#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 5.90 0.28 1.61 0.01 -1.26 -5.10 113.70 115.14 2dlk s SER 2 Ca 0.00 0.24 0.02 0.00 1.31 0.00 0.00 55.95 57.52 2dlk s SER 2 Cb 0.00 -1.93 -0.03 0.00 0.21 0.00 0.00 66.02 64.26 2dlk s SER 2 CO 0.00 0.29 0.45 -0.55 0.41 0.00 0.00 173.24 173.83 2dlk s SER 3 N -0.30 6.33 -1.53 2.44 0.15 -1.26 -5.00 113.70 114.53 2dlk s SER 3 Ca 0.09 0.31 -0.10 0.00 0.70 0.00 0.00 55.95 56.95 2dlk s SER 3 Cb -0.12 -1.97 -0.01 0.00 -1.71 0.00 0.00 66.02 62.21 2dlk s SER 3 CO 0.01 -0.16 2.64 0.61 1.20 0.00 0.00 173.24 177.55 2dlk n GLY 4 N -1.39 4.45 3.31 9.45 0.00 -1.26 -4.89 105.19 114.86 2dlk n GLY 4 Ca -0.06 -1.63 -0.22 0.00 0.00 0.00 0.00 46.02 44.10 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 2.11 2.58 -0.19 1.61 0.15 -1.26 -5.05 113.70 113.65 2dlk s SER 5 Ca 0.60 -0.79 0.14 0.00 0.70 0.00 0.00 55.95 56.60 2dlk s SER 5 Cb 0.17 -0.14 -0.23 0.00 -1.71 0.00 0.00 66.02 64.10 2dlk s SER 5 CO -0.07 -0.01 0.09 -1.54 1.20 0.00 0.00 173.24 172.91 2dlk n SER 6 N 0.60 0.49 0.00 5.45 3.41 -1.26 -5.06 113.62 117.25 2dlk n SER 6 Ca -0.16 0.02 0.00 0.00 -0.26 0.00 0.00 58.87 58.48 2dlk n SER 6 Cb 0.56 0.59 0.00 0.00 -0.26 0.00 0.00 64.21 65.10 2dlk n SER 6 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2dlk n GLY 7 N 1.83 3.89 2.94 5.00 0.00 -1.26 -4.88 105.19 112.70 2dlk n GLY 7 Ca -0.34 -1.70 -0.25 0.00 0.00 0.00 0.00 46.02 43.73 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 -3.07 1.43 0.50 1.61 1.00 -0.46 -4.88 119.30 115.42 2dlk s MET 8 Ca 0.00 -0.27 -0.21 0.00 0.00 0.00 0.00 55.69 55.21 2dlk s MET 8 Cb 0.00 -1.37 -0.07 0.00 0.00 0.00 0.00 34.83 33.39 2dlk s MET 8 CO 0.00 -0.13 1.15 -1.25 0.00 0.00 0.00 175.02 174.79 2dlk s PRO 9 N 1.22 3.56 0.89 2.03 0.04 -1.26 -0.25 135.00 141.23 2dlk s PRO 9 Ca -0.05 1.70 -0.12 0.00 0.04 0.00 0.00 61.00 62.57 2dlk s PRO 9 Cb -0.14 -2.21 0.13 0.00 0.04 0.00 0.00 34.50 32.31 2dlk s PRO 9 CO -0.02 -0.70 1.09 0.00 0.04 0.00 0.00 177.00 177.42 2dlk h ASP 11 N -1.51 -0.16 -2.76 0.00 3.58 -1.95 -3.45 116.42 110.17 2dlk h ASP 11 Ca -0.50 -0.35 -0.59 0.00 0.42 0.00 0.00 57.03 56.02 2dlk h ASP 11 Cb 1.29 0.04 0.09 0.00 1.72 0.00 0.00 39.33 42.47 2dlk h ASP 11 CO 0.56 0.31 0.52 0.49 -2.88 0.00 0.00 179.24 178.24 2dlk n PHE 12 N -4.96 2.05 0.03 0.28 3.72 -1.26 -4.93 117.46 112.40 2dlk n PHE 12 Ca -0.09 0.50 -0.13 0.00 -0.05 0.00 0.00 