#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 -1.43 0.10 1.61 0.02 -2.02 0.67 113.55 112.50 2dlk h SER 2 Ca 0.00 0.20 0.00 0.00 -0.84 0.00 0.00 61.79 61.15 2dlk h SER 2 Cb 0.00 0.60 0.00 0.00 0.14 0.00 0.00 62.40 63.14 2dlk h SER 2 CO 0.00 -0.40 0.00 -1.54 -1.14 0.00 0.00 176.83 173.75 2dlk n SER 3 N -5.42 0.00 -3.96 3.07 3.41 -1.26 -4.13 113.62 105.33 2dlk n SER 3 Ca -0.02 -0.36 -0.31 0.00 -0.26 0.00 0.00 58.87 57.92 2dlk n SER 3 Cb 0.36 -0.09 -0.12 0.00 -0.26 0.00 0.00 64.21 64.10 2dlk n SER 3 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 2dlk s GLY 4 N -2.18 2.77 0.00 5.00 0.00 0.24 -4.88 107.32 108.27 2dlk s GLY 4 Ca 0.23 -3.62 0.30 0.00 0.00 0.00 0.00 44.72 41.64 2dlk s GLY 4 CO 0.22 1.08 2.05 -1.14 0.00 0.00 0.00 173.10 175.31 2dlk n SER 5 N 2.51 0.24 -4.95 1.64 3.41 -1.25 -3.39 113.62 111.83 2dlk n SER 5 Ca 0.14 -0.71 -0.24 0.00 -0.26 0.00 0.00 58.87 57.81 2dlk n SER 5 Cb 0.35 -0.09 -0.02 0.00 -0.26 0.00 0.00 64.21 64.18 2dlk n SER 5 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2dlk s SER 6 N -2.27 6.32 -0.01 4.04 1.04 -1.26 -5.12 113.70 116.45 2dlk s SER 6 Ca 0.37 0.32 -0.10 0.00 0.48 0.00 0.00 55.95 57.03 2dlk s SER 6 Cb 0.21 -1.97 0.01 0.00 0.10 0.00 0.00 66.02 64.37 2dlk s SER 6 CO 0.42 -0.18 0.20 -0.83 0.98 0.00 0.00 173.24 173.83 2dlk s GLY 7 N -3.85 -0.04 -0.03 7.32 0.00 -1.26 -4.37 107.32 105.09 2dlk s GLY 7 Ca 0.38 0.09 0.06 0.00 0.00 0.00 0.00 44.72 45.25 2dlk s GLY 7 CO 0.32 -0.07 -0.22 1.06 0.00 0.00 0.00 173.10 174.20 2dlk s MET 8 N -1.24 1.95 0.98 2.90 1.00 0.11 -4.88 119.30 120.13 2dlk s MET 8 Ca -0.13 -0.78 -0.12 0.00 0.00 0.00 0.00 55.69 54.65 2dlk s MET 8 Cb -0.06 -1.79 0.18 0.00 0.00 0.00 0.00 34.83 33.15 2dlk s MET 8 CO 0.02 0.41 1.09 -1.25 0.00 0.00 0.00 175.02 175.30 2dlk s PRO 9 N -0.34 0.55 -0.28 2.03 0.04 -1.26 -1.06 135.00 134.68 2dlk s PRO 9 Ca 0.04 0.57 -0.28 0.00 0.04 0.00 0.00 61.00 61.37 2dlk s PRO 9 Cb -0.10 -1.75 0.01 0.00 0.04 0.00 0.00 34.50 32.70 2dlk s PRO 9 CO 0.01 -2.66 1.00 0.00 0.04 0.00 0.00 177.00 175.39 2dlk h ASP 11 N 7.86 0.03 -2.97 0.00 3.32 -1.93 -3.40 116.42 119.32 2dlk h ASP 11 Ca -0.21 0.24 -0.52 0.00 0.02 0.00 0.00 57.03 56.56 2dlk h ASP 11 Cb 1.07 0.31 0.07 0.00 0.22 0.00 0.00 39.33 41.00 2dlk h ASP 11 CO 0.98 -0.29 0.95 0.12 -1.72 0.00 0.00 179.24 179.28 2dlk s PHE 12 N -5.80 2.85 0.68 4.55 5.36 -1.26 -4.97 117.98 119.40 