#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 4.68 0.16 1.61 1.04 -1.26 -5.03 113.70 114.91 2dlk s SER 2 Ca 0.00 -1.09 -0.31 0.00 0.48 0.00 0.00 55.95 55.04 2dlk s SER 2 Cb 0.00 -0.04 -0.07 0.00 0.10 0.00 0.00 66.02 66.02 2dlk s SER 2 CO 0.00 -0.86 1.54 -1.28 0.98 0.00 0.00 173.24 173.62 2dlk h SER 3 N 0.98 -2.16 -0.49 7.02 0.87 -2.12 -3.31 113.55 114.35 2dlk h SER 3 Ca -0.39 0.33 -0.13 0.00 -1.23 0.00 0.00 61.79 60.37 2dlk h SER 3 Cb 1.28 0.96 -0.02 0.00 -0.44 0.00 0.00 62.40 64.18 2dlk h SER 3 CO 0.60 -0.23 0.55 0.61 -0.53 0.00 0.00 176.83 177.83 2dlk n GLY 4 N -1.25 -0.15 3.77 5.77 0.00 -1.26 -4.90 105.19 107.16 2dlk n GLY 4 Ca 0.02 0.35 -0.38 0.00 0.00 0.00 0.00 46.02 46.01 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 9.76 7.15 -0.13 1.61 0.01 -1.25 -5.01 113.70 125.83 2dlk s SER 5 Ca 1.00 2.09 -0.24 0.00 1.31 0.00 0.00 55.95 60.10 2dlk s SER 5 Cb -0.26 -2.60 -0.02 0.00 0.21 0.00 0.00 66.02 63.35 2dlk s SER 5 CO 0.18 -0.21 0.75 -0.55 0.41 0.00 0.00 173.24 173.82 2dlk s SER 6 N -1.26 6.93 0.61 2.44 0.15 -1.26 -5.01 113.70 116.29 2dlk s SER 6 Ca 0.49 1.13 -0.02 0.00 0.70 0.00 0.00 55.95 58.25 2dlk s SER 6 Cb -0.26 -2.42 0.04 0.00 -1.71 0.00 0.00 66.02 61.67 2dlk s SER 6 CO 0.33 -0.27 0.87 -0.83 1.20 0.00 0.00 173.24 174.53 2dlk s GLY 7 N 1.04 1.74 -0.09 9.45 0.00 -1.26 -4.80 107.32 113.40 2dlk s GLY 7 Ca 0.37 -1.11 0.03 0.00 0.00 0.00 0.00 44.72 44.01 2dlk s GLY 7 CO 0.15 -0.79 -0.20 1.06 0.00 0.00 0.00 173.10 173.32 2dlk s MET 8 N -4.95 2.55 0.77 2.90 -1.94 0.22 -4.86 119.30 113.99 2dlk s MET 8 Ca 0.58 -0.72 -0.11 0.00 -1.71 0.00 0.00 55.69 53.73 2dlk s MET 8 Cb -0.10 -1.98 0.05 0.00 2.01 0.00 0.00 34.83 34.81 2dlk s MET 8 CO 0.41 0.13 1.09 -1.25 -0.01 0.00 0.00 175.02 175.40 2dlk s PRO 9 N 0.43 2.29 0.05 2.03 0.04 -1.26 -1.36 135.00 137.21 2dlk s PRO 9 Ca -0.17 1.18 -0.30 0.00 0.04 0.00 0.00 61.00 61.75 2dlk s PRO 9 Cb -0.17 -1.90 -0.05 0.00 0.04 0.00 0.00 34.50 32.42 2dlk s PRO 9 CO 0.07 -1.62 1.15 0.00 0.04 0.00 0.00 177.00 176.63 2dlk h ASP 11 N 6.79 0.84 -2.84 0.00 3.58 -1.94 -3.43 116.42 119.42 2dlk h ASP 11 Ca -0.41 0.04 -0.56 0.00 0.42 0.00 0.00 57.03 56.51 2dlk h ASP 11 Cb 1.22 -0.13 0.08 0.00 1.72 0.00 0.00 39.33 42.21 2dlk h ASP 11 CO 0.80 0.49 0.76 0.33 -2.88 0.00 0.00 179.24 178.74 2dlk n PHE 12 N -4.64 2.47 -2.18 0.28 7.35 -1.26 -4.95 117.46 114.52 2dlk n PHE 12 Ca 0.15 0.32 -0.35 0.00 -0.76 0.00 0.00 57.45 56.82 2dlk n PHE 12 Cb 0.26 -2.53 0.01 0.00 0.35 0.00 0.00 39.48 37.57 2dlk n PHE 12 CO 0.00 0.00 0.00 -1.25 -0.76 0.00 0.00 176.76 174.75 2dlk s PRO 13 N -0.18 3.27 0.00 -7.13 0.04 -1.26 -3.59 135.00 126.14 2dlk s PRO 13 Ca 0.68 1.57 0.00 0.00 0.04 0.00 0.00 61.00 63.29 2dlk s PRO 13 Cb -0.59 -2.00 0.00 0.00 0.04 0.00 0.00 34.50 31.96 2dlk s PRO 13 CO 0.47 -0.91 0.00 0.41 0.04 0.00 0.00 177.00 177.01 2dlk n GLY 14 N 0.04 1.29 0.12 0.56 0.00 -1.26 -4.77 105.19 101.16 2dlk n GLY 14 Ca 0.11 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.10 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 -1.07 0.06 3.40 0.00 0.00 -1.26 -5.04 105.19 101.29 2dlk n GLY 16 Ca 0.01 -0.16 -0.32 0.00 0.00 0.00 0.00 46.02 45.55 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 -5.27 2.25 0.01 1.61 0.52 -1.26 -4.95 118.95 111.86 2dlk s ARG 17 Ca 0.17 -0.85 0.07 0.00 -0.52 0.00 0.00 55.73 54.60 2dlk s ARG 17 Cb -0.08 -2.20 -0.02 0.00 0.52 0.00 0.00 34.95 33.18 2dlk s ARG 17 CO 0.41 0.58 -0.20 0.42 0.02 0.00 0.00 175.30 176.53 2dlk s ILE 18 N -0.72 1.59 0.00 1.52 1.01 -1.26 0.19 121.20 123.53 2dlk s ILE 18 Ca 0.11 -0.99 0.01 0.00 0.00 0.00 0.00 60.65 59.78 2dlk s ILE 18 Cb -0.10 -1.35 -0.01 0.00 0.01 0.00 0.00 42.46 41.01 2dlk s ILE 18 CO 0.01 0.33 -0.03 -0.36 0.00 0.00 0.00 174.94 174.89 2dlk s PHE 19 N -0.61 0.30 -0.01 3.97 0.40 -0.47 -4.87 117.98 116.69 2dlk s PHE 19 Ca 0.07 -0.14 -0.22 0.00 -0.60 0.00 0.00 56.93 56.05 2dlk s PHE 19 Cb -0.08 -0.19 -0.13 0.00 0.51 0.00 0.00 43.02 43.13 2dlk s PHE 19 CO 0.00 -0.03 0.94 0.66 0.70 0.00 0.00 175.22 177.49 2dlk h SER 20 N 5.79 -0.59 -3.66 1.36 4.64 -1.87 0.66 113.55 119.88 2dlk h SER 20 Ca -0.28 -0.02 -0.50 0.00 -0.47 0.00 0.00 61.79 60.52 2dlk h SER 20 Cb 1.20 0.15 -0.03 0.00 -0.31 0.00 0.00 62.40 63.42 2dlk h SER 20 CO 0.49 -0.19 0.09 0.20 -0.87 0.00 0.00 176.83 176.55 2dlk s ASN 21 N -4.76 6.85 0.05 4.97 0.01 -1.26 -4.64 114.94 116.16 2dlk s ASN 21 Ca -0.12 1.30 -0.20 0.00 -0.71 0.00 0.00 52.86 53.13 2dlk s ASN 21 Cb 0.01 -2.38 -0.14 0.00 0.41 0.00 0.00 41.25 39.16 2dlk s ASN 21 CO 0.38 -0.12 1.35 -0.09 -1.51 0.00 0.00 177.10 177.10 2dlk h ARG 22 N 2.64 0.40 -0.98 -0.60 1.12 -2.00 -3.15 114.38 111.81 2dlk h ARG 22 Ca -0.48 -0.22 0.18 0.00 -1.11 0.00 0.00 59.98 58.36 2dlk h ARG 22 Cb 1.18 0.01 -0.18 0.00 -0.01 0.00 0.00 29.97 30.97 2dlk h