#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dk5 h SER 2 N 0.00 0.26 0.00 1.61 0.02 -2.14 -3.23 113.55 110.06 2dk5 h SER 2 Ca 0.00 0.09 -0.08 0.00 -0.84 0.00 0.00 61.79 60.97 2dk5 h SER 2 Cb 0.00 0.07 -0.01 0.00 0.14 0.00 0.00 62.40 62.60 2dk5 h SER 2 CO 0.00 0.12 -0.76 -1.54 -1.14 0.00 0.00 176.83 173.51 2dk5 n SER 3 N -5.00 1.82 0.00 3.07 3.41 -1.26 -5.10 113.62 110.57 2dk5 n SER 3 Ca 0.12 0.57 0.00 0.00 -0.26 0.00 0.00 58.87 59.30 2dk5 n SER 3 Cb 0.35 -0.90 0.00 0.00 -0.26 0.00 0.00 64.21 63.39 2dk5 n SER 3 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2dk5 n GLY 4 N 1.56 -2.37 3.36 5.00 0.00 -1.22 -5.03 105.19 106.48 2dk5 n GLY 4 Ca -0.16 -1.82 -0.13 0.00 0.00 0.00 0.00 46.02 43.91 2dk5 n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2dk5 s SER 5 N -3.01 -0.48 0.32 1.61 1.04 -1.26 -5.03 113.70 106.89 2dk5 s SER 5 Ca 0.00 0.93 0.25 0.00 0.48 0.00 0.00 55.95 57.61 2dk5 s SER 5 Cb 0.00 0.94 0.70 0.00 0.10 0.00 0.00 66.02 67.76 2dk5 s SER 5 CO 0.00 -0.16 1.73 0.77 0.98 0.00 0.00 173.24 176.56 2dk5 h SER 6 N 5.42 0.00 -4.10 7.02 4.64 -2.07 -3.49 113.55 120.96 2dk5 h SER 6 Ca -0.27 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.05 2dk5 h SER 6 Cb 1.18 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.27 2dk5 h SER 6 CO 0.21 0.00 -0.97 0.61 -0.87 0.00 0.00 176.83 175.82 2dk5 n GLY 7 N 1.03 -4.79 3.55 -0.77 0.00 -1.26 -5.06 105.19 97.89 2dk5 n GLY 7 Ca 0.04 -0.64 -0.00 0.00 0.00 0.00 0.00 46.02 45.43 2dk5 n GLY 7 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 2dk5 s ASP 8 N -3.33 -0.89 -0.48 1.61 -4.77 -1.26 -5.04 116.67 102.50 2dk5 s ASP 8 Ca 0.00 1.24 -0.02 0.00 -3.30 0.00 0.00 52.55 50.47 2dk5 s ASP 8 Cb 0.00 1.99 0.22 0.00 -1.09 0.00 0.00 42.92 44.04 2dk5 s ASP 8 CO 0.00 -0.17 2.27 -0.24 0.70 0.00 0.00 175.17 177.72 2dk5 n SER 9 N 5.18 6.82 -4.61 2.11 2.88 -1.26 -4.92 113.62 119.82 2dk5 n SER 9 Ca -0.11 -3.33 -0.39 0.00 -1.33 0.00 0.00 58.87 53.70 2dk5 n SER 9 Cb 0.51 -1.10 -0.09 0.00 -0.75 0.00 0.00 64.21 62.78 2dk5 n SER 9 CO 0.00 0.00 0.00 -1.10 -1.23 0.00 0.00 175.04 172.71 2dk5 s GLN 10 N -2.40 4.04 0.05 -1.46 -1.52 -1.26 -5.02 119.66 112.08 2dk5 s GLN 10 Ca 0.49 0.14 -0.28 0.00 -1.95 0.00 0.00 55.36 53.76 2dk5 s GLN 10 Cb 0.36 -3.65 0.10 0.00 -0.22 0.00 0.00 33.01 29.59 2dk5 s GLN 10 CO -0.12 -0.30 1.19 1.21 -0.25 0.00 0.00 175.29 177.02 2dk5 s ASN 11 N 1.60 -0.06 0.23 5.90 2.47 -1.26 -5.03 114.94 118.80 2dk5 s ASN 11 Ca 0.17 -0.28 -0.06 0.00 0.42 0.00 0.00 52.86 53.11 2dk5 s ASN 11 Cb -0.16 0.27 0.35 0.00 -1.45 0.00 0.00 41.25 40.26 2dk5 s ASN 11 CO 0.10 -0.51 1.80 0.00 -3.72 0.00 0.00 177.10 174.76 2dk5 h ALA 12 N 2.00 1.05 0.00 1.71 0.00 -2.05 -3.44 119.26 118.52 2dk5 h ALA 12 Ca -0.27 0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.67 2dk5 h ALA 12 Cb 1.21 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.90 2dk5 h ALA 12 CO 0.30 0.03 0.00 0.41 0.00 0.00 0.00 179.25 179.99 2dk5 n GLY 13 N -1.31 0.00 3.68 0.00 0.00 -1.26 -5.17 105.19 101.14 