2dlk s PHE 12 Ca -0.11 0.56 -0.14 0.00 -0.96 0.00 0.00 56.93 56.27 2dlk s PHE 12 Cb 0.30 -4.09 0.01 0.00 -0.34 0.00 0.00 43.02 38.90 2dlk s PHE 12 CO 0.78 -3.94 1.11 -1.25 -1.46 0.00 0.00 175.22 170.46 2dlk s PRO 13 N 0.43 2.69 0.00 10.12 0.04 -1.26 -3.77 135.00 143.25 2dlk s PRO 13 Ca 0.69 1.34 0.00 0.00 0.04 0.00 0.00 61.00 63.08 2dlk s PRO 13 Cb -0.48 -1.94 0.00 0.00 0.04 0.00 0.00 34.50 32.12 2dlk s PRO 13 CO 0.39 -1.33 0.00 0.41 0.04 0.00 0.00 177.00 176.51 2dlk n GLY 14 N -0.67 1.19 0.28 0.56 0.00 -1.26 -4.67 105.19 100.62 2dlk n GLY 14 Ca 0.10 -0.01 0.01 0.00 0.00 0.00 0.00 46.02 46.12 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 -1.39 -0.40 3.59 0.00 0.00 -1.26 -5.01 105.19 100.73 2dlk n GLY 16 Ca 0.09 0.14 -0.31 0.00 0.00 0.00 0.00 46.02 45.94 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 -5.69 2.39 0.06 1.61 1.81 -1.26 -4.93 118.95 112.93 2dlk s ARG 17 Ca 0.16 -0.85 0.07 0.00 -1.72 0.00 0.00 55.73 53.38 2dlk s ARG 17 Cb -0.07 -2.42 -0.03 0.00 -0.45 0.00 0.00 34.95 31.98 2dlk s ARG 17 CO 0.74 0.56 -0.18 0.42 -0.68 0.00 0.00 175.30 176.16 2dlk s ILE 18 N -1.10 1.46 0.04 1.52 -1.09 -1.26 0.25 121.20 121.03 2dlk s ILE 18 Ca 0.19 -1.25 -0.02 0.00 -2.23 0.00 0.00 60.65 57.34 2dlk s ILE 18 Cb -0.11 -1.31 -0.03 0.00 -1.58 0.00 0.00 42.46 39.43 2dlk s ILE 18 CO 0.11 0.03 0.00 -0.36 -1.23 0.00 0.00 174.94 173.49 2dlk s PHE 19 N -0.97 0.39 -0.13 3.97 0.40 -0.23 -4.93 117.98 116.48 2dlk s PHE 19 Ca 0.04 -0.83 -0.15 0.00 -0.60 0.00 0.00 56.93 55.39 2dlk s PHE 19 Cb -0.09 -0.29 -0.25 0.00 0.51 0.00 0.00 43.02 42.90 2dlk s PHE 19 CO 0.02 -0.34 0.43 0.66 0.70 0.00 0.00 175.22 176.69 2dlk h SER 20 N 3.56 0.29 -2.97 1.36 4.64 -1.87 0.32 113.55 118.87 2dlk h SER 20 Ca -0.33 -0.80 -0.66 0.00 -0.47 0.00 0.00 61.79 59.53 2dlk h SER 20 Cb 1.17 -0.09 -0.11 0.00 -0.31 0.00 0.00 62.40 63.06 2dlk h SER 20 CO 0.57 1.63 -0.53 0.20 -0.87 0.00 0.00 176.83 177.84 2dlk s ASN 21 N -6.97 5.99 0.27 4.97 -0.87 -1.26 -4.67 114.94 112.39 2dlk s ASN 21 Ca -0.23 0.31 -0.04 0.00 -1.57 0.00 0.00 52.86 51.33 2dlk s ASN 21 Cb 0.05 -1.92 0.33 0.00 -0.02 0.00 0.00 41.25 39.69 2dlk s ASN 21 CO 0.72 0.34 1.92 -0.09 -2.57 0.00 0.00 177.10 177.42 2dlk h ARG 22 N 5.48 1.18 -0.62 -0.60 1.12 -1.99 -2.66 114.38 116.30 2dlk h ARG 22 Ca -0.50 -0.10 0.13 0.00 -1.11 0.00 0.00 59.98 58.40 2dlk h ARG 22 Cb 1.20 -0.25 -0.11 0.00 -0.01 