ARG 22 CO 0.65 0.78 -0.28 1.04 -3.11 0.00 0.00 179.97 179.05 2dlk n GLN 23 N -4.51 -0.13 0.31 0.20 3.00 -1.26 -0.72 117.38 114.28 2dlk n GLN 23 Ca -0.06 1.52 -0.16 0.00 -0.01 0.00 0.00 57.00 58.29 2dlk n GLN 23 Cb 0.38 -2.27 -0.08 0.00 0.00 0.00 0.00 30.24 28.27 2dlk n GLN 23 CO 0.00 0.00 0.00 1.88 0.00 0.00 0.00 177.06 178.94 2dlk h TYR 24 N 0.00 -0.71 -0.75 1.08 0.05 -1.98 -0.78 116.97 113.87 2dlk h TYR 24 Ca 0.43 -0.02 0.12 0.00 0.05 0.00 0.00 58.73 59.32 2dlk h TYR 24 Cb 0.68 0.24 -0.13 0.00 1.01 0.00 0.00 36.73 38.52 2dlk h TYR 24 CO -0.78 -0.41 -0.38 1.25 -1.05 0.00 0.00 178.16 176.79 2dlk h LEU 25 N -0.87 -1.36 0.02 3.88 5.85 -0.88 0.33 115.31 122.28 2dlk h LEU 25 Ca -0.08 0.26 -0.00 0.00 0.84 0.00 0.00 57.88 58.90 2dlk h LEU 25 Cb 0.63 0.67 0.00 0.00 0.37 0.00 0.00 40.66 42.33 2dlk h LEU 25 CO 0.13 -0.30 -0.01 -1.13 -0.34 0.00 0.00 178.44 176.79 2dlk h ASN 26 N -0.11 -0.02 -0.90 1.25 -1.24 -1.05 -1.81 115.58 111.70 2dlk h ASN 26 Ca 0.26 -0.01 0.16 0.00 0.71 0.00 0.00 56.30 57.42 2dlk h ASN 26 Cb 0.56 0.01 -0.07 0.00 0.73 0.00 0.00 38.32 39.55 2dlk h ASN 26 CO -0.80 -0.00 0.58 -0.74 -1.29 0.00 0.00 177.43 175.18 2dlk h HIS 27 N -0.04 0.76 -0.19 0.67 2.76 0.48 0.19 115.15 119.78 2dlk h HIS 27 Ca -0.00 0.02 -0.05 0.00 -2.20 0.00 0.00 60.37 58.14 2dlk h HIS 27 Cb 0.03 -0.24 -0.01 0.00 1.55 0.00 0.00 27.41 28.75 2dlk h HIS 27 CO -0.07 0.25 -0.09 1.25 -1.30 0.00 0.00 177.93 177.97 2dlk h HIS 28 N 0.61 0.46 -0.61 5.26 -0.00 0.07 -0.30 115.15 120.65 2dlk h HIS 28 Ca 0.46 -0.11 -0.08 0.00 -0.00 0.00 0.00 60.37 60.64 2dlk h HIS 28 Cb 0.86 -0.11 -0.02 0.00 -0.00 0.00 0.00 27.41 28.13 2dlk h HIS 28 CO -0.00 0.69 0.05 0.87 -0.00 0.00 0.00 177.93 179.54 2dlk h LYS 29 N 0.10 1.03 0.00 5.26 1.57 -0.40 1.06 116.57 125.19 2dlk h LYS 29 Ca 0.04 -0.29 -0.02 0.00 -1.87 0.00 0.00 60.65 58.51 2dlk h LYS 29 Cb 0.57 -0.11 -0.00 0.00 0.08 0.00 0.00 32.23 32.76 2dlk h LYS 29 CO 0.03 0.97 -0.11 -0.22 -0.57 0.00 0.00 179.45 179.56 2dlk h LYS 30 N 0.95 0.00 0.00 3.15 3.64 -0.64 -1.78 116.57 121.89 2dlk h LYS 30 Ca 0.18 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.56 2dlk h LYS 30 Cb 0.48 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.30 2dlk h LYS 30 CO 0.02 0.11 -0.17 0.66 -2.27 0.00 0.00 179.45 177.80 2dlk n TYR 31 N -3.18 0.04 0.34 1.91 4.02 -0.13 -3.80 117.16 116.35 2dlk n TYR 31 Ca 0.02 0.02 -0.17 0.00 -0.01 