57.45 57.69 2dlk n PHE 12 Cb 0.26 -2.42 -0.09 0.00 -0.94 0.00 0.00 39.48 36.29 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 3.56 -0.11 -0.62 -1.08 0.13 -2.03 -3.30 132.00 128.55 2dlk h PRO 13 Ca -0.45 0.01 -0.05 0.00 -0.87 0.00 0.00 66.00 64.64 2dlk h PRO 13 Cb 1.29 0.02 -0.03 0.00 0.13 0.00 0.00 31.00 32.42 2dlk h PRO 13 CO 0.71 0.34 0.18 0.78 -0.23 0.00 0.00 178.00 179.78 2dlk h GLY 14 N -0.60 1.04 -1.00 1.56 0.00 -1.99 -3.12 103.07 98.97 2dlk h GLY 14 Ca -0.01 -0.62 0.17 0.00 0.00 0.00 0.00 47.33 46.86 2dlk h GLY 14 CO 0.02 0.58 -0.35 0.00 0.00 0.00 0.00 176.54 176.79 2dlk n GLY 16 N -1.51 -0.66 3.32 0.00 0.00 -1.18 -5.00 105.19 100.16 2dlk n GLY 16 Ca 0.12 0.31 -0.23 0.00 0.00 0.00 0.00 46.02 46.22 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 -5.90 1.22 -0.02 1.61 0.52 -1.26 -5.00 118.95 110.12 2dlk s ARG 17 Ca 0.24 -1.30 0.03 0.00 -0.52 0.00 0.00 55.73 54.18 2dlk s ARG 17 Cb -0.08 -1.39 -0.00 0.00 0.52 0.00 0.00 34.95 34.00 2dlk s ARG 17 CO 0.84 0.30 -0.10 0.42 0.02 0.00 0.00 175.30 176.78 2dlk s ILE 18 N -1.62 0.86 -0.03 1.52 1.01 -1.26 0.67 121.20 122.34 2dlk s ILE 18 Ca 0.12 -0.42 0.01 0.00 0.00 0.00 0.00 60.65 60.35 2dlk s ILE 18 Cb -0.08 -0.75 0.03 0.00 0.01 0.00 0.00 42.46 41.67 2dlk s ILE 18 CO 0.06 0.26 -0.01 -0.36 0.00 0.00 0.00 174.94 174.89 2dlk s PHE 19 N 0.05 0.41 -0.02 3.97 0.40 0.65 -4.81 117.98 118.64 2dlk s PHE 19 Ca -0.01 -0.05 -0.23 0.00 -0.60 0.00 0.00 56.93 56.04 2dlk s PHE 19 Cb -0.07 -0.47 -0.16 0.00 0.51 0.00 0.00 43.02 42.83 2dlk s PHE 19 CO 0.00 -0.14 1.08 0.77 0.70 0.00 0.00 175.22 177.63 2dlk h SER 20 N 7.25 -0.27 -3.62 1.36 0.02 -1.90 -1.23 113.55 115.17 2dlk h SER 20 Ca -0.41 -0.26 -0.51 0.00 -0.84 0.00 0.00 61.79 59.77 2dlk h SER 20 Cb 1.14 0.07 0.00 0.00 0.14 0.00 0.00 62.40 63.75 2dlk h SER 20 CO 0.47 0.18 0.46 0.20 -1.14 0.00 0.00 176.83 177.00 2dlk s ASN 21 N -5.26 7.31 0.06 3.07 -0.87 -1.26 -4.71 114.94 113.29 2dlk s ASN 21 Ca -0.13 2.09 -0.27 0.00 -1.57 0.00 0.00 52.86 52.97 2dlk s ASN 21 Cb 0.01 -2.61 -0.17 0.00 -0.02 0.00 0.00 41.25 38.47 2dlk s ASN 21 CO 0.52 -0.17 1.59 0.03 -2.57 0.00 0.00 177.10 176.50 2dlk h ARG 22 N 4.86 -0.37 -0.87 -0.60 3.08 -2.00 -2.91 114.38 115.57 2dlk h ARG 22 Ca -0.45 0.02 0.18 0.00 0.07 0.00 0.00 59.98 59.81 2dlk h ARG 22 Cb 1.21 0.08 -0.17 0.00 0.08 0.00 0.00 29.97 31.18 2dlk h ARG 22 CO 0.71 -0.18 -0.20 0.37 -1.07 