0.00 0.00 29.97 30.80 2dlk h ARG 22 CO 0.61 0.82 -0.02 0.37 -3.11 0.00 0.00 179.97 178.64 2dlk h GLN 23 N 1.20 0.10 -0.56 0.20 4.15 -2.00 -0.13 115.11 118.07 2dlk h GLN 23 Ca 0.32 -0.01 -0.06 0.00 0.77 0.00 0.00 58.65 59.67 2dlk h GLN 23 Cb -0.06 -0.02 -0.02 0.00 0.21 0.00 0.00 27.48 27.58 2dlk h GLN 23 CO -0.06 0.06 0.13 -0.92 -1.93 0.00 0.00 178.83 176.11 2dlk h TYR 24 N 0.10 0.95 -0.55 3.99 5.03 -1.91 -1.42 116.97 123.16 2dlk h TYR 24 Ca 0.32 -0.12 0.08 0.00 2.58 0.00 0.00 58.73 61.60 2dlk h TYR 24 Cb 0.52 -0.27 -0.07 0.00 1.55 0.00 0.00 36.73 38.47 2dlk h TYR 24 CO -0.39 0.82 0.19 1.25 -1.32 0.00 0.00 178.16 178.71 2dlk h LEU 25 N 0.80 0.17 -0.22 2.82 5.85 -0.85 0.43 115.31 124.31 2dlk h LEU 25 Ca 0.17 0.07 -0.07 0.00 0.84 0.00 0.00 57.88 58.90 2dlk h LEU 25 Cb 0.36 0.06 -0.01 0.00 0.37 0.00 0.00 40.66 41.45 2dlk h LEU 25 CO 0.00 0.12 -0.12 -1.13 -0.34 0.00 0.00 178.44 176.97 2dlk h ASN 26 N 0.36 0.49 -0.48 1.25 -0.73 -1.06 -2.70 115.58 112.72 2dlk h ASN 26 Ca 0.27 -0.42 -0.02 0.00 1.87 0.00 0.00 56.30 58.00 2dlk h ASN 26 Cb 0.32 -0.14 -0.03 0.00 0.27 0.00 0.00 38.32 38.75 2dlk h ASN 26 CO -0.28 0.81 0.25 -0.74 -0.37 0.00 0.00 177.43 177.09 2dlk h HIS 27 N 0.18 0.71 -0.37 0.67 2.76 -0.71 -0.24 115.15 118.15 2dlk h HIS 27 Ca 0.05 -0.02 -0.03 0.00 -2.20 0.00 0.00 60.37 58.17 2dlk h HIS 27 Cb 0.63 -0.23 -0.02 0.00 1.55 0.00 0.00 27.41 29.35 2dlk h HIS 27 CO 0.07 0.52 0.11 1.25 -1.30 0.00 0.00 177.93 178.57 2dlk h HIS 28 N 0.72 0.60 -0.39 5.26 -0.00 -0.05 0.44 115.15 121.73 2dlk h HIS 28 Ca 0.18 -0.07 -0.14 0.00 -0.00 0.00 0.00 60.37 60.34 2dlk h HIS 28 Cb 0.07 -0.17 -0.01 0.00 -0.00 0.00 0.00 27.41 27.30 2dlk h HIS 28 CO 0.01 0.59 -0.32 0.87 -0.00 0.00 0.00 177.93 179.07 2dlk h LYS 29 N 0.45 0.91 0.00 5.26 1.57 -1.13 0.60 116.57 124.23 2dlk h LYS 29 Ca 0.12 -0.45 -0.02 0.00 -1.87 0.00 0.00 60.65 58.43 2dlk h LYS 29 Cb 0.27 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.58 2dlk h LYS 29 CO -0.00 1.11 -0.08 -0.22 -0.57 0.00 0.00 179.45 179.68 2dlk h LYS 30 N 0.72 0.00 0.00 3.15 3.64 -0.94 -0.99 116.57 122.16 2dlk h LYS 30 Ca 0.07 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.45 2dlk h LYS 30 Cb 0.90 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.72 2dlk h LYS 30 CO 0.08 0.08 -0.17 0.66 -2.27 0.00 0.00 179.45 177.84 2dlk n TYR 31 N -3.23 0.04 0.51 1.91 4.02 0.13 -3.66 117.16 116.89 