2dk5 n GLY 13 Ca 0.12 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.82 2dk5 n GLY 13 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2dk5 s LYS 14 N 0.00 2.70 -0.89 1.61 3.01 -1.26 -5.02 119.74 119.90 2dk5 s LYS 14 Ca 0.00 -0.69 -0.07 0.00 -1.01 0.00 0.00 55.97 54.20 2dk5 s LYS 14 Cb 0.00 -2.62 -0.07 0.00 -1.01 0.00 0.00 37.83 34.13 2dk5 s LYS 14 CO 0.00 0.59 3.00 -1.33 0.51 0.00 0.00 175.35 178.12 2dk5 n MET 15 N 1.09 3.18 -3.92 1.68 2.81 -1.26 -4.66 117.12 116.05 2dk5 n MET 15 Ca -0.13 -2.16 -0.27 0.00 -1.81 0.00 0.00 57.70 53.34 2dk5 n MET 15 Cb 0.52 -2.42 0.00 0.00 -0.71 0.00 0.00 33.22 30.62 2dk5 n MET 15 CO 0.00 0.00 0.00 1.63 1.51 0.00 0.00 175.97 179.11 2dk5 n LYS 16 N 2.39 -4.14 0.00 0.03 5.02 -1.26 -4.63 118.16 115.57 2dk5 n LYS 16 Ca 0.60 0.49 0.00 0.00 -2.02 0.00 0.00 58.31 57.38 2dk5 n LYS 16 Cb 0.49 -4.97 0.00 0.00 -0.02 0.00 0.00 35.03 30.53 2dk5 n LYS 16 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2dk5 n GLY 17 N -1.74 1.04 3.55 0.72 0.00 -1.26 -4.92 105.19 102.59 2dk5 n GLY 17 Ca -0.19 -2.19 -0.39 0.00 0.00 0.00 0.00 46.02 43.25 2dk5 n GLY 17 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2dk5 s SER 18 N 0.00 5.40 -0.27 1.61 0.15 -1.26 -4.90 113.70 114.43 2dk5 s SER 18 Ca 0.00 0.32 -0.02 0.00 0.70 0.00 0.00 55.95 56.95 2dk5 s SER 18 Cb 0.00 -2.53 0.16 0.00 -1.71 0.00 0.00 66.02 61.94 2dk5 s SER 18 CO 0.00 -2.28 0.47 -1.81 1.20 0.00 0.00 173.24 170.82 2dk5 s ASP 19 N 7.54 -0.47 -0.09 5.45 1.01 -1.26 -5.01 116.67 123.85 2dk5 s ASP 19 Ca 0.65 0.46 0.17 0.00 0.71 0.00 0.00 52.55 54.54 2dk5 s ASP 19 Cb -0.13 1.57 -0.25 0.00 1.01 0.00 0.00 42.92 45.13 2dk5 s ASP 19 CO 0.21 -0.29 0.24 0.59 0.21 0.00 0.00 175.17 176.14 2dk5 n ASN 20 N 5.39 0.87 -0.16 0.27 3.02 -1.26 -4.42 115.26 118.98 2dk5 n ASN 20 Ca -0.02 0.00 0.07 0.00 -0.03 0.00 0.00 54.58 54.60 2dk5 n ASN 20 Cb 0.51 1.42 0.38 0.00 -0.61 0.00 0.00 39.78 41.47 2dk5 n ASN 20 CO 0.00 0.00 0.00 1.56 -2.62 0.00 0.00 177.26 176.20 2dk5 h GLN 21 N 0.00 0.68 0.00 3.52 7.50 -2.01 0.85 115.11 125.65 2dk5 h GLN 21 Ca -0.20 -0.04 0.00 0.00 0.50 0.00 0.00 58.65 58.91 2dk5 h GLN 21 Cb 1.37 -0.15 0.00 0.00 0.05 0.00 0.00 27.48 28.74 2dk5 h GLN 21 CO 0.01 0.45 0.00 1.49 -1.50 0.00 0.00 178.83 179.28 2dk5 h GLU 22 N 0.70 0.00 0.10 1.46 4.81 -1.97 -0.98 114.58 118.70 2dk5 h GLU 22 Ca 0.30 0.00 -0.28 0.00 -0.13 0.00 0.00 59.36 59.24 2dk5 h GLU 22 Cb 0.27 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.64 2dk5 h GLU 22 CO -0.10 0.00 -1.39 1.57 -0.73 0.00 0.00 179.01 178.37 2dk5 h LYS 23 N 0.00 0.21 0.00 1.92 2.10 -1.09 -2.66 116.57 117.04 2dk5 h LYS 23 Ca 0.00 -0.36 -0.12 0.00 -2.00 0.00 0.00 60.65 58.17 2dk5 h LYS 23 Cb 0.05 0.13 -0.02 0.00 -0.90 0.00 0.00 32.23 31.50 2dk5 h LYS 23 CO 0.00 1.10 -0.55 1.25 -2.00 0.00 0.00 179.45 179.24 2dk5 h LEU 24 N 0.06 0.00 0.05 7.07 5.85 -1.19 -2.94 115.31 124.20 2dk5 h LEU 24 Ca -0.18 0.00 -0.26 0.00 0.84 0.00 0.00 57.88 58.28 2dk5 h LEU 24 Cb 1.97 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 