0.00 0.00 179.97 179.59 2dlk h GLN 23 N -0.47 0.00 -0.92 0.04 5.75 -1.98 0.78 115.11 118.31 2dlk h GLN 23 Ca -0.04 -0.00 0.06 0.00 -0.15 0.00 0.00 58.65 58.52 2dlk h GLN 23 Cb 0.35 -0.00 -0.06 0.00 1.07 0.00 0.00 27.48 28.84 2dlk h GLN 23 CO 0.06 0.00 0.60 1.88 -2.65 0.00 0.00 178.83 178.72 2dlk h TYR 24 N 0.00 1.08 0.51 3.99 -1.99 -1.94 0.30 116.97 118.92 2dlk h TYR 24 Ca 0.42 0.03 -0.02 0.00 2.00 0.00 0.00 58.73 61.16 2dlk h TYR 24 Cb 0.66 -0.36 0.00 0.00 2.00 0.00 0.00 36.73 39.04 2dlk h TYR 24 CO -0.67 0.58 -0.24 1.25 -0.00 0.00 0.00 178.16 179.07 2dlk h LEU 25 N 1.07 -0.58 -0.67 3.88 5.85 0.69 0.17 115.31 125.73 2dlk h LEU 25 Ca 0.39 0.02 0.08 0.00 0.84 0.00 0.00 57.88 59.21 2dlk h LEU 25 Cb 0.16 0.15 -0.07 0.00 0.37 0.00 0.00 40.66 41.27 2dlk h LEU 25 CO -0.14 -0.32 0.32 -1.13 -0.34 0.00 0.00 178.44 176.83 2dlk h ASN 26 N -0.86 0.41 -0.58 1.25 -1.24 -1.04 -1.06 115.58 112.46 2dlk h ASN 26 Ca -0.07 0.06 -0.03 0.00 0.71 0.00 0.00 56.30 56.97 2dlk h ASN 26 Cb 0.52 -0.01 -0.03 0.00 0.73 0.00 0.00 38.32 39.53 2dlk h ASN 26 CO 0.11 0.25 0.26 -0.74 -1.29 0.00 0.00 177.43 176.02 2dlk h HIS 27 N 0.56 0.86 -0.92 0.67 2.76 -0.44 0.87 115.15 119.52 2dlk h HIS 27 Ca 0.32 -0.05 0.01 0.00 -2.20 0.00 0.00 60.37 58.45 2dlk h HIS 27 Cb 0.33 -0.26 -0.05 0.00 1.55 0.00 0.00 27.41 28.98 2dlk h HIS 27 CO -0.12 0.67 0.61 1.25 -1.30 0.00 0.00 177.93 179.05 2dlk h HIS 28 N 0.80 1.15 0.00 5.26 -0.00 0.24 0.26 115.15 122.86 2dlk h HIS 28 Ca 0.20 0.03 -0.04 0.00 -0.00 0.00 0.00 60.37 60.56 2dlk h HIS 28 Cb 0.15 -0.39 -0.01 0.00 -0.00 0.00 0.00 27.41 27.17 2dlk h HIS 28 CO 0.00 0.72 -0.18 0.87 -0.00 0.00 0.00 177.93 179.35 2dlk h LYS 29 N 1.24 0.00 -0.01 5.26 1.57 -0.91 0.37 116.57 124.10 2dlk h LYS 29 Ca 0.34 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.12 2dlk h LYS 29 Cb -0.14 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.17 2dlk h LYS 29 CO -0.07 0.18 -0.41 1.17 -0.57 0.00 0.00 179.45 179.74 2dlk n LYS 30 N -3.18 0.55 -0.03 3.15 4.81 0.27 -2.32 118.16 121.43 2dlk n LYS 30 Ca 0.02 -0.36 -0.04 0.00 -0.87 0.00 0.00 58.31 57.07 2dlk n LYS 30 Cb 0.55 -1.49 -0.03 0.00 0.02 0.00 0.00 35.03 34.08 2dlk n LYS 30 CO 0.00 0.00 0.00 0.66 1.17 0.00 0.00 177.40 179.23 2dlk n TYR 31 N -0.91 0.00 -0.12 5.64 4.02 0.81 -4.47 117.16 122.13 2dlk n TYR 31 Ca 0.09 0.00 -0.22 0.00 -0.01 0.00 0.00 57.90 57.76 2dlk n TYR 31 Cb 0.36 -0.22 -0.08 0.00 -0.02 0.00 0.00 39.34 39.37 2dlk n TYR 31 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 176.86 176.89 2dlk n GLN 32 N -2.55 0.56 -0.02 -0.72 1.13 0.13 -4.33 117.38 111.57 2dlk n GLN 32 Ca -0.09 0.33 0.00 0.00 -1.94 0.00 0.00 57.00 55.30 2dlk n GLN 32 Cb 0.62 -1.54 0.01 0.00 0.11 0.00 0.00 30.24 29.44 2dlk n GLN 32 CO 0.00 0.00 0.00 0.72 -1.44 0.00 0.00 177.06 176.34 2dlk n HIS 33 N -4.35 0.06 1.40 1.08 8.25 -1.07 -3.66 115.22 116.92 2dlk n HIS 33 Ca -0.39 -0.02 0.03 0.00 -0.26 0.00 0.00 57.72 57.08 2dlk n HIS 33 Cb 0.73 -0.06 0.08 0.00 1.12 0.00 0.00 29.99 31.86 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 -0.21 0.26 -3.05 1.59 3.06 -0.98 -4.84 119.36 115.18 2dlk n ILE 34 Ca 0.01 -0.25 -0.15 0.00 -2.50 0.00 0.00 62.75 59.86 2dlk n ILE 34 Cb 0.15 0.11 0.04 0.00 0.54 0.00 0.00 39.64 40.48 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 0.04 -1.65 -3.65 9.51 -0.00 -1.24 -5.01 115.22 113.21 2dlk n HIS 35 Ca 0.06 0.55 -0.09 0.00 -0.00 0.00 0.00 57.72 58.24 2dlk n HIS 35 Cb 0.16 -3.46 -0.02 0.00 -0.00 0.00 0.00 29.99 26.67 2dlk n HIS 35 CO 0.00 0.00 0.00 -0.65 -0.00 0.00 0.00 176.34 175.69 2dlk s GLN 36 N -5.66 1.49 -0.06 1.57 -0.21 -1.26 -5.07 119.66 110.46 2dlk s GLN 36 Ca 0.32 -0.72 -0.24 0.00 0.02 0.00 0.00 55.36 54.74 2dlk s GLN 36 Cb -0.14 0.58 -0.20 0.00 1.00 0.00 0.00 33.01 34.25 2dlk s GLN 36 CO 0.39 -0.67 0.99 0.87 -2.12 0.00 0.00 175.29 174.75 2dlk h LYS 37 N 2.00 -0.08 -5.98 2.91 1.79 -1.84 -3.43 116.57 111.95 2dlk h LYS 37 Ca -0.26 0.01 -0.42 0.00 -2.18 0.00 0.00 60.65 57.80 2dlk h LYS 37 Cb 1.27 0.02 0.09 0.00 -1.58 0.00 0.00 32.23 32.03 2dlk h LYS 37 CO 0.30 0.49 -0.71 -1.13 -1.08 0.00 0.00 179.45 177.32 2dlk n SER 38 N -4.83 -5.57 -4.68 0.86 3.41 -1.22 -4.82 113.62 96.77 2dlk n SER 38 Ca -0.08 -0.62 -0.50 0.00 -0.26 0.00 0.00 58.87 57.41 2dlk n SER 38 Cb 0.30 -4.68 -0.05 0.00 -0.26 0.00 0.00 64.21 59.52 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 -4.86 2.29 -4.42 7.33 3.72 -1.01 -4.69 117.46 115.82 2dlk n PHE 39 Ca -0.01 0.08 -0.27 0.00 -0.05 0.00 0.00 57.45 57.20 2dlk n PHE 39 Cb 0.56 -2.63 -0.12 0.00 -0.94 0.00 0.00 39.48 36.35 2dlk n PHE 39 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 2dlk s SER 40 N 3.86 3.39 0.15 4.37 0.15 -1.26 -0.22 113.70 124.15 2dlk s SER 40 Ca 0.93 -0.85 -0.30 0.00 0.70 0.00 0.00 55.95 56.43 2dlk s SER 40 Cb -0.74 -0.25 -0.07 0.00 -1.71 0.00 0.00 66.02 63.25 2dlk s SER 40 CO 0.53 0.13 1.09 0.00 1.20 0.00 0.00 173.24 176.18 2dlk h PRO 42 N 5.37 0.60 -6.55 0.00 0.13 -2.00 -3.42 132.00 126.14 2dlk h PRO 42 Ca -0.44 -0.32 -0.53 0.00 -0.87 0.00 0.00 66.00 63.85 2dlk h PRO 42 Cb 1.21 0.01 0.04 0.00 0.13 0.00 0.00 31.00 32.39 2dlk h PRO 42 CO 0.73 0.91 0.97 -2.00 -0.23 0.00 0.00 178.00 178.39 2dlk s GLU 43 N -4.22 4.19 -0.02 0.86 2.12 -1.26 -4.93 118.70 115.43 2dlk s GLU 43 Ca -0.08 2.42 -0.24 0.00 0.36 0.00 0.00 54.97 57.42 2dlk s GLU 43 Cb 0.12 -3.36 -0.18 0.00 0.26 0.00 0.00 34.13 30.97 2dlk s GLU 43 CO 0.83 -0.70 1.16 -1.00 -0.54 0.00 0.00 175.26 175.01 2dlk h PRO 44 N 7.58 -0.15 -1.00 4.30 0.13 -2.00 -1.18 132.00 139.67 2dlk h PRO 44 Ca -0.43 0.01 0.19 0.00 -0.87 0.00 0.00 66.00 64.90 2dlk h PRO 44 Cb 1.20 0.03 -0.10 0.00 0.13 0.00 0.00 31.00 32.27 2dlk h PRO 44 CO 0.93 0.28 0.61 0.00 -0.23 0.00 0.00 178.00 179.59 2dlk h ALA 45 N 0.12 1.70 0.22 -0.56 0.00 -1.99 -2.62 119.26 116.14 2dlk h ALA 45 Ca -0.02 0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 2dlk h ALA 45 Cb 0.50 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.21 2dlk h ALA 45 CO 0.03 -0.06 -0.11 0.00 0.00 0.00 0.00 179.25 179.11 2dlk n GLY 47 N 0.73 -0.58 2.81 0.00 0.00 -0.45 -5.01 105.19 102.68 2dlk n GLY 47 Ca -0.06 1.17 -0.19 0.00 0.00 0.00 0.00 46.02 46.93 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 -2.47 0.46 0.28 1.61 1.02 -1.26 -5.00 119.74 114.38 2dlk s LYS 48 Ca 0.31 0.07 0.08 0.00 0.02 0.00 0.00 55.97 56.45 2dlk s LYS 48 Cb -0.05 -0.69 -0.04 0.00 -0.52 0.00 0.00 37.83 36.54 2dlk s LYS 48 CO 0.81 -0.18 0.18 -1.12 -0.92 0.00 0.00 175.35 174.11 2dlk s SER 49 N 1.34 5.23 0.21 2.83 0.01 -1.26 0.20 113.70 122.25 2dlk s SER 49 Ca -0.05 -0.41 -0.14 0.00 1.31 0.00 0.00 55.95 56.65 2dlk s SER 49 Cb -0.13 -1.16 0.01 0.00 0.21 0.00 0.00 66.02 64.95 2dlk s SER 49 CO -0.02 -0.12 0.47 -0.36 0.41 0.00 0.00 173.24 173.62 2dlk s PHE 50 N -2.23 0.13 -0.15 2.43 0.08 0.69 -4.97 117.98 113.96 2dlk s PHE 50 Ca 0.35 -0.50 -0.12 0.00 0.12 0.00 0.00 56.93 56.78 2dlk s PHE 50 Cb -0.07 0.26 -0.08 0.00 -0.57 0.00 0.00 43.02 42.55 2dlk s PHE 50 CO 0.24 -0.92 0.03 -0.97 -0.10 0.00 0.00 175.22 173.50 2dlk h ASN 51 N 2.28 0.00 -1.84 1.36 -1.24 -1.93 -2.68 115.58 111.53 2dlk h ASN 51 Ca -0.28 -0.21 -0.52 0.00 0.71 0.00 0.00 56.30 56.01 2dlk h ASN 51 Cb 