2dlk n TYR 31 Ca 0.00 0.02 -0.20 0.00 -0.01 0.00 0.00 57.90 57.71 2dlk n TYR 31 Cb 0.34 -0.16 -0.09 0.00 -0.02 0.00 0.00 39.34 39.41 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 -0.19 -1.24 0.00 -0.72 1.08 0.07 -2.43 115.11 111.68 2dlk h GLN 32 Ca 0.00 0.08 0.00 0.00 -1.45 0.00 0.00 58.65 57.28 2dlk h GLN 32 Cb 0.17 0.28 0.00 0.00 -0.05 0.00 0.00 27.48 27.88 2dlk h GLN 32 CO 0.00 -0.83 0.00 0.72 -0.95 0.00 0.00 178.83 177.77 2dlk n HIS 33 N -5.51 0.00 -0.43 2.96 8.25 -0.72 -4.25 115.22 115.52 2dlk n HIS 33 Ca -0.16 0.00 0.35 0.00 -0.26 0.00 0.00 57.72 57.65 2dlk n HIS 33 Cb 0.51 0.00 0.56 0.00 1.12 0.00 0.00 29.99 32.18 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 -0.52 -0.13 -4.72 1.59 0.13 -0.45 -4.37 119.36 110.88 2dlk n ILE 34 Ca 0.01 1.31 -0.32 0.00 -1.10 0.00 0.00 62.75 62.65 2dlk n ILE 34 Cb 0.01 -2.15 -0.08 0.00 -0.84 0.00 0.00 39.64 36.57 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 -4.71 1.89 0.17 9.51 -3.43 -1.26 -4.99 115.29 112.47 2dlk s HIS 35 Ca -0.05 -0.99 -0.08 0.00 -0.80 0.00 0.00 55.06 53.14 2dlk s HIS 35 Cb 0.23 -1.56 -0.06 0.00 -1.43 0.00 0.00 32.58 29.76 2dlk s HIS 35 CO 0.65 0.17 0.47 1.14 -2.00 0.00 0.00 174.74 175.17 2dlk s GLN 36 N -3.85 3.75 -0.14 -0.38 1.03 -1.26 -5.01 119.66 113.81 2dlk s GLN 36 Ca 0.10 0.16 0.06 0.00 0.04 0.00 0.00 55.36 55.72 2dlk s GLN 36 Cb 0.02 -2.79 -0.12 0.00 0.03 0.00 0.00 33.01 30.15 2dlk s GLN 36 CO 0.05 0.41 -0.05 1.63 -2.54 0.00 0.00 175.29 174.80 2dlk n LYS 37 N 0.17 1.21 -1.66 9.60 4.01 -1.26 -4.99 118.16 125.24 2dlk n LYS 37 Ca -0.02 0.04 -0.50 0.00 -0.51 0.00 0.00 58.31 57.32 2dlk n LYS 37 Cb 0.52 -1.30 -0.05 0.00 -0.51 0.00 0.00 35.03 33.68 2dlk n LYS 37 CO 0.00 0.00 0.00 0.45 -1.11 0.00 0.00 177.40 176.74 2dlk n SER 38 N -2.70 2.67 -4.41 4.39 2.88 -1.13 -4.55 113.62 110.77 2dlk n SER 38 Ca -0.23 1.07 -0.44 0.00 -1.33 0.00 0.00 58.87 57.93 2dlk n SER 38 Cb 0.84 -1.30 -0.08 0.00 -0.75 0.00 0.00 64.21 62.91 2dlk n SER 38 CO 0.00 0.00 0.00 0.12 -1.23 0.00 0.00 175.04 173.93 2dlk s PHE 39 N 1.97 3.24 0.26 0.66 2.19 -0.84 -4.88 117.98 120.57 2dlk s PHE 39 Ca 0.87 -0.80 -0.27 0.00 0.33 0.00 0.00 56.93 57.06 2dlk s PHE 39 Cb -0.82 -2.97 -0.09 0.00 -1.31 0.00 0.00 43.02 37.83 2dlk s PHE 39 CO 0.48 -0.73 0.91 0.45 1.83 0.00 0.00 175.22 178.16 2dlk s SER 40 N 2.27 7.48 0.13 6.13 0.15 -1.26 -3.13 113.70 125.46 2dlk s SER 40 Ca 