42.98 2dk5 h LEU 24 CO 0.17 0.55 -1.31 0.58 -0.34 0.00 0.00 178.44 178.09 2dk5 h VAL 25 N 0.00 1.38 -0.02 1.05 2.07 -1.49 -3.27 116.25 115.96 2dk5 h VAL 25 Ca -0.01 -3.07 -0.12 0.00 0.82 0.00 0.00 66.70 64.33 2dk5 h VAL 25 Cb 1.26 2.77 -0.02 0.00 -1.52 0.00 0.00 31.29 33.78 2dk5 h VAL 25 CO 0.07 0.84 -0.54 0.22 0.02 0.00 0.00 177.57 178.18 2dk5 h TYR 26 N 0.03 0.07 0.00 1.57 3.20 -1.48 -2.73 116.97 117.63 2dk5 h TYR 26 Ca -0.14 -0.02 -0.06 0.00 3.14 0.00 0.00 58.73 61.65 2dk5 h TYR 26 Cb 1.91 -0.01 -0.01 0.00 1.54 0.00 0.00 36.73 40.16 2dk5 h TYR 26 CO 0.03 0.59 -0.28 1.96 -1.64 0.00 0.00 178.16 178.82 2dk5 h GLN 27 N 0.04 0.00 0.16 1.82 1.08 -1.60 -2.94 115.11 113.68 2dk5 h GLN 27 Ca -0.00 0.00 -0.24 0.00 -1.45 0.00 0.00 58.65 56.95 2dk5 h GLN 27 Cb 0.97 0.00 0.03 0.00 -0.05 0.00 0.00 27.48 28.43 2dk5 h GLN 27 CO 0.07 0.28 -1.06 0.82 -0.95 0.00 0.00 178.83 177.99 2dk5 h ILE 28 N 0.00 1.41 -0.78 2.54 2.04 -1.54 -2.97 117.51 118.21 2dk5 h ILE 28 Ca -0.00 -2.54 0.00 0.00 1.00 0.00 0.00 64.86 63.32 2dk5 h ILE 28 Cb 0.84 3.04 -0.04 0.00 -0.74 0.00 0.00 36.82 39.93 2dk5 h ILE 28 CO 0.04 0.74 0.50 0.40 0.00 0.00 0.00 178.15 179.83 2dk5 h ILE 29 N -0.11 1.21 0.00 -0.67 2.04 -1.47 -1.76 117.51 116.74 2dk5 h ILE 29 Ca -0.18 -0.39 -0.08 0.00 1.00 0.00 0.00 64.86 65.21 2dk5 h ILE 29 Cb 1.82 0.08 -0.01 0.00 -0.74 0.00 0.00 36.82 37.96 2dk5 h ILE 29 CO 0.20 0.20 -0.38 1.05 0.00 0.00 0.00 178.15 179.22 2dk5 h GLU 30 N 1.05 0.00 -0.15 2.37 -0.00 -1.62 -2.81 114.58 113.43 2dk5 h GLU 30 Ca 0.28 0.00 -0.12 0.00 -0.00 0.00 0.00 59.36 59.52 2dk5 h GLU 30 Cb -0.10 0.00 -0.01 0.00 -0.00 0.00 0.00 28.75 28.64 2dk5 h GLU 30 CO -0.06 0.38 -0.44 -0.44 -0.00 0.00 0.00 179.01 178.44 2dk5 h ASP 31 N 0.00 0.37 -0.72 3.06 3.32 -1.17 -2.98 116.42 118.30 2dk5 h ASP 31 Ca -0.00 -0.17 0.03 0.00 0.02 0.00 0.00 57.03 56.91 2dk5 h ASP 31 Cb 0.74 -0.11 -0.04 0.00 0.22 0.00 0.00 39.33 40.14 2dk5 h ASP 31 CO 0.05 0.77 0.48 0.00 -1.72 0.00 0.00 179.24 178.82 2dk5 h ALA 32 N 1.24 1.57 0.00 3.45 0.00 -1.14 -3.49 119.26 120.90 2dk5 h ALA 32 Ca 0.02 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.89 2dk5 h ALA 32 Cb 0.90 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 18.44 2dk5 h ALA 32 CO 0.07 0.36 0.00 0.41 0.00 0.00 0.00 179.25 180.09 2dk5 n GLY 33 N -1.43 -1.82 0.24 0.00 0.00 -1.13 -4.05 105.19 97.00 2dk5 n GLY 33 Ca 0.09 -1.50 -0.01 0.00 0.00 0.00 0.00 46.02 44.61 2dk5 n GLY 33 CO 0.00 0.00 0.00 3.45 0.00 0.00 0.00 173.32 176.77 2dk5 h ASN 34 N 0.00 -0.55 -1.23 1.61 -1.07 -1.93 0.41 115.58 112.81 2dk5 h ASN 34 Ca 0.00 0.18 0.35 0.00 0.07 0.00 0.00 56.30 56.91 2dk5 h ASN 34 Cb 0.00 0.38 -0.06 0.00 -2.07 0.00 0.00 38.32 36.57 2dk5 h ASN 34 CO 0.00 -0.20 0.87 0.11 0.07 0.00 0.00 177.43 178.28 2dk5 h LYS 35 N 0.01 0.07 0.00 4.14 1.57 -2.00 -3.47 116.57 116.89 2dk5 h LYS 35 Ca 0.30 -0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.08 2dk5 h LYS 35 Cb 0.47 -0.02 0.00 0.00 0.08 0.00 0.00 32.23 32.76 2dk5 