19 0.20 0.46 2.43 5.85 -1.08 0.53 115.31 123.88 2dlk h LEU 56 Ca 0.14 0.02 -0.01 0.00 0.84 0.00 0.00 57.88 58.87 2dlk h LEU 56 Cb 0.15 -0.02 -0.02 0.00 0.37 0.00 0.00 40.66 41.15 2dlk h LEU 56 CO -0.18 0.16 -0.39 0.50 -0.34 0.00 0.00 178.44 178.18 2dlk h LYS 57 N 0.31 -0.82 -0.95 1.25 3.64 -1.06 -1.17 116.57 117.77 2dlk h LYS 57 Ca 0.13 0.06 0.09 0.00 -1.27 0.00 0.00 60.65 59.66 2dlk h LYS 57 Cb 0.06 0.19 -0.07 0.00 -0.41 0.00 0.00 32.23 31.99 2dlk h LYS 57 CO -0.10 -0.54 0.59 1.05 -2.27 0.00 0.00 179.45 178.18 2dlk h GLU 58 N -0.85 0.98 -0.32 1.90 4.11 -1.06 -1.98 114.58 117.36 2dlk h GLU 58 Ca -0.04 -0.06 0.03 0.00 0.07 0.00 0.00 59.36 59.36 2dlk h GLU 58 Cb 0.73 -0.22 -0.03 0.00 0.50 0.00 0.00 28.75 29.73 2dlk h GLU 58 CO -0.03 0.65 0.12 1.25 0.07 0.00 0.00 179.01 181.07 2dlk h HIS 59 N 1.01 0.22 -0.90 2.06 2.76 -0.46 -2.18 115.15 117.66 2dlk h HIS 59 Ca 0.45 0.02 0.14 0.00 -2.20 0.00 0.00 60.37 58.77 2dlk h HIS 59 Cb 0.34 -0.05 -0.09 0.00 1.55 0.00 0.00 27.41 29.16 2dlk h HIS 59 CO -0.02 0.10 0.51 0.52 -1.30 0.00 0.00 177.93 177.74 2dlk h MET 60 N 0.27 0.73 -0.78 5.26 2.86 -0.45 -2.30 114.93 120.52 2dlk h MET 60 Ca 0.14 -0.04 0.14 0.00 -2.06 0.00 0.00 59.70 57.88 2dlk h MET 60 Cb 0.11 -0.17 -0.14 0.00 0.06 0.00 0.00 31.60 31.46 2dlk h MET 60 CO -0.14 0.48 -0.24 1.63 1.06 0.00 0.00 176.91 179.71 2dlk n LYS 61 N -4.78 -0.11 0.11 1.72 4.76 -0.82 0.60 118.16 119.64 2dlk n LYS 61 Ca 0.18 1.21 -0.13 0.00 -2.87 0.00 0.00 58.31 56.70 2dlk n LYS 61 Cb 0.41 -1.80 -0.06 0.00 -1.84 0.00 0.00 35.03 31.75 2dlk n LYS 61 CO 0.00 0.00 0.00 -0.07 -1.37 0.00 0.00 177.40 175.96 2dlk h LEU 62 N 0.00 -0.73 -0.73 -0.35 3.38 -1.54 -2.32 115.31 113.02 2dlk h LEU 62 Ca 0.33 0.09 0.14 0.00 0.09 0.00 0.00 57.88 58.53 2dlk h LEU 62 Cb 0.53 0.28 -0.10 0.00 0.09 0.00 0.00 40.66 41.46 2dlk h LEU 62 CO -0.79 -0.35 0.27 0.45 0.09 0.00 0.00 178.44 178.11 2dlk h HIS 63 N -0.46 0.45 -0.97 1.13 3.86 0.06 -0.98 115.15 118.24 2dlk h HIS 63 Ca 0.03 0.04 0.31 0.00 -1.16 0.00 0.00 60.37 59.59 2dlk h HIS 63 Cb 0.49 -0.09 -0.17 0.00 1.06 0.00 0.00 27.41 28.70 2dlk h HIS 63 CO -0.24 0.03 0.23 1.03 0.86 0.00 0.00 177.93 179.85 2dlk h SER 64 N 0.40 -0.12 -0.74 2.45 0.87 -0.54 0.17 113.55 116.04 2dlk h SER 64 Ca 0.40 0.26 0.22 0.00 -1.23 0.00 0.00 61.79 61.44 2dlk h SER 64 Cb 0.62 0.37 -0.14 0.00 -0.44 0.00 0.00 62.40 62.81 2dlk h SER 64 CO -0.42 -0.33 0.06 0.47 -0.53 0.00 0.00 176.83 176.08 2dlk n ASP 65 N -5.36 -0.04 -4.63 6.23 9.92 -0.37 -3.83 116.55 118.47 2dlk n ASP 65 Ca 0.27 1.25 -0.41 0.00 -0.53 0.00 0.00 54.79 55.37 2dlk n ASP 65 Cb 0.90 -0.48 -0.05 0.00 -0.64 0.00 0.00 41.12 40.86 2dlk n ASP 65 CO 0.00 0.00 0.00 0.42 0.13 0.00 0.00 177.20 177.75 2dlk s THR 66 N -5.59 4.89 0.22 -3.53 -4.23 0.59 -5.05 115.64 102.94 2dlk s THR 66 Ca -0.09 1.34 0.06 0.00 -1.18 0.00 0.00 61.69 61.81 2dlk s THR 66 Cb 0.22 -4.05 -0.04 0.00 1.34 0.00 0.00 72.50 69.98 2dlk s THR 66 CO 0.58 -0.06 0.21 -0.60 -0.54 