0.05 1.84 -0.30 0.00 0.70 0.00 0.00 55.95 58.24 2dlk s SER 40 Cb -0.22 -2.57 -0.06 0.00 -1.71 0.00 0.00 66.02 61.45 2dlk s SER 40 CO 0.08 0.08 1.06 0.00 1.20 0.00 0.00 173.24 175.66 2dlk n PRO 42 N 2.82 0.33 -3.38 0.00 -0.04 -1.26 -4.68 135.00 128.78 2dlk n PRO 42 Ca 0.04 0.08 -0.38 0.00 -0.04 0.00 0.00 63.50 63.20 2dlk n PRO 42 Cb 0.47 -1.50 -0.07 0.00 -0.04 0.00 0.00 33.50 32.37 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 -2.33 4.29 -0.02 0.54 0.41 -1.26 -5.00 118.70 115.33 2dlk s GLU 43 Ca 0.18 0.31 -0.25 0.00 -0.41 0.00 0.00 54.97 54.80 2dlk s GLU 43 Cb 0.10 -3.46 -0.20 0.00 -1.78 0.00 0.00 34.13 28.80 2dlk s GLU 43 CO 0.21 0.13 1.22 -1.00 -0.49 0.00 0.00 175.26 175.33 2dlk h PRO 44 N 6.85 -0.06 -0.75 0.39 0.13 -2.00 0.22 132.00 136.78 2dlk h PRO 44 Ca -0.40 0.00 0.06 0.00 -0.87 0.00 0.00 66.00 64.80 2dlk h PRO 44 Cb 1.17 0.01 -0.06 0.00 0.13 0.00 0.00 31.00 32.26 2dlk h PRO 44 CO 0.75 0.40 0.45 0.00 -0.23 0.00 0.00 178.00 179.37 2dlk h ALA 45 N 0.36 1.02 0.11 -0.56 0.00 -1.98 -2.96 119.26 115.26 2dlk h ALA 45 Ca -0.01 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 2dlk h ALA 45 Cb 0.49 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.11 2dlk h ALA 45 CO 0.01 0.15 -0.05 0.00 0.00 0.00 0.00 179.25 179.36 2dlk n GLY 47 N 0.41 -0.69 2.74 0.00 0.00 0.07 -4.96 105.19 102.76 2dlk n GLY 47 Ca -0.08 0.62 -0.20 0.00 0.00 0.00 0.00 46.02 46.36 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 -3.65 0.19 0.22 1.61 1.02 -1.26 -5.01 119.74 112.85 2dlk s LYS 48 Ca 0.09 0.22 0.05 0.00 0.02 0.00 0.00 55.97 56.35 2dlk s LYS 48 Cb -0.01 -0.59 -0.03 0.00 -0.52 0.00 0.00 37.83 36.68 2dlk s LYS 48 CO 0.71 -0.26 0.28 -1.54 -0.92 0.00 0.00 175.35 173.62 2dlk s SER 49 N 1.74 6.05 -0.04 2.83 1.04 -1.26 -2.89 113.70 121.15 2dlk s SER 49 Ca 0.00 -0.01 -0.01 0.00 0.48 0.00 0.00 55.95 56.41 2dlk s SER 49 Cb -0.13 -1.71 0.03 0.00 0.10 0.00 0.00 66.02 64.31 2dlk s SER 49 CO -0.03 -0.03 0.01 -0.36 0.98 0.00 0.00 173.24 173.81 2dlk s PHE 50 N -1.95 0.37 0.26 5.02 0.40 -1.18 -4.97 117.98 115.91 2dlk s PHE 50 Ca 0.33 0.00 -0.09 0.00 -0.60 0.00 0.00 56.93 56.58 2dlk s PHE 50 Cb -0.09 -0.54 0.41 0.00 0.51 0.00 0.00 43.02 43.30 2dlk s PHE 50 CO 0.27 -0.20 1.46 -1.71 0.70 0.00 0.00 175.22 175.75 2dlk n ASN 51 N 4.66 -0.37 -4.83 1.36 5.15 -1.26 -1.99 115.26 117.98 2dlk n ASN 51 Ca -0.16 1.62 -0.25 0.00 -0.60 0.00 