h LYS 35 CO -0.63 0.04 0.00 0.41 -0.57 0.00 0.00 179.45 178.70 2dk5 n GLY 36 N -1.72 -1.97 3.16 3.86 0.00 0.14 -4.98 105.19 103.69 2dk5 n GLY 36 Ca 0.28 -1.42 -0.12 0.00 0.00 0.00 0.00 46.02 44.76 2dk5 n GLY 36 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2dk5 s ILE 37 N 0.00 0.06 -0.06 -0.61 2.07 -0.88 -4.64 121.20 117.13 2dk5 s ILE 37 Ca 0.00 -0.48 -0.30 0.00 -1.41 0.00 0.00 60.65 58.47 2dk5 s ILE 37 Cb 0.00 -0.48 -0.02 0.00 0.13 0.00 0.00 42.46 42.09 2dk5 s ILE 37 CO 0.00 -0.26 1.01 0.86 -1.91 0.00 0.00 174.94 174.63 2dk5 s TRP 38 N -1.06 3.56 0.28 3.50 -0.00 -1.26 -0.48 118.94 123.48 2dk5 s TRP 38 Ca -0.11 1.62 0.18 0.00 -0.00 0.00 0.00 56.10 57.78 2dk5 s TRP 38 Cb -0.06 -3.17 1.01 0.00 -0.00 0.00 0.00 33.47 31.26 2dk5 s TRP 38 CO 0.02 -0.19 1.14 0.43 -0.00 0.00 0.00 176.95 178.36 2dk5 n SER 39 N 4.56 0.22 -0.03 5.86 7.64 -1.07 0.18 113.62 130.98 2dk5 n SER 39 Ca 0.08 1.15 -0.13 0.00 1.01 0.00 0.00 58.87 60.97 2dk5 n SER 39 Cb 0.49 -0.56 -0.11 0.00 -1.01 0.00 0.00 64.21 63.03 2dk5 n SER 39 CO 0.00 0.00 0.00 0.03 -3.01 0.00 0.00 175.04 172.06 2dk5 h ARG 40 N 0.00 0.04 -0.43 1.43 3.08 -1.90 -3.11 114.38 113.48 2dk5 h ARG 40 Ca 0.63 -0.03 0.13 0.00 0.07 0.00 0.00 59.98 60.77 2dk5 h ARG 40 Cb 1.77 0.01 -0.02 0.00 0.08 0.00 0.00 29.97 31.81 2dk5 h ARG 40 CO -0.49 0.68 0.84 -0.44 -1.07 0.00 0.00 179.97 179.49 2dk5 h ASP 41 N -0.60 0.00 0.06 7.04 5.19 0.15 0.47 116.42 128.74 2dk5 h ASP 41 Ca -0.00 0.00 -0.09 0.00 -0.62 0.00 0.00 57.03 56.32 2dk5 h ASP 41 Cb 0.68 0.00 0.01 0.00 0.18 0.00 0.00 39.33 40.20 2dk5 h ASP 41 CO 0.01 0.00 -0.39 0.58 -3.12 0.00 0.00 179.24 176.32 2dk5 h VAL 42 N 0.00 1.64 -0.90 -1.35 2.07 -1.40 -3.23 116.25 113.09 2dk5 h VAL 42 Ca 0.21 -2.39 0.37 0.00 0.82 0.00 0.00 66.70 65.71 2dk5 h VAL 42 Cb 1.88 3.24 -0.16 0.00 -1.52 0.00 0.00 31.29 34.73 2dk5 h VAL 42 CO -0.00 0.65 0.49 0.54 0.02 0.00 0.00 177.57 179.27 2dk5 n ARG 43 N -4.38 -0.05 0.08 1.57 1.74 0.17 0.52 116.66 116.30 2dk5 n ARG 43 Ca -0.12 1.22 -0.07 0.00 -0.77 0.00 0.00 57.85 58.11 2dk5 n ARG 43 Cb 0.64 -2.19 -0.04 0.00 -1.02 0.00 0.00 32.46 29.84 2dk5 n ARG 43 CO 0.00 0.00 0.00 1.88 -1.52 0.00 0.00 177.63 177.99 2dk5 h TYR 44 N 0.00 -0.27 0.31 -1.55 -1.99 -1.65 -1.25 116.97 110.56 2dk5 h TYR 44 Ca 0.75 -0.01 0.00 0.00 2.00 0.00 0.00 58.73 61.48 2dk5 h TYR 44 Cb 2.01 0.09 -0.03 0.00 2.00 0.00 0.00 36.73 40.80 2dk5 h TYR 44 CO -0.01 -0.06 -0.48 0.87 -0.00 0.00 0.00 178.16 178.49 2dk5 h LYS 45 N -1.04 -0.81 0.00 4.88 1.79 -0.75 -0.80 116.57 119.84 2dk5 h LYS 45 Ca -0.03 0.06 -0.00 0.00 -2.18 0.00 0.00 60.65 58.49 2dk5 h LYS 45 Cb 0.34 0.18 -0.00 0.00 -1.58 0.00 0.00 32.23 31.17 2dk5 h LYS 45 CO 0.05 -0.54 -0.00 0.66 -1.08 0.00 0.00 179.45 178.54 2dk5 h SER 46 N -0.84 0.00 -2.67 0.86 4.64 -0.10 -3.46 113.55 111.99 2dk5 h SER 46 Ca -0.03 0.00 -0.39 0.00 -0.47 0.00 0.00 61.79 60.91 2dk5 h SER 46 Cb 0.78 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.85 2dk5 h SER 46 CO -0.16 0.00 -0.49 -3.20 -0.87 0.00 0.00 