0.00 0.00 57.90 57.76 2dlk n TYR 31 Cb 0.44 -0.14 -0.08 0.00 -0.02 0.00 0.00 39.34 39.53 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 -0.84 -0.78 -0.72 1.08 0.98 -2.63 115.11 112.01 2dlk h GLN 32 Ca 0.00 0.06 0.00 0.00 -1.45 0.00 0.00 58.65 57.26 2dlk h GLN 32 Cb 0.17 0.19 0.00 0.00 -0.05 0.00 0.00 27.48 27.79 2dlk h GLN 32 CO 0.00 -0.52 0.00 0.72 -0.95 0.00 0.00 178.83 178.08 2dlk n HIS 33 N -5.41 0.15 -1.62 2.96 8.25 -0.87 -4.92 115.22 113.75 2dlk n HIS 33 Ca -0.13 -0.05 -0.41 0.00 -0.26 0.00 0.00 57.72 56.87 2dlk n HIS 33 Cb 0.37 -0.11 0.01 0.00 1.12 0.00 0.00 29.99 31.38 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 -0.03 2.50 -0.32 1.59 3.06 -0.72 -4.78 119.36 120.67 2dlk n ILE 34 Ca 0.02 -0.50 0.06 0.00 -2.50 0.00 0.00 62.75 59.83 2dlk n ILE 34 Cb 0.27 -1.22 0.15 0.00 0.54 0.00 0.00 39.64 39.38 2dlk n ILE 34 CO 0.00 0.00 0.00 0.45 -2.50 0.00 0.00 176.55 174.50 2dlk h HIS 35 N 1.60 -0.36 -4.07 9.51 3.86 -1.87 -3.40 115.15 120.41 2dlk h HIS 35 Ca -0.45 0.08 -0.45 0.00 -1.16 0.00 0.00 60.37 58.39 2dlk h HIS 35 Cb 1.33 0.30 0.15 0.00 1.06 0.00 0.00 27.41 30.25 2dlk h HIS 35 CO 0.44 -0.38 0.31 -0.65 0.86 0.00 0.00 177.93 178.51 2dlk s GLN 36 N -6.20 0.62 0.19 2.45 1.11 -1.26 -5.08 119.66 111.48 2dlk s GLN 36 Ca -0.14 0.03 0.10 0.00 0.01 0.00 0.00 55.36 55.36 2dlk s GLN 36 Cb 0.25 -1.80 -0.04 0.00 -1.01 0.00 0.00 33.01 30.41 2dlk s GLN 36 CO 0.77 -2.50 -0.14 -1.59 0.01 0.00 0.00 175.29 171.83 2dlk s LYS 37 N -5.48 1.88 -0.12 2.91 0.00 -1.26 -4.97 119.74 112.69 2dlk s LYS 37 Ca 0.68 -1.36 -0.15 0.00 0.00 0.00 0.00 55.97 55.14 2dlk s LYS 37 Cb -0.11 -2.05 -0.05 0.00 0.00 0.00 0.00 37.83 35.62 2dlk s LYS 37 CO 0.53 0.42 0.34 -1.54 0.00 0.00 0.00 175.35 175.11 2dlk s SER 38 N -2.78 6.54 0.89 0.03 1.04 -1.26 -4.83 113.70 113.34 2dlk s SER 38 Ca 0.24 0.64 -0.12 0.00 0.48 0.00 0.00 55.95 57.19 2dlk s SER 38 Cb -0.08 -2.21 0.13 0.00 0.10 0.00 0.00 66.02 63.95 2dlk s SER 38 CO 0.13 0.13 1.12 -0.36 0.98 0.00 0.00 173.24 175.24 2dlk s PHE 39 N 0.19 2.52 0.03 5.02 0.08 0.14 -4.86 117.98 121.10 2dlk s PHE 39 Ca 0.20 0.98 0.04 0.00 0.12 0.00 0.00 56.93 58.27 2dlk s PHE 39 Cb -0.14 -3.28 -0.02 0.00 -0.57 0.00 0.00 43.02 39.01 2dlk s PHE 39 CO 0.07 -2.29 -0.13 -1.12 -0.10 0.00 0.00 175.22 171.65 2dlk s SER 40 N -3.86 1.50 0.20 1.36 0.01 -1.26 -2.97 113.70 108.67 2dlk s SER 40 Ca 0.63 -0.39 -0.30 0.00 1.31 0.00 