1.25 0.00 -0.05 0.00 0.73 0.00 0.00 38.32 40.25 2dlk h ASN 51 CO 0.38 0.91 -0.48 -0.36 -1.29 0.00 0.00 177.43 176.59 2dlk s PHE 52 N -2.15 2.81 0.14 0.67 0.08 -1.26 -3.43 117.98 114.84 2dlk s PHE 52 Ca -0.16 -0.35 -0.12 0.00 0.12 0.00 0.00 56.93 56.42 2dlk s PHE 52 Cb 0.02 -1.76 -0.02 0.00 -0.57 0.00 0.00 43.02 40.70 2dlk s PHE 52 CO 0.31 0.23 1.53 -0.22 -0.10 0.00 0.00 175.22 176.97 2dlk h LYS 53 N 1.36 0.86 -0.98 0.44 1.63 -1.96 -3.16 116.57 114.77 2dlk h LYS 53 Ca -0.44 -0.36 0.22 0.00 -0.85 0.00 0.00 60.65 59.22 2dlk h LYS 53 Cb 1.25 -0.03 -0.18 0.00 -0.60 0.00 0.00 32.23 32.67 2dlk h LYS 53 CO 0.60 1.00 -0.15 1.57 -3.45 0.00 0.00 179.45 179.03 2dlk h LYS 54 N 0.69 0.00 -0.61 1.90 2.10 -2.00 1.05 116.57 119.71 2dlk h LYS 54 Ca 0.10 -0.00 -0.07 0.00 -2.00 0.00 0.00 60.65 58.68 2dlk h LYS 54 Cb 0.72 -0.00 -0.03 0.00 -0.90 0.00 0.00 32.23 32.02 2dlk h LYS 54 CO 0.05 0.00 0.09 0.45 -2.00 0.00 0.00 179.45 178.05 2dlk h HIS 55 N 0.00 1.05 -0.41 0.07 3.86 -1.98 -2.67 115.15 115.06 2dlk h HIS 55 Ca 0.51 -0.13 -0.06 0.00 -1.16 0.00 0.00 60.37 59.53 2dlk h HIS 55 Cb 0.88 -0.29 -0.02 0.00 1.06 0.00 0.00 27.41 29.04 2dlk h HIS 55 CO -0.66 0.89 0.01 1.25 0.86 0.00 0.00 177.93 180.28 2dlk h LEU 56 N 0.93 0.62 0.92 2.43 5.85 0.98 -2.77 115.31 124.27 2dlk h LEU 56 Ca 0.19 -0.13 -0.05 0.00 0.84 0.00 0.00 57.88 58.73 2dlk h LEU 56 Cb 0.41 -0.16 0.01 0.00 0.37 0.00 0.00 40.66 41.29 2dlk h LEU 56 CO 0.01 0.68 -0.44 0.50 -0.34 0.00 0.00 178.44 178.85 2dlk h LYS 57 N 0.63 -1.19 -0.33 1.25 1.63 -0.36 0.38 116.57 118.58 2dlk h LYS 57 Ca 0.13 0.08 0.10 0.00 -0.85 0.00 0.00 60.65 60.11 2dlk h LYS 57 Cb 0.37 0.27 -0.01 0.00 -0.60 0.00 0.00 32.23 32.26 2dlk h LYS 57 CO 0.01 -0.79 0.43 1.05 -3.45 0.00 0.00 179.45 176.70 2dlk h GLU 58 N -1.26 0.00 0.00 1.90 4.11 -1.50 0.36 114.58 118.19 2dlk h GLU 58 Ca -0.13 0.00 -0.26 0.00 0.07 0.00 0.00 59.36 59.04 2dlk h GLU 58 Cb 0.95 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 30.15 2dlk h GLU 58 CO 0.21 0.00 -1.47 1.25 0.07 0.00 0.00 179.01 179.07 2dlk h HIS 59 N 0.00 0.00 -0.09 2.06 2.76 -1.13 -3.33 115.15 115.42 2dlk h HIS 59 Ca 0.16 0.00 -0.02 0.00 -2.20 0.00 0.00 60.37 58.31 2dlk h HIS 59 Cb 1.01 0.00 -0.00 0.00 1.55 0.00 0.00 27.41 29.97 2dlk h HIS 59 CO 0.00 0.98 -0.02 0.52 -1.30 0.00 0.00 177.93 178.11 2dlk h MET 60 N 0.00 0.18 -0.67 5.26 2.86 0.39 -2.95 114.93 119.99 2dlk