176.83 172.11 2dk5 n ASN 47 N -3.10 -5.55 -4.56 4.97 2.85 -0.31 -4.95 115.26 104.60 2dk5 n ASN 47 Ca -0.02 0.01 -0.27 0.00 -0.11 0.00 0.00 54.58 54.19 2dk5 n ASN 47 Cb 0.16 -4.60 -0.09 0.00 1.24 0.00 0.00 39.78 36.48 2dk5 n ASN 47 CO 0.00 0.00 0.00 -0.76 -2.11 0.00 0.00 177.26 174.39 2dk5 s LEU 48 N -5.51 2.94 0.68 1.20 1.43 -0.91 -5.01 118.68 113.51 2dk5 s LEU 48 Ca 0.00 -0.58 -0.14 0.00 -1.03 0.00 0.00 54.13 52.38 2dk5 s LEU 48 Cb 0.00 -1.64 0.01 0.00 0.03 0.00 0.00 46.19 44.59 2dk5 s LEU 48 CO 0.00 0.11 1.11 -2.16 0.23 0.00 0.00 176.35 175.64 2dk5 s PRO 49 N -2.77 2.69 0.21 1.29 0.04 -1.26 -4.56 135.00 130.64 2dk5 s PRO 49 Ca 0.24 1.35 -0.16 0.00 0.04 0.00 0.00 61.00 62.47 2dk5 s PRO 49 Cb -0.09 -1.94 0.23 0.00 0.04 0.00 0.00 34.50 32.74 2dk5 s PRO 49 CO 0.15 -1.33 1.60 1.25 0.04 0.00 0.00 177.00 178.70 2dk5 h LEU 50 N -0.20 -0.92 -1.93 -3.56 7.12 -1.98 0.87 115.31 114.72 2dk5 h LEU 50 Ca -0.46 0.23 0.21 0.00 0.13 0.00 0.00 57.88 57.99 2dk5 h LEU 50 Cb 1.24 0.52 -0.03 0.00 -0.53 0.00 0.00 40.66 41.87 2dk5 h LEU 50 CO 0.53 -0.27 0.61 0.00 -0.13 0.00 0.00 178.44 179.18 2dk5 h THR 51 N -0.07 0.44 0.17 1.05 1.03 -1.99 0.37 112.91 113.90 2dk5 h THR 51 Ca 0.30 0.00 -0.33 0.00 -0.01 0.00 0.00 66.41 66.38 2dk5 h THR 51 Cb 0.55 0.55 0.01 0.00 -1.07 0.00 0.00 68.15 68.18 2dk5 h THR 51 CO -0.74 0.00 -1.64 -0.33 -0.01 0.00 0.00 175.52 172.80 2dk5 h GLU 52 N 0.00 0.35 -0.04 0.00 4.39 0.34 -3.14 114.58 116.48 2dk5 h GLU 52 Ca 0.34 -0.60 -0.09 0.00 0.34 0.00 0.00 59.36 59.36 2dk5 h GLU 52 Cb 1.56 0.22 -0.01 0.00 -0.10 0.00 0.00 28.75 30.42 2dk5 h GLU 52 CO -0.00 1.29 -0.37 0.82 -1.16 0.00 0.00 179.01 179.58 2dk5 h ILE 53 N -0.02 1.28 -0.02 3.13 5.03 0.10 0.82 117.51 127.83 2dk5 h ILE 53 Ca -0.33 -1.34 -0.01 0.00 -0.12 0.00 0.00 64.86 63.06 2dk5 h ILE 53 Cb 1.99 1.67 0.00 0.00 -3.03 0.00 0.00 36.82 37.46 2dk5 h ILE 53 CO 0.14 0.39 -0.04 0.78 -0.68 0.00 0.00 178.15 178.74 2dk5 h ASN 54 N 0.07 0.06 -0.18 1.72 4.21 -0.51 0.42 115.58 121.37 2dk5 h ASN 54 Ca 0.01 -0.58 -0.14 0.00 1.21 0.00 0.00 56.30 56.79 2dk5 h ASN 54 Cb 0.70 -0.02 -0.01 0.00 -1.12 0.00 0.00 38.32 37.87 2dk5 h ASN 54 CO 0.05 0.63 -0.38 0.07 -1.29 0.00 0.00 177.43 176.51 2dk5 h LYS 55 N -0.50 0.71 0.15 0.81 2.10 -1.49 -2.57 116.57 115.77 2dk5 h LYS 55 Ca 0.00 -0.36 -0.01 0.00 -2.00 0.00 0.00 60.65 58.28 2dk5 h LYS 55 Cb 0.62 0.01 0.00 0.00 -0.90 0.00 0.00 32.23 31.96 2dk5 h LYS 55 CO 0.01 0.97 -0.07 0.82 -2.00 0.00 0.00 179.45 179.18 2dk5 h ILE 56 N 0.58 0.98 -0.72 0.07 2.04 -0.89 -0.63 117.51 118.94 2dk5 h ILE 56 Ca 0.05 -0.98 0.14 0.00 1.00 0.00 0.00 64.86 65.06 2dk5 h ILE 56 Cb 0.92 1.55 -0.09 0.00 -0.74 0.00 0.00 36.82 38.46 2dk5 h ILE 56 CO 0.08 0.22 0.27 -0.07 0.00 0.00 0.00 178.15 178.65 2dk5 h LEU 57 N -0.71 0.23 0.53 1.44 3.38 -0.96 -2.17 115.31 117.05 2dk5 h LEU 57 Ca -0.02 0.11 -0.03 0.00 0.09 0.00 0.00 57.88 58.03 2dk5 h LEU 57 Cb 0.51 0.10 0.01 0.00 0.09 0.00 0.00 40.66 41.36 2dk5 h LEU 57 CO 0.03 0.09 -0.26 0.50 0.09 0.00 0.00 178.44 