0.00 54.58 55.18 2dlk n ASN 51 Cb 0.50 -0.47 -0.04 0.00 -0.53 0.00 0.00 39.78 39.24 2dlk n ASN 51 CO 0.00 0.00 0.00 -0.36 1.40 0.00 0.00 177.26 178.30 2dlk s PHE 52 N -6.14 2.19 -0.06 1.20 0.40 -1.26 -2.81 117.98 111.48 2dlk s PHE 52 Ca -0.14 -0.70 -0.10 0.00 -0.60 0.00 0.00 56.93 55.40 2dlk s PHE 52 Cb 0.25 -1.95 -0.30 0.00 0.51 0.00 0.00 43.02 41.53 2dlk s PHE 52 CO 0.72 -0.12 0.60 0.87 0.70 0.00 0.00 175.22 177.99 2dlk h LYS 53 N 1.09 0.36 -1.70 0.44 6.56 -1.80 -3.35 116.57 118.17 2dlk h LYS 53 Ca -0.40 -0.61 0.49 0.00 -1.06 0.00 0.00 60.65 59.07 2dlk h LYS 53 Cb 1.28 0.23 -0.07 0.00 -0.57 0.00 0.00 32.23 33.10 2dlk h LYS 53 CO 0.63 1.29 1.30 0.36 -2.06 0.00 0.00 179.45 180.97 2dlk n LYS 54 N -3.56 0.00 0.01 3.15 2.85 -1.26 0.17 118.16 119.52 2dlk n LYS 54 Ca -0.26 0.99 -0.21 0.00 -1.05 0.00 0.00 58.31 57.78 2dlk n LYS 54 Cb 1.07 -2.33 -0.14 0.00 -0.65 0.00 0.00 35.03 32.99 2dlk n LYS 54 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 177.40 177.80 2dlk h HIS 55 N 0.00 0.43 0.58 5.58 3.86 -1.96 -3.35 115.15 120.28 2dlk h HIS 55 Ca 0.81 -0.31 -0.03 0.00 -1.16 0.00 0.00 60.37 59.68 2dlk h HIS 55 Cb 3.39 -0.02 0.01 0.00 1.06 0.00 0.00 27.41 31.85 2dlk h HIS 55 CO 0.00 1.50 -0.28 1.25 0.86 0.00 0.00 177.93 181.26 2dlk h LEU 56 N -0.36 -0.65 -0.84 2.43 7.12 0.16 0.21 115.31 123.37 2dlk h LEU 56 Ca -0.27 -0.02 0.15 0.00 0.13 0.00 0.00 57.88 57.86 2dlk h LEU 56 Cb 1.70 0.17 -0.15 0.00 -0.53 0.00 0.00 40.66 41.86 2dlk h LEU 56 CO 0.06 -0.39 -0.27 0.29 -0.13 0.00 0.00 178.44 178.00 2dlk n LYS 57 N -5.38 -0.14 0.01 1.25 4.76 0.20 -0.87 118.16 118.00 2dlk n LYS 57 Ca -0.12 1.30 -0.11 0.00 -2.87 0.00 0.00 58.31 56.51 2dlk n LYS 57 Cb 0.33 -1.94 -0.08 0.00 -1.84 0.00 0.00 35.03 31.51 2dlk n LYS 57 CO 0.00 0.00 0.00 0.93 -1.37 0.00 0.00 177.40 176.96 2dlk h GLU 58 N 0.00 -0.13 -0.83 1.97 4.39 -1.67 -3.33 114.58 114.98 2dlk h GLU 58 Ca 0.34 0.01 0.14 0.00 0.34 0.00 0.00 59.36 60.19 2dlk h GLU 58 Cb 0.55 0.03 -0.14 0.00 -0.10 0.00 0.00 28.75 29.09 2dlk h GLU 58 CO -0.85 0.37 -0.29 1.58 -1.16 0.00 0.00 179.01 178.67 2dlk n HIS 59 N -4.84 0.11 -0.27 4.33 -0.00 0.75 0.84 115.22 116.13 2dlk n HIS 59 Ca -0.07 1.02 0.01 0.00 -0.00 0.00 0.00 57.72 58.68 2dlk n HIS 59 Cb 0.28 -0.87 0.09 0.00 -0.00 0.00 0.00 29.99 29.49 2dlk n HIS 59 CO 0.00 0.00 0.00 0.52 -0.00 0.00 0.00 176.34 176.86 2dlk h MET 60 N 0.00 -0.01 -1.03 