0.00 55.95 57.20 2dlk s SER 40 Cb -0.15 -0.10 -0.08 0.00 0.21 0.00 0.00 66.02 65.89 2dlk s SER 40 CO 0.54 0.04 1.06 0.00 0.41 0.00 0.00 173.24 175.30 2dlk n PRO 42 N 2.01 0.49 -4.71 0.00 -0.04 -1.26 -4.63 135.00 126.85 2dlk n PRO 42 Ca 0.01 0.00 -0.33 0.00 -0.04 0.00 0.00 63.50 63.14 2dlk n PRO 42 Cb 0.46 -1.09 -0.15 0.00 -0.04 0.00 0.00 33.50 32.69 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 -2.00 3.34 0.01 0.54 0.41 -1.26 -5.03 118.70 114.70 2dlk s GLU 43 Ca 0.04 -0.70 -0.23 0.00 -0.41 0.00 0.00 54.97 53.66 2dlk s GLU 43 Cb 0.02 -2.63 -0.18 0.00 -1.78 0.00 0.00 34.13 29.56 2dlk s GLU 43 CO 0.03 0.16 1.30 -1.00 -0.49 0.00 0.00 175.26 175.26 2dlk h PRO 44 N 6.88 0.17 -0.58 0.39 0.13 -2.03 -3.08 132.00 133.89 2dlk h PRO 44 Ca -0.27 -0.09 -0.03 0.00 -0.87 0.00 0.00 66.00 64.74 2dlk h PRO 44 Cb 1.21 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.32 2dlk h PRO 44 CO 0.56 0.61 0.26 0.00 -0.23 0.00 0.00 178.00 179.19 2dlk h ALA 45 N 0.55 0.75 -0.09 -0.56 0.00 -1.97 -3.10 119.26 114.84 2dlk h ALA 45 Ca 0.01 -0.15 0.04 0.00 0.00 0.00 0.00 54.91 54.81 2dlk h ALA 45 Cb 0.58 -0.23 -0.06 0.00 0.00 0.00 0.00 17.79 18.08 2dlk h ALA 45 CO 0.02 0.34 -0.38 0.00 0.00 0.00 0.00 179.25 179.23 2dlk n GLY 47 N -1.43 -1.04 2.73 0.00 0.00 -1.16 -5.00 105.19 99.29 2dlk n GLY 47 Ca -0.04 0.49 -0.22 0.00 0.00 0.00 0.00 46.02 46.25 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 -5.62 0.31 0.34 1.61 1.02 -1.26 -5.08 119.74 111.06 2dlk s LYS 48 Ca 0.46 0.22 0.08 0.00 0.02 0.00 0.00 55.97 56.76 2dlk s LYS 48 Cb -0.15 -0.77 -0.04 0.00 -0.52 0.00 0.00 37.83 36.36 2dlk s LYS 48 CO 0.84 -0.31 0.18 -1.54 -0.92 0.00 0.00 175.35 173.60 2dlk s SER 49 N 2.04 4.84 -0.05 2.83 1.04 -1.26 -3.24 113.70 119.91 2dlk s SER 49 Ca 0.05 -0.70 -0.10 0.00 0.48 0.00 0.00 55.95 55.68 2dlk s SER 49 Cb -0.12 -0.79 0.02 0.00 0.10 0.00 0.00 66.02 65.23 2dlk s SER 49 CO -0.04 -0.32 0.24 -0.36 0.98 0.00 0.00 173.24 173.74 2dlk s PHE 50 N -2.39 -0.17 -0.11 5.02 0.08 -1.16 -5.01 117.98 114.25 2dlk s PHE 50 Ca 0.39 0.35 -0.27 0.00 0.12 0.00 0.00 56.93 57.52 2dlk s PHE 50 Cb -0.03 0.06 -0.23 0.00 -0.57 0.00 0.00 43.02 42.24 2dlk s PHE 50 CO 0.24 -0.24 0.86 -0.91 -0.10 0.00 0.00 175.22 175.07 2dlk h ASN 51 N 4.85 -0.01 -3.52 1.36 4.21 -1.88 0.44 115.58 121.02 2dlk h ASN 51 Ca -0.28 -0.81 -0.66 0.00 1.21 0.00 0.00 56.30 55.76 2dlk h ASN 51 Cb 1.19 