0.00 0.00 174.62 174.20 2dlk s ARG 67 N 2.73 3.03 0.12 3.99 3.52 -1.25 -5.02 118.95 126.06 2dlk s ARG 67 Ca 0.31 -0.93 -0.13 0.00 -0.13 0.00 0.00 55.73 54.85 2dlk s ARG 67 Cb -0.15 -2.66 0.02 0.00 -1.56 0.00 0.00 34.95 30.60 2dlk s ARG 67 CO 0.09 0.44 0.32 -0.51 -0.81 0.00 0.00 175.30 174.83 2dlk s ASP 68 N -3.61 -0.09 -0.16 -2.12 1.01 -1.26 -5.16 116.67 105.29 2dlk s ASP 68 Ca 0.33 -0.47 -0.05 0.00 0.71 0.00 0.00 52.55 53.06 2dlk s ASP 68 Cb -0.09 0.43 -0.03 0.00 1.01 0.00 0.00 42.92 44.23 2dlk s ASP 68 CO 0.25 -0.82 0.02 -0.47 0.21 0.00 0.00 175.17 174.36 2dlk s TYR 69 N -3.84 3.15 0.45 4.23 5.04 -1.26 -4.99 117.35 120.14 2dlk s TYR 69 Ca 0.05 -0.05 0.18 0.00 -2.44 0.00 0.00 57.07 54.80 2dlk s TYR 69 Cb 0.03 -1.99 1.13 0.00 0.35 0.00 0.00 41.96 41.48 2dlk s TYR 69 CO -0.11 0.13 1.94 -0.84 -1.34 0.00 0.00 175.55 175.33 2dlk h ILE 70 N 4.87 0.79 -2.89 3.14 3.07 -2.06 -3.41 117.51 121.03 2dlk h ILE 70 Ca -0.37 -0.11 -0.54 0.00 1.55 0.00 0.00 64.86 65.39 2dlk h ILE 70 Cb 1.18 0.44 -0.02 0.00 -0.27 0.00 0.00 36.82 38.15 2dlk h ILE 70 CO 0.65 0.06 -0.33 0.00 -1.05 0.00 0.00 178.15 177.48 2dlk s GLU 72 N -3.23 1.17 -0.07 0.00 2.12 -1.26 -5.07 118.70 112.35 2dlk s GLU 72 Ca 0.39 -0.10 -0.27 0.00 0.36 0.00 0.00 54.97 55.35 2dlk s GLU 72 Cb -0.11 0.54 -0.23 0.00 0.26 0.00 0.00 34.13 34.59 2dlk s GLU 72 CO 0.28 -0.44 1.03 0.74 -0.54 0.00 0.00 175.26 176.33 2dlk h PHE 73 N 2.51 0.07 -0.88 5.30 0.04 -1.99 -3.29 116.94 118.70 2dlk h PHE 73 Ca -0.30 -0.03 0.28 0.00 2.80 0.00 0.00 57.97 60.71 2dlk h PHE 73 Cb 1.22 -0.01 -0.16 0.00 2.20 0.00 0.00 35.95 39.20 2dlk h PHE 73 CO 0.31 0.79 0.15 0.45 -0.60 0.00 0.00 178.31 179.41 2dlk n SER 74 N -4.68 0.02 -3.79 2.17 2.88 -1.26 -3.00 113.62 105.97 2dlk n SER 74 Ca -0.09 1.48 -0.30 0.00 -1.33 0.00 0.00 58.87 58.63 2dlk n SER 74 Cb 0.40 -0.59 -0.14 0.00 -0.75 0.00 0.00 64.21 63.13 2dlk n SER 74 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 2dlk s GLY 75 N -4.29 1.80 -0.27 0.46 0.00 -1.24 -5.09 107.32 98.69 2dlk s GLY 75 Ca -0.10 -2.64 -0.29 0.00 0.00 0.00 0.00 44.72 41.68 2dlk s GLY 75 CO 0.69 1.39 1.65 2.56 0.00 0.00 0.00 173.10 179.39 2dlk s PRO 76 N 0.38 3.63 0.10 2.90 0.04 -1.16 -4.53 135.00 136.35 2dlk s PRO 76 Ca 0.16 1.51 -0.31 0.00 0.04 0.00 0.00 61.00 62.40 2dlk s PRO 76 Cb -0.24 -4.08 -0.07 0.00 0.04 0.00 0.00 34.50 30.15 2dlk s PRO 76 CO -0.03 -1.50 1.34 0.45 0.04 0.00 0.00 177.00 177.31 2dlk s SER 77 N 4.76 6.89 0.16 6.66 0.15 -1.26 -5.03 113.70 126.04 2dlk s SER 77 Ca 0.73 2.24 0.07 0.00 0.70 0.00 0.00 55.95 59.69 2dlk s SER 77 Cb -0.23 -2.58 -0.04 0.00 -1.71 0.00 0.00 66.02 61.46 2dlk s SER 77 CO 0.31 -0.61 -0.15 -0.55 1.20 0.00 0.00 173.24 173.45 2dlk s SER 78 N 1.10 2.33 0.00 5.45 0.15 -1.26 -5.18 113.70 116.29 2dlk s SER 78 Ca 0.63 -0.91 0.00 0.00 0.70 0.00 0.00 55.95 56.37 2dlk s SER 78 Cb -0.35 -0.11 0.00 0.00 -1.71 0.00 0.00 66.02 63.86 2dlk s SER 78 CO 0.30 -0.14 0.00 0.61 1.20 0.00 0.00 173.24 175.20