1.57 2.86 -1.11 0.51 114.93 117.72 2dlk h MET 60 Ca 0.32 0.00 0.27 0.00 -2.06 0.00 0.00 59.70 58.24 2dlk h MET 60 Cb 0.53 0.00 -0.12 0.00 0.06 0.00 0.00 31.60 32.07 2dlk h MET 60 CO -0.84 -0.01 0.62 0.87 1.06 0.00 0.00 176.91 178.62 2dlk h LYS 61 N -0.02 0.45 -0.96 1.72 1.57 0.30 0.25 116.57 119.89 2dlk h LYS 61 Ca 0.36 -0.03 0.20 0.00 -1.87 0.00 0.00 60.65 59.31 2dlk h LYS 61 Cb 0.57 -0.10 -0.11 0.00 0.08 0.00 0.00 32.23 32.67 2dlk h LYS 61 CO -0.81 0.30 0.55 1.37 -0.57 0.00 0.00 179.45 180.29 2dlk h LEU 62 N 0.46 0.66 -0.98 2.94 8.10 0.09 0.11 115.31 126.69 2dlk h LEU 62 Ca 0.66 0.11 0.15 0.00 0.11 0.00 0.00 57.88 58.91 2dlk h LEU 62 Cb 1.45 0.00 -0.09 0.00 -0.44 0.00 0.00 40.66 41.58 2dlk h LEU 62 CO -0.45 0.20 0.60 0.45 -4.11 0.00 0.00 178.44 175.12 2dlk h HIS 63 N 0.65 1.07 -4.05 0.17 3.86 -0.53 -3.42 115.15 112.90 2dlk h HIS 63 Ca 0.57 0.03 -0.55 0.00 -1.16 0.00 0.00 60.37 59.26 2dlk h HIS 63 Cb 0.93 -0.33 0.14 0.00 1.06 0.00 0.00 27.41 29.21 2dlk h HIS 63 CO -0.04 0.34 0.60 0.45 0.86 0.00 0.00 177.93 180.14 2dlk s SER 64 N -5.55 5.21 -0.25 2.45 0.15 0.39 -4.87 113.70 111.24 2dlk s SER 64 Ca -0.12 2.74 -0.28 0.00 0.70 0.00 0.00 55.95 58.99 2dlk s SER 64 Cb 0.23 -2.63 -0.04 0.00 -1.71 0.00 0.00 66.02 61.87 2dlk s SER 64 CO 0.80 -1.61 2.04 -1.81 1.20 0.00 0.00 173.24 173.86 2dlk s ASP 65 N -1.01 5.68 -0.20 5.45 1.01 -1.26 -4.96 116.67 121.38 2dlk s ASP 65 Ca 0.73 1.70 0.01 0.00 0.71 0.00 0.00 52.55 55.70 2dlk s ASP 65 Cb -0.40 -2.52 0.03 0.00 1.01 0.00 0.00 42.92 41.05 2dlk s ASP 65 CO 0.47 -1.81 -0.16 -0.89 0.21 0.00 0.00 175.17 172.99 2dlk s THR 66 N 7.55 2.00 -0.09 -1.27 2.01 -1.26 -5.02 115.64 119.55 2dlk s THR 66 Ca 0.92 -1.12 -0.01 0.00 0.31 0.00 0.00 61.69 61.79 2dlk s THR 66 Cb -0.29 -1.93 -0.00 0.00 0.01 0.00 0.00 72.50 70.28 2dlk s THR 66 CO 0.35 0.32 -0.02 -0.09 -0.69 0.00 0.00 174.62 174.49 2dlk h ARG 67 N 7.91 0.00 -7.26 4.92 9.65 -2.02 -3.46 114.38 124.12 2dlk h ARG 67 Ca -0.35 0.00 -0.52 0.00 -1.10 0.00 0.00 59.98 58.00 2dlk h ARG 67 Cb 1.11 0.00 0.17 0.00 -1.39 0.00 0.00 29.97 29.86 2dlk h ARG 67 CO 0.56 0.00 0.29 0.34 2.80 0.00 0.00 179.97 183.96 2dlk s ASP 68 N -5.32 3.62 -1.11 -3.80 2.15 -1.26 -3.68 116.67 107.27 2dlk s ASP 68 Ca -0.02 2.15 -0.03 0.00 0.43 0.00 0.00 52.55 55.08 2dlk s ASP 68 Cb 0.00 -2.56 0.00 0.00 -0.30 0.00 0.00 42.92 40.06 2dlk s ASP 68 CO 0.03 -2.64 0.94 0.00 -0.17 0.00 0.00 175.17 173.33 2dlk n TYR 69 N -3.66 -2.15 0.07 -5.34 9.36 -1.26 -4.92 117.16 109.25 2dlk n TYR 69 Ca 0.12 0.85 -0.06 0.00 3.32 0.00 0.00 57.90 62.12 2dlk n TYR 69 Cb 0.52 -4.66 -0.08 0.00 -0.63 0.00 0.00 39.34 34.49 2dlk n TYR 69 CO 0.00 0.00 0.00 0.97 0.22 0.00 0.00 176.86 178.05 2dlk h ILE 70 N -1.93 1.68 -6.19 2.97 6.09 -1.88 -3.48 117.51 114.77 2dlk h ILE 70 Ca -0.51 -3.24 -0.46 0.00 -1.37 0.00 0.00 64.86 59.28 2dlk h ILE 70 Cb 1.31 2.75 0.01 0.00 0.47 0.00 0.00 36.82 41.36 2dlk h ILE 70 CO 0.46 0.93 -0.74 0.00 -3.07 0.00 0.00 178.15 175.72 2dlk s GLU 72 N -6.51 4.74 0.26 0.00 -1.05 -1.26 -5.00 118.70 109.88 2dlk s GLU 72 Ca 0.61 1.59 -0.30 0.00 -0.15 0.00 0.00 54.97 56.72 2dlk s GLU 72 Cb -0.30 -3.28 -0.10 0.00 -0.44 0.00 0.00 34.13 30.02 2dlk s GLU 72 CO 0.81 0.33 1.42 0.12 0.95 0.00 0.00 175.26 178.89 2dlk s PHE 73 N -0.83 3.02 0.07 4.83 2.19 -1.26 -5.00 117.98 120.99 2dlk s PHE 73 Ca 0.44 1.08 -0.12 0.00 0.33 0.00 0.00 56.93 58.66 2dlk s PHE 73 Cb -0.27 -3.80 -0.06 0.00 -1.31 0.00 0.00 43.02 37.57 2dlk s PHE 73 CO 0.34 -2.56 0.44 -1.54 1.83 0.00 0.00 175.22 173.73 2dlk s SER 74 N 0.26 6.73 -0.03 6.13 1.04 -1.26 -4.99 113.70 121.57 2dlk s SER 74 Ca 0.58 0.90 -0.30 0.00 0.48 0.00 0.00 55.95 57.61 2dlk s SER 74 Cb -0.42 -2.22 -0.15 0.00 0.10 0.00 0.00 66.02 63.34 2dlk s SER 74 CO 0.45 0.20 0.82 0.61 0.98 0.00 0.00 173.24 176.30 2dlk n GLY 75 N 1.11 -0.18 3.55 7.32 0.00 -1.26 -4.73 105.19 111.01 2dlk n GLY 75 Ca -0.09 0.58 -0.35 0.00 0.00 0.00 0.00 46.02 46.15 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 0.19 2.61 0.97 1.61 0.04 -1.26 -4.97 135.00 134.19 2dlk s PRO 76 Ca 0.68 0.38 -0.11 0.00 0.04 0.00 0.00 61.00 61.99 2dlk s PRO 76 Cb -0.95 -4.56 0.17 0.00 0.04 0.00 0.00 34.50 29.20 2dlk s PRO 76 CO 0.44 -2.90 1.06 -1.13 0.04 0.00 0.00 177.00 174.51 2dlk n SER 77 N 13.07 -0.24 -3.79 6.66 3.41 -1.26 -5.04 113.62 126.43 2dlk n SER 77 Ca 0.25 0.30 -0.18 0.00 -0.26 0.00 0.00 58.87 58.98 2dlk n SER 77 Cb 0.51 -1.41 -0.17 0.00 -0.26 0.00 0.00 64.21 62.88 2dlk n SER 77 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 2dlk s SER 78 N -2.54 0.69 0.00 4.04 0.15 -1.26 -5.28 113.70 109.49 2dlk s SER 78 Ca 0.66 -0.02 0.17 0.00 0.70 0.00 0.00 55.95 57.47 2dlk s SER 78 Cb -0.23 -0.24 0.14 0.00 -1.71 0.00 0.00 66.02 63.97 2dlk s SER 78 CO 0.60 -0.13 1.05 0.61 1.20 0.00 0.00 173.24 176.57