0.00 -0.16 0.00 -1.12 0.00 0.00 38.32 38.23 2dlk h ASN 51 CO 0.38 0.83 0.08 -0.36 -1.29 0.00 0.00 177.43 177.06 2dlk s PHE 52 N -2.74 3.07 0.30 1.19 0.08 -1.26 -4.54 117.98 114.08 2dlk s PHE 52 Ca -0.17 -0.17 0.15 0.00 0.12 0.00 0.00 56.93 56.86 2dlk s PHE 52 Cb -0.02 -3.33 1.05 0.00 -0.57 0.00 0.00 43.02 40.16 2dlk s PHE 52 CO 0.65 -0.88 1.34 0.36 -0.10 0.00 0.00 175.22 176.58 2dlk n LYS 53 N 6.19 -0.05 -0.30 0.44 2.85 -1.26 -0.17 118.16 125.85 2dlk n LYS 53 Ca -0.03 1.19 0.01 0.00 -1.05 0.00 0.00 58.31 58.43 2dlk n LYS 53 Cb 0.47 -2.09 0.06 0.00 -0.65 0.00 0.00 35.03 32.83 2dlk n LYS 53 CO 0.00 0.00 0.00 1.17 -0.05 0.00 0.00 177.40 178.52 2dlk n LYS 54 N -4.97 -0.14 -0.05 -1.58 3.00 -1.26 0.99 118.16 114.14 2dlk n LYS 54 Ca 0.30 1.24 -0.10 0.00 -0.00 0.00 0.00 58.31 59.75 2dlk n LYS 54 Cb 1.01 -1.85 -0.04 0.00 0.00 0.00 0.00 35.03 34.15 2dlk n LYS 54 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.40 177.85 2dlk h HIS 55 N 0.00 0.29 -0.74 5.64 3.86 -0.98 -2.12 115.15 121.09 2dlk h HIS 55 Ca 0.32 -0.01 0.22 0.00 -1.16 0.00 0.00 60.37 59.74 2dlk h HIS 55 Cb 0.52 -0.09 -0.03 0.00 1.06 0.00 0.00 27.41 28.87 2dlk h HIS 55 CO -0.67 0.27 0.74 1.25 0.86 0.00 0.00 177.93 180.37 2dlk h LEU 56 N 0.22 0.00 0.07 2.43 5.85 0.57 0.25 115.31 124.70 2dlk h LEU 56 Ca 0.07 0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.79 2dlk h LEU 56 Cb 0.08 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.11 2dlk h LEU 56 CO -0.01 0.00 -0.03 0.50 -0.34 0.00 0.00 178.44 178.55 2dlk h LYS 57 N 0.00 -0.09 -0.82 1.25 1.63 -0.65 -3.23 116.57 114.66 2dlk h LYS 57 Ca 0.35 0.01 0.16 0.00 -0.85 0.00 0.00 60.65 60.32 2dlk h LYS 57 Cb 1.83 0.02 -0.06 0.00 -0.60 0.00 0.00 32.23 33.42 2dlk h LYS 57 CO -0.00 -0.06 0.54 1.05 -3.45 0.00 0.00 179.45 177.53 2dlk h GLU 58 N -0.35 0.44 -0.21 1.90 4.11 -1.29 -1.85 114.58 117.32 2dlk h GLU 58 Ca -0.01 -0.03 0.06 0.00 0.07 0.00 0.00 59.36 59.45 2dlk h GLU 58 Cb 0.07 -0.10 -0.07 0.00 0.50 0.00 0.00 28.75 29.16 2dlk h GLU 58 CO 0.02 0.29 -0.22 1.25 0.07 0.00 0.00 179.01 180.41 2dlk h HIS 59 N 0.45 -0.59 -1.47 2.06 2.76 -0.65 0.51 115.15 118.22 2dlk h HIS 59 Ca 0.41 0.03 0.43 0.00 -2.20 0.00 0.00 60.37 59.04 2dlk h HIS 59 Cb 0.93 0.29 -0.06 0.00 1.55 0.00 0.00 27.41 30.12 2dlk h HIS 59 CO -0.00 -0.30 1.09 0.52 -1.30 0.00 0.00 177.93 177.94 2dlk h MET 60 N -0.24 0.00 -0.98 5.26 2.86 -1.35 0.68 114.93 