h MET 60 Ca -0.19 -0.07 0.14 0.00 -2.06 0.00 0.00 59.70 57.52 2dlk h MET 60 Cb 1.92 -0.01 -0.04 0.00 0.06 0.00 0.00 31.60 33.53 2dlk h MET 60 CO 0.09 0.48 0.45 1.57 1.06 0.00 0.00 176.91 180.57 2dlk h LYS 61 N -0.14 0.32 0.00 1.72 2.10 -1.53 0.20 116.57 119.24 2dlk h LYS 61 Ca 0.02 -0.02 -0.01 0.00 -2.00 0.00 0.00 60.65 58.65 2dlk h LYS 61 Cb 0.41 -0.07 -0.00 0.00 -0.90 0.00 0.00 32.23 31.67 2dlk h LYS 61 CO 0.01 0.21 -0.03 -0.07 -2.00 0.00 0.00 179.45 177.58 2dlk h LEU 62 N 0.33 0.00 0.00 7.07 3.38 -1.63 0.58 115.31 125.04 2dlk h LEU 62 Ca 0.32 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.29 2dlk h LEU 62 Cb 0.80 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.55 2dlk h LEU 62 CO -0.08 0.03 0.00 1.41 0.09 0.00 0.00 178.44 179.88 2dlk n HIS 63 N -3.73 0.00 -0.38 1.13 8.25 0.69 -4.16 115.22 117.02 2dlk n HIS 63 Ca -0.03 0.00 -0.03 0.00 -0.26 0.00 0.00 57.72 57.40 2dlk n HIS 63 Cb 0.11 0.00 0.02 0.00 1.12 0.00 0.00 29.99 31.24 2dlk n HIS 63 CO 0.00 0.00 0.00 1.03 0.64 0.00 0.00 176.34 178.01 2dlk h SER 64 N 0.00 -1.54 -1.93 0.41 0.87 -0.98 -3.37 113.55 107.00 2dlk h SER 64 Ca 0.00 0.31 -0.61 0.00 -1.23 0.00 0.00 61.79 60.26 2dlk h SER 64 Cb 0.00 0.78 0.01 0.00 -0.44 0.00 0.00 62.40 62.75 2dlk h SER 64 CO 0.00 -0.28 1.24 -0.90 -0.53 0.00 0.00 176.83 176.35 2dlk n ASP 65 N -5.44 3.34 -0.09 6.23 5.75 -1.26 -4.87 116.55 120.22 2dlk n ASP 65 Ca 0.09 0.75 -0.12 0.00 -0.01 0.00 0.00 54.79 55.49 2dlk n ASP 65 Cb 0.38 -1.41 -0.05 0.00 -1.03 0.00 0.00 41.12 39.01 2dlk n ASP 65 CO 0.00 0.00 0.00 0.71 -0.11 0.00 0.00 177.20 177.80 2dlk h THR 66 N 6.03 1.29 -1.68 2.12 1.35 -1.97 -3.41 112.91 116.62 2dlk h THR 66 Ca -0.44 -1.12 -0.55 0.00 -0.55 0.00 0.00 66.41 63.74 2dlk h THR 66 Cb 1.27 1.50 -0.00 0.00 -1.73 0.00 0.00 68.15 69.19 2dlk h THR 66 CO 0.96 0.35 1.55 -1.14 -0.25 0.00 0.00 175.52 176.99 2dlk n ARG 67 N -4.52 1.48 -0.09 4.72 0.63 -1.26 -4.79 116.66 112.82 2dlk n ARG 67 Ca -0.04 0.30 -0.22 0.00 -0.92 0.00 0.00 57.85 56.97 2dlk n ARG 67 Cb 0.32 -3.17 -0.12 0.00 0.45 0.00 0.00 32.46 29.94 2dlk n ARG 67 CO 0.00 0.00 0.00 -0.25 -2.51 0.00 0.00 177.63 174.87 2dlk n ASP 68 N 12.96 2.00 -3.95 6.15 8.00 -1.26 -4.99 116.55 135.46 2dlk n ASP 68 Ca 0.35 0.11 -0.12 0.00 0.71 0.00 0.00 54.79 55.84 2dlk n ASP 68 Cb 0.44 -0.67 -0.13 0.00 -0.02 0.00 0.00 41.12 40.75 2dlk n ASP 68 CO 0.00 0.00 0.00 -0.47 -0.39 0.00 