178.90 2dk5 h LYS 58 N 0.41 -0.69 -0.75 1.13 3.11 -1.49 -3.06 116.57 115.22 2dk5 h LYS 58 Ca 0.39 0.05 0.19 0.00 -2.81 0.00 0.00 60.65 58.47 2dk5 h LYS 58 Cb 0.59 0.16 -0.14 0.00 -1.00 0.00 0.00 32.23 31.84 2dk5 h LYS 58 CO -0.40 -0.46 -0.06 0.09 -2.81 0.00 0.00 179.45 175.80 2dk5 n ASN 59 N -5.01 -0.16 -0.12 4.20 3.02 -0.25 0.20 115.26 117.14 2dk5 n ASN 59 Ca -0.09 1.29 -0.08 0.00 -0.03 0.00 0.00 54.58 55.67 2dk5 n ASN 59 Cb 0.28 -0.44 0.01 0.00 -0.61 0.00 0.00 39.78 39.02 2dk5 n ASN 59 CO 0.00 0.00 0.00 -0.07 -2.62 0.00 0.00 177.26 174.57 2dk5 h LEU 60 N 0.00 0.39 -1.11 3.41 3.38 -1.43 -0.64 115.31 119.31 2dk5 h LEU 60 Ca 0.42 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.39 2dk5 h LEU 60 Cb 0.79 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.46 2dk5 h LEU 60 CO -0.74 0.28 0.15 -0.62 0.09 0.00 0.00 178.44 177.61 2dk5 n GLU 61 N -4.86 0.11 -0.01 1.13 1.02 0.52 0.12 120.64 118.67 2dk5 n GLU 61 Ca 0.01 0.60 -0.01 0.00 -0.02 0.00 0.00 57.16 57.73 2dk5 n GLU 61 Cb 0.05 -2.01 -0.12 0.00 -0.02 0.00 0.00 31.44 29.34 2dk5 n GLU 61 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 2dk5 n SER 62 N -2.13 0.55 -1.01 1.62 2.88 -0.27 -3.99 113.62 111.27 2dk5 n SER 62 Ca -0.01 0.24 0.05 0.00 -1.33 0.00 0.00 58.87 57.82 2dk5 n SER 62 Cb 0.18 0.58 0.19 0.00 -0.75 0.00 0.00 64.21 64.41 2dk5 n SER 62 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 2dk5 n LYS 63 N -2.78 2.55 -2.88 -1.46 5.02 0.12 -4.88 118.16 113.84 2dk5 n LYS 63 Ca -0.15 -1.52 -0.20 0.00 -2.02 0.00 0.00 58.31 54.43 2dk5 n LYS 63 Cb 0.89 -1.65 0.01 0.00 -0.02 0.00 0.00 35.03 34.25 2dk5 n LYS 63 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 2dk5 n LYS 64 N 0.44 -3.33 -0.11 1.97 5.02 -1.10 -4.85 118.16 116.20 2dk5 n LYS 64 Ca 0.14 0.72 -0.20 0.00 -2.02 0.00 0.00 58.31 56.95 2dk5 n LYS 64 Cb 0.57 -5.44 -0.12 0.00 -0.02 0.00 0.00 35.03 30.01 2dk5 n LYS 64 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 2dk5 n LEU 65 N -3.49 2.79 -4.38 -0.35 4.77 -1.10 -4.68 117.00 110.56 2dk5 n LEU 65 Ca -0.11 -0.01 -0.22 0.00 -0.03 0.00 0.00 56.01 55.64 2dk5 n LEU 65 Cb 0.60 -0.94 -0.08 0.00 -2.33 0.00 0.00 43.42 40.67 2dk5 n LEU 65 CO 0.38 0.87 -0.15 0.27 -1.33 0.00 0.00 177.39 177.43 2dk5 s ILE 66 N -2.52 0.25 0.17 -0.08 -4.36 -1.25 -0.10 121.20 113.32 2dk5 s ILE 66 Ca -0.33 -2.00 -0.17 0.00 -0.26 0.00 0.00 60.65 57.89 2dk5 s ILE 66 Cb 0.09 -2.43 0.03 0.00 1.25 0.00 0.00 42.46 41.40 2dk5 s ILE 66 CO 0.62 0.00 0.49 -1.59 0.24 0.00 0.00 174.94 174.70 2dk5 s LYS 67 N -3.60 1.28 -0.18 0.37 -2.85 -0.71 -4.17 119.74 109.88 2dk5 s LYS 67 Ca 0.33 -0.79 -0.15 0.00 -1.00 0.00 0.00 55.97 54.37 2dk5 s LYS 67 Cb 0.03 0.51 -0.04 0.00 -2.06 0.00 0.00 37.83 36.26 2dk5 s LYS 67 CO 0.21 -0.53 0.33 0.00 0.10 0.00 0.00 175.35 175.46 2dk5 s ALA 68 N -3.84 3.57 0.15 0.59 0.00 -1.26 -2.52 121.76 118.44 2dk5 s ALA 68 Ca 0.07 -0.49 0.09 0.00 0.00 0.00 0.00 51.96 51.62 2dk5 s ALA 68 Cb -0.00 -2.48 -0.04 0.00 0.00 0.00 0.00 23.12 20.59 2dk5 s ALA 68 CO -0.06 -0.06 -0.19 0.08 0.00 0.00 0.00 175.76 175.52 2dk5 s VAL 69 N 0.80 1.82 -0.52 0.00 1.01 0.72 -4.97 120.40 119.25 2dk5 s VAL 69 Ca 0.17 -1.82 -0.06 0.00 0.00 0.00 0.00 61.98 60.28 2dk5 s VAL 69 Cb -0.14 -1.78 0.14 0.00 0.00 0.00 0.00 36.38 34.60 2dk5 s VAL 69 CO 0.06 -0.23 0.36 -0.75 0.00 0.00 0.00 175.10 174.54 2dk5 s LYS 70 N -2.53 2.44 0.17 2.72 2.47 -1.26 -2.13 119.74 121.62 2dk5 s LYS 70 Ca 0.13 -2.06 -0.31 0.00 -1.56 0.00 0.00 55.97 52.18 2dk5 s LYS 70 Cb -0.07 -3.80 -0.09 0.00 -1.46 0.00 0.00 37.83 32.41 2dk5 s LYS 70 CO 0.06 -1.16 1.39 -1.12 0.16 0.00 0.00 175.35 174.68 2dk5 s SER 71 N 1.79 6.79 -0.48 1.43 0.01 -1.26 -4.85 113.70 117.14 2dk5 s SER 71 Ca 0.11 2.44 -0.44 0.00 1.31 0.00 0.00 55.95 59.37 2dk5 s SER 71 Cb -0.22 -2.60 -0.19 0.00 0.21 0.00 0.00 66.02 63.22 2dk5 s SER 71 CO -0.03 -0.63 1.72 0.55 0.41 0.00 0.00 173.24 175.26 2dk5 n VAL 72 N 3.20 0.00 -3.83 3.43 3.14 -1.26 -4.85 118.33 118.16 2dk5 n VAL 72 Ca 0.09 0.00 -0.01 0.00 -2.96 0.00 0.00 64.34 61.46 2dk5 n VAL 72 Cb 0.42 -0.48 0.01 0.00 -1.06 0.00 0.00 33.84 32.73 2dk5 n VAL 72 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 2dk5 s ALA 73 N 3.95 -1.93 -0.26 1.55 0.00 -1.26 -5.08 121.76 118.73 2dk5 s ALA 73 Ca 1.06 0.05 -0.16 0.00 0.00 0.00 0.00 51.96 52.90 2dk5 s ALA 73 Cb -1.43 0.68 -0.14 0.00 0.00 0.00 0.00 23.12 22.23 2dk5 s ALA 73 CO 0.73 -1.08 -0.22 0.00 0.00 0.00 0.00 175.76 175.19 2dk5 n ALA 74 N -0.66 1.09 -1.36 0.00 0.00 -1.26 -4.99 120.51 113.33 2dk5 n ALA 74 Ca -0.03 -0.95 -0.30 0.00 0.00 0.00 0.00 53.44 52.16 2dk5 n ALA 74 Cb 0.60 -0.04 0.13 0.00 0.00 0.00 0.00 19.45 20.14 2dk5 n ALA 74 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 2dk5 s SER 75 N -7.34 3.74 -0.00 0.00 0.01 -1.26 -5.01 113.70 103.84 2dk5 s SER 75 Ca -0.36 1.33 -0.26 0.00 1.31 0.00 0.00 55.95 57.97 2dk5 s SER 75 Cb 0.13 -2.02 -0.04 0.00 0.21 0.00 0.00 66.02 64.30 2dk5 s SER 75 CO 0.52 -2.45 0.79 -0.54 0.41 0.00 0.00 173.24 171.97 2dk5 s LYS 76 N -5.05 4.49 0.31 12.44 -0.14 -1.26 -5.04 119.74 125.48 2dk5 s LYS 76 Ca 0.63 1.08 -0.07 0.00 -1.36 0.00 0.00 55.97 56.25 2dk5 s LYS 76 Cb -0.16 -3.41 0.00 0.00 -1.68 0.00 0.00 37.83 32.57 2dk5 s LYS 76 CO 0.56 0.13 0.48 0.15 -0.76 0.00 0.00 175.35 175.91 2dk5 s LYS 77 N 0.48 1.77 -0.23 1.68 1.02 -1.26 -5.15 119.74 118.05 2dk5 s LYS 77 Ca 0.41 -1.56 -0.03 0.00 0.02 0.00 0.00 55.97 54.81 2dk5 s LYS 77 Cb -0.20 0.45 0.10 0.00 -0.52 0.00 0.00 37.83 37.67 2dk5 s LYS 77 CO 0.22 -0.74 0.22 0.21 -0.92 0.00 0.00 175.35 174.35 2dk5 s LYS 78 N -3.39 0.21 -0.18 1.68 2.47 -1.26 -4.90 119.74 114.37 2dk5 s LYS 78 Ca 0.27 0.03 -0.09 0.00 -1.56 0.00 0.00 55.97 54.62 2dk5 s LYS 78 Cb -0.00 -1.13 -0.05 0.00 -1.46 0.00 0.00 37.83 35.19 2dk5 s LYS 78 CO 0.15 -0.78 0.13 0.08 0.16 0.00 0.00 175.35 175.10 2dk5 s VAL 79 N 2.30 5.41 -0.16 4.02 1.01 -0.90 -2.61 120.40 129.46 2dk5 s VAL 79 Ca 0.07 0.19 -0.03 0.00 0.00 0.00 0.00 61.98 62.22 2dk5 s VAL 79 Cb -0.15 -3.45 -0.02 0.00 0.00 0.00 0.00 36.38 32.76 2dk5 s VAL 79 CO -0.19 0.48 -0.07 -0.31 0.00 0.00 0.00 175.10 175.01 2dk5 s TYR 80 N 0.07 2.94 0.31 5.22 2.02 0.36 -0.20 117.35 128.06 2dk5 s TYR 80 Ca 0.09 -0.55 0.07 0.00 -0.37 0.00 0.00 57.07 56.31 2dk5 s TYR 80 Cb -0.11 -1.95 -0.02 0.00 -0.40 0.00 0.00 41.96 39.47 2dk5 s TYR 80 CO -0.01 -0.20 0.24 0.00 -1.57 0.00 0.00 175.55 174.01 2dk5 n MET 81 N 3.79 0.39 -1.84 -0.62 0.00 -1.05 -2.08 117.12 115.72 2dk5 n MET 81 Ca -0.18 -3.01 -0.41 0.00 0.00 0.00 0.00 57.70 54.10 2dk5 n MET 81 Cb 0.52 2.38 -0.01 0.00 0.00 0.00 0.00 33.22 36.11 2dk5 n MET 81 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 175.97 175.46 2dk5 s LEU 82 N 0.00 4.34 0.42 3.17 1.43 -1.26 -1.74 118.68 125.04 2dk5 s LEU 82 Ca 0.34 2.96 0.29 0.00 -1.03 0.00 0.00 54.13 56.68 2dk5 s LEU 82 Cb 0.02 -3.65 1.06 0.00 0.03 0.00 0.00 46.19 43.65 2dk5 s LEU 82 CO 0.24 -0.84 1.83 0.22 0.23 0.00 0.00 176.35 178.03 2dk5 h TYR 83 N 3.81 0.00 -0.28 0.29 3.20 -0.74 -3.03 116.97 120.22 2dk5 h TYR 83 Ca -0.49 0.00 -0.18 0.00 3.14 0.00 0.00 58.73 61.20 2dk5 h TYR 83 Cb 1.23 0.00 -0.00 0.00 1.54 0.00 0.00 36.73 39.50 2dk5 h TYR 83 CO 0.56 0.00 -0.54 -0.91 -1.64 0.00 0.00 178.16 175.63 2dk5 h ASN 84 N 0.00 0.93 -3.32 -2.11 2.35 -1.86 -3.45 115.58 108.11 2dk5 h ASN 84 Ca 0.00 -0.50 -0.47 0.00 -0.55 0.00 0.00 56.30 54.79 2dk5 h ASN 84 Cb 0.56 -0.27 0.22 0.00 0.05 0.00 0.00 38.32 38.88 2dk5 h ASN 84 CO 0.00 1.29 -0.18 0.18 -1.65 0.00 0.00 177.43 177.07 2dk5 n LEU 85 N -4.00 -0.43 -0.00 1.61 4.77 -1.15 -4.95 117.00 112.85 2dk5 n LEU 85 Ca -0.04 0.01 0.10 0.00 -0.03 0.00 0.00 56.01 56.06 2dk5 n LEU 85 Cb 0.62 -1.26 -0.14 0.00 -2.33 0.00 0.00 43.42 40.32 2dk5 n LEU 85 CO 0.50 -3.04 -0.36 -1.54 -1.33 0.00 0.00 177.39 171.62 2dk5 n SER 86 N -4.00 0.55 0.00 -1.43 3.41 -1.26 -5.03 113.62 105.86 2dk5 n SER 86 Ca 0.05 -0.54 0.00 0.00 -0.26 0.00 0.00 58.87 58.11 2dk5 n SER 86 Cb 0.55 1.43 0.00 0.00 -0.26 0.00 0.00 64.21 65.93 2dk5 n SER 86 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2dk5 n GLY 87 N 1.39 -1.23 3.73 5.00 0.00 -1.26 -4.96 105.19 107.85 2dk5 n GLY 87 Ca 0.00 -1.64 -0.30 0.00 0.00 0.00 0.00 46.02 44.09 2dk5 n GLY 87 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2dk5 s PRO 88 N 0.00 1.46 -0.10 1.61 0.04 -1.26 -5.01 135.00 131.74 2dk5 s PRO 88 Ca 0.00 0.89 -0.14 0.00 0.04 0.00 0.00 61.00 61.79 2dk5 s PRO 88 Cb 0.00 -1.83 -0.12 0.00 0.04 0.00 0.00 34.50 32.60 2dk5 s PRO 88 CO 0.00 -2.12 0.46 1.03 0.04 0.00 0.00 177.00 176.41 2dk5 h SER 89 N -1.47 -0.07 -3.01 6.66 0.87 -2.03 -3.43 113.55 111.08 2dk5 h SER 89 Ca -0.48 -0.37 -0.57 0.00 -1.23 0.00 0.00 61.79 59.14 2dk5 h SER 89 Cb 1.27 0.02 -0.04 0.00 -0.44 0.00 0.00 62.40 63.21 2dk5 h SER 89 CO 0.54 0.58 1.10 -0.55 -0.53 0.00 0.00 176.83 177.97 2dk5 s SER 90 N -5.69 6.34 0.00 6.23 0.15 -1.26 -5.27 113.70 114.20 2dk5 s SER 90 Ca -0.09 1.20 0.00 0.00 0.70 0.00 0.00 55.95 57.76 2dk5 s SER 90 Cb -0.01 -2.54 0.00 0.00 -1.71 0.00 0.00 66.02 61.77 2dk5 s SER 90 CO 0.33 -1.36 0.00 0.61 1.20 0.00 0.00 173.24 174.01