121.16 2dlk h MET 60 Ca 0.13 0.00 0.05 0.00 -2.06 0.00 0.00 59.70 57.81 2dlk h MET 60 Cb 0.44 0.00 -0.06 0.00 0.06 0.00 0.00 31.60 32.04 2dlk h MET 60 CO -0.35 0.00 0.64 0.87 1.06 0.00 0.00 176.91 179.13 2dlk h LYS 61 N 0.00 1.18 -0.53 1.72 1.79 -0.98 -2.33 116.57 117.41 2dlk h LYS 61 Ca 0.70 -0.07 0.09 0.00 -2.18 0.00 0.00 60.65 59.19 2dlk h LYS 61 Cb 2.88 -0.27 -0.07 0.00 -1.58 0.00 0.00 32.23 33.19 2dlk h LYS 61 CO -0.01 0.78 0.14 -0.07 -1.08 0.00 0.00 179.45 179.21 2dlk h LEU 62 N 1.21 0.07 -0.70 2.94 4.07 0.30 0.25 115.31 123.46 2dlk h LEU 62 Ca 0.40 0.09 0.07 0.00 0.08 0.00 0.00 57.88 58.52 2dlk h LEU 62 Cb 0.05 0.10 -0.06 0.00 1.08 0.00 0.00 40.66 41.83 2dlk h LEU 62 CO -0.14 0.06 0.38 0.45 -1.08 0.00 0.00 178.44 178.11 2dlk h HIS 63 N 0.29 0.69 -0.40 1.13 3.86 -1.51 0.25 115.15 119.45 2dlk h HIS 63 Ca 0.27 0.03 0.00 0.00 -1.16 0.00 0.00 60.37 59.50 2dlk h HIS 63 Cb 0.35 -0.20 0.00 0.00 1.06 0.00 0.00 27.41 28.61 2dlk h HIS 63 CO -0.21 0.30 0.00 0.45 0.86 0.00 0.00 177.93 179.33 2dlk n SER 64 N -4.81 3.18 -0.04 2.45 2.88 -0.56 -4.28 113.62 112.46 2dlk n SER 64 Ca 0.10 -2.29 -0.12 0.00 -1.33 0.00 0.00 58.87 55.23 2dlk n SER 64 Cb 0.22 -0.46 -0.07 0.00 -0.75 0.00 0.00 64.21 63.15 2dlk n SER 64 CO 0.00 0.00 0.00 -0.78 -1.23 0.00 0.00 175.04 173.03 2dlk h ASP 65 N 2.55 0.21 -4.05 -3.46 1.82 0.16 -3.44 116.42 110.21 2dlk h ASP 65 Ca 0.00 -0.30 -0.54 0.00 -0.39 0.00 0.00 57.03 55.81 2dlk h ASP 65 Cb 1.02 -0.06 0.12 0.00 0.68 0.00 0.00 39.33 41.09 2dlk h ASP 65 CO 0.16 0.45 0.56 0.28 -1.61 0.00 0.00 179.24 179.08 2dlk s THR 66 N -5.03 2.37 0.67 2.25 -1.32 -1.26 -5.01 115.64 108.31 2dlk s THR 66 Ca -0.14 0.27 -0.09 0.00 -1.21 0.00 0.00 61.69 60.51 2dlk s THR 66 Cb 0.05 -3.13 0.02 0.00 -1.51 0.00 0.00 72.50 67.93 2dlk s THR 66 CO 0.71 -0.01 1.02 -0.13 -2.21 0.00 0.00 174.62 174.00 2dlk s ARG 67 N -2.93 2.80 -0.14 7.08 0.52 -1.26 -5.04 118.95 119.97 2dlk s ARG 67 Ca 0.71 0.23 -0.10 0.00 -0.52 0.00 0.00 55.73 56.05 2dlk s ARG 67 Cb -0.36 -2.12 -0.06 0.00 0.52 0.00 0.00 34.95 32.92 2dlk s ARG 67 CO 0.43 -0.95 -0.02 0.38 0.02 0.00 0.00 175.30 175.15 2dlk h ASP 68 N -0.49 0.00 -6.18 0.23 2.03 -1.96 -3.48 116.42 106.56 2dlk h ASP 68 Ca -0.45 -0.13 -0.45 0.00 -0.73 0.00 0.00 57.03 55.27 2dlk h ASP 68 Cb 1.26 0.00 0.01 0.00 -0.83 0.00 0.00 39.33 39.78 2dlk h ASP 68 CO 0.63 0.82 -0.78 0.00 -1.03 0.00 0.00 179.24 178.88 