0.00 177.20 176.34 2dlk s TYR 69 N -2.51 0.26 0.38 1.24 6.14 -1.26 -5.14 117.35 116.46 2dlk s TYR 69 Ca -0.32 -0.25 -0.27 0.00 0.64 0.00 0.00 57.07 56.87 2dlk s TYR 69 Cb 0.09 -0.17 -0.10 0.00 0.42 0.00 0.00 41.96 42.21 2dlk s TYR 69 CO 0.62 -0.07 1.38 0.42 0.64 0.00 0.00 175.55 178.54 2dlk s ILE 70 N -0.66 2.40 0.13 3.14 -1.09 -1.26 -5.02 121.20 118.84 2dlk s ILE 70 Ca -0.06 0.38 0.00 0.00 -2.23 0.00 0.00 60.65 58.74 2dlk s ILE 70 Cb -0.05 -3.23 -0.04 0.00 -1.58 0.00 0.00 42.46 37.56 2dlk s ILE 70 CO -0.00 0.08 0.29 0.00 -1.23 0.00 0.00 174.94 174.07 2dlk s GLU 72 N -2.94 2.57 0.05 0.00 0.41 -1.26 -5.01 118.70 112.51 2dlk s GLU 72 Ca 0.36 1.04 -0.24 0.00 -0.41 0.00 0.00 54.97 55.72 2dlk s GLU 72 Cb -0.12 -1.94 -0.06 0.00 -1.78 0.00 0.00 34.13 30.23 2dlk s GLU 72 CO 0.28 -1.39 0.75 -0.59 -0.49 0.00 0.00 175.26 173.82 2dlk s PHE 73 N -2.98 3.74 -0.00 1.61 -0.71 -1.26 -4.99 117.98 113.39 2dlk s PHE 73 Ca 0.60 1.45 -0.25 0.00 -1.04 0.00 0.00 56.93 57.68 2dlk s PHE 73 Cb -0.16 -2.79 -0.19 0.00 -1.21 0.00 0.00 43.02 38.67 2dlk s PHE 73 CO 0.55 0.30 1.33 0.77 -1.34 0.00 0.00 175.22 176.84 2dlk h SER 74 N 5.57 -0.01 0.00 1.98 0.02 -2.04 -3.49 113.55 115.57 2dlk h SER 74 Ca -0.44 -0.40 0.00 0.00 -0.84 0.00 0.00 61.79 60.10 2dlk h SER 74 Cb 1.20 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.75 2dlk h SER 74 CO 0.70 0.40 0.00 0.61 -1.14 0.00 0.00 176.83 177.40 2dlk n GLY 75 N 0.02 3.54 0.00 -3.77 0.00 -1.26 -4.93 105.19 98.79 2dlk n GLY 75 Ca -0.08 -0.84 0.06 0.00 0.00 0.00 0.00 46.02 45.17 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 -0.35 1.61 -0.04 -1.26 -4.07 135.00 131.37 2dlk n PRO 76 Ca 0.00 0.00 -0.07 0.00 -0.04 0.00 0.00 63.50 63.39 2dlk n PRO 76 Cb 0.00 -1.42 -0.06 0.00 -0.04 0.00 0.00 33.50 31.99 2dlk n PRO 76 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 2dlk n SER 77 N -0.92 -0.82 -4.39 3.54 3.41 -1.26 -4.63 113.62 108.55 2dlk n SER 77 Ca 0.10 1.50 -0.20 0.00 -0.26 0.00 0.00 58.87 60.00 2dlk n SER 77 Cb 0.04 -0.23 -0.10 0.00 -0.26 0.00 0.00 64.21 63.66 2dlk n SER 77 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2dlk s SER 78 N -5.40 2.04 0.00 4.04 1.04 -1.26 -5.33 113.70 108.84 2dlk s SER 78 Ca -0.10 -1.40 0.27 0.00 0.48 0.00 0.00 55.95 55.20 2dlk s SER 78 Cb 0.11 0.02 0.90 0.00 0.10 0.00 0.00 66.02 67.15 2dlk s SER 78 CO 0.54 -0.66 1.66 0.61 0.98 0.00 0.00 173.24 176.37