2dlk n TYR 69 N -4.63 -2.21 -2.80 4.15 4.19 -1.26 -4.94 117.16 109.66 2dlk n TYR 69 Ca -0.09 0.89 -0.36 0.00 3.31 0.00 0.00 57.90 61.65 2dlk n TYR 69 Cb 0.28 -4.24 -0.07 0.00 0.49 0.00 0.00 39.34 35.80 2dlk n TYR 69 CO 0.00 0.00 0.00 -1.50 0.91 0.00 0.00 176.86 176.27 2dlk s ILE 70 N -3.44 4.26 0.24 2.97 1.10 -1.26 -4.99 121.20 120.08 2dlk s ILE 70 Ca 0.40 1.75 -0.31 0.00 -0.51 0.00 0.00 60.65 61.98 2dlk s ILE 70 Cb -0.20 -3.93 -0.13 0.00 0.15 0.00 0.00 42.46 38.35 2dlk s ILE 70 CO 0.81 0.05 1.46 0.00 -2.11 0.00 0.00 174.94 175.15 2dlk s GLU 72 N -0.29 0.76 -0.06 0.00 -1.05 -1.26 -5.16 118.70 111.64 2dlk s GLU 72 Ca 0.68 -0.75 -0.03 0.00 -0.15 0.00 0.00 54.97 54.72 2dlk s GLU 72 Cb -0.63 0.32 0.04 0.00 -0.44 0.00 0.00 34.13 33.42 2dlk s GLU 72 CO 0.48 -0.23 0.13 -0.59 0.95 0.00 0.00 175.26 176.00 2dlk s PHE 73 N -3.10 -0.14 -0.19 4.83 -0.12 -1.26 -5.13 117.98 112.88 2dlk s PHE 73 Ca -0.01 0.46 -0.04 0.00 -0.05 0.00 0.00 56.93 57.29 2dlk s PHE 73 Cb 0.01 -0.14 0.09 0.00 -0.63 0.00 0.00 43.02 42.36 2dlk s PHE 73 CO -0.07 -0.17 0.27 0.45 -0.05 0.00 0.00 175.22 175.65 2dlk s SER 74 N 1.35 0.74 0.52 1.98 0.15 -1.26 -5.15 113.70 112.02 2dlk s SER 74 Ca -0.07 0.19 -0.17 0.00 0.70 0.00 0.00 55.95 56.60 2dlk s SER 74 Cb -0.12 0.68 -0.08 0.00 -1.71 0.00 0.00 66.02 64.79 2dlk s SER 74 CO -0.06 -0.29 0.99 -0.83 1.20 0.00 0.00 173.24 174.26 2dlk s GLY 75 N 2.41 2.08 0.84 9.45 0.00 -1.26 -5.05 107.32 115.80 2dlk s GLY 75 Ca 0.06 0.21 -0.11 0.00 0.00 0.00 0.00 44.72 44.88 2dlk s GLY 75 CO -0.12 0.49 1.09 2.56 0.00 0.00 0.00 173.10 177.12 2dlk s PRO 76 N -4.04 1.68 0.27 2.90 0.04 -1.26 -5.00 135.00 129.59 2dlk s PRO 76 Ca 0.59 0.97 -0.30 0.00 0.04 0.00 0.00 61.00 62.31 2dlk s PRO 76 Cb -0.10 -1.85 -0.09 0.00 0.04 0.00 0.00 34.50 32.50 2dlk s PRO 76 CO 0.31 -1.99 1.09 -1.12 0.04 0.00 0.00 177.00 175.33 2dlk s SER 77 N -3.41 7.29 0.99 6.66 0.01 -1.26 -5.04 113.70 118.94 2dlk s SER 77 Ca 0.62 2.24 -0.16 0.00 1.31 0.00 0.00 55.95 59.96 2dlk s SER 77 Cb -0.18 -2.62 0.20 0.00 0.21 0.00 0.00 66.02 63.63 2dlk s SER 77 CO 0.57 -0.13 1.28 -0.94 0.41 0.00 0.00 173.24 174.43 2dlk s SER 78 N -0.85 2.89 0.00 2.44 1.04 -1.26 -5.36 113.70 112.61 2dlk s SER 78 Ca 0.45 0.37 0.00 0.00 0.48 0.00 0.00 55.95 57.24 2dlk s SER 78 Cb -0.31 -0.48 0.00 0.00 0.10 0.00 0.00 66.02 65.33 2dlk s SER 78 CO 0.40 -2.88 0.00 0.61 0.98 0.00 0.00 173.24 172.35