#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ekx s SER 2 N 0.00 1.37 -0.79 1.61 1.04 -1.26 -5.10 113.70 110.57 2ekx s SER 2 Ca 0.00 -0.50 -0.15 0.00 0.48 0.00 0.00 55.95 55.78 2ekx s SER 2 Cb 0.00 -0.05 0.20 0.00 0.10 0.00 0.00 66.02 66.27 2ekx s SER 2 CO 0.00 -0.06 0.74 -0.44 0.98 0.00 0.00 173.24 174.46 2ekx s SER 3 N -1.36 6.67 -0.29 7.02 0.01 -1.26 -4.98 113.70 119.52 2ekx s SER 3 Ca -0.03 -2.52 -0.24 0.00 1.31 0.00 0.00 55.95 54.47 2ekx s SER 3 Cb -0.09 -2.22 0.14 0.00 0.21 0.00 0.00 66.02 64.06 2ekx s SER 3 CO 0.01 -0.64 1.12 -0.83 0.41 0.00 0.00 173.24 173.31 2ekx s GLY 4 N 2.45 -0.02 -0.54 3.44 0.00 -1.26 -5.04 107.32 106.34 2ekx s GLY 4 Ca 0.16 2.91 0.01 0.00 0.00 0.00 0.00 44.72 47.80 2ekx s GLY 4 CO -0.07 1.92 1.79 1.44 0.00 0.00 0.00 173.10 178.18 2ekx n SER 5 N 2.20 6.43 -4.89 1.64 7.64 -1.26 -4.99 113.62 120.38 2ekx n SER 5 Ca -0.12 -3.77 -0.21 0.00 1.01 0.00 0.00 58.87 55.78 2ekx n SER 5 Cb 0.56 -0.79 0.08 0.00 -1.01 0.00 0.00 64.21 63.05 2ekx n SER 5 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2ekx s SER 6 N -2.26 4.80 0.00 6.43 0.15 -1.26 -5.07 113.70 116.48 2ekx s SER 6 Ca 0.60 -0.68 0.00 0.00 0.70 0.00 0.00 55.95 56.57 2ekx s SER 6 Cb 0.48 0.21 0.00 0.00 -1.71 0.00 0.00 66.02 64.99 2ekx s SER 6 CO 0.01 -1.55 0.00 0.61 1.20 0.00 0.00 173.24 173.51 2ekx n GLY 7 N -2.47 1.80 0.14 9.45 0.00 -1.26 -4.98 105.19 107.87 2ekx n GLY 7 Ca 0.16 -1.66 -0.22 0.00 0.00 0.00 0.00 46.02 44.30 2ekx n GLY 7 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2ekx h LEU 8 N 0.00 0.50 -1.88 0.99 3.38 -1.99 -3.35 115.31 112.97 2ekx h LEU 8 Ca 0.00 -0.93 0.54 0.00 0.09 0.00 0.00 57.88 57.58 2ekx h LEU 8 Cb 0.00 -0.16 -0.09 0.00 0.09 0.00 0.00 40.66 40.50 2ekx h LEU 8 CO 0.00 1.80 1.28 -0.78 0.09 0.00 0.00 178.44 180.83 2ekx h ASP 9 N 0.02 0.04 -0.08 -0.43 1.82 -1.93 0.16 116.42 116.02 2ekx h ASP 9 Ca -0.37 0.03 0.02 0.00 -0.39 0.00 0.00 57.03 56.32 2ekx h ASP 9 Cb 2.02 0.03 -0.05 0.00 0.68 0.00 0.00 39.33 42.01 2ekx h ASP 9 CO 0.12 -0.05 -0.45 0.44 -1.61 0.00 0.00 179.24 177.69 2ekx h ASP 10 N 0.01 -1.43 -2.18 2.28 3.32 -1.95 -3.42 116.42 113.05 2ekx h ASP 10 Ca 0.90 0.17 -0.46 0.00 0.02 0.00 0.00 57.03 57.66 2ekx h ASP 10 Cb 3.49 0.55 0.24 0.00 0.22 0.00 0.00 39.33 43.83 2ekx h ASP 10 CO -0.10 -0.42 -1.23 -1.22 -1.72 0.00 0.00 179.24 174.56 2ekx n TYR 11 N -4.95 -1.40 -0.07 4.55 4.01 0.04 -5.00 117.16 114.34 2ekx n TYR 11 Ca -0.05 0.18 -0.07 0.00 -0.16 0.00 0.00 57.90 57.80 2ekx n TYR 11 Cb 0.32 -1.54 -0.02 0.00 -0.31 0.00 0.00 39.34 37.79 2ekx n TYR 11 CO 0.00 0.00 0.00 -0.25 -0.46 0.00 0.00 176.86 176.15 2ekx n ASP 12 N -1.30 1.69 -0.30 7.72 8.00 -1.26 -4.48 116.55 126.61 2ekx n ASP 12 Ca 0.00 0.41 0.14 0.00 0.71 0.00 0.00 54.79 56.04 2ekx n ASP 12 Cb 0.64 -0.76 0.27 0.00 -0.02 0.00 0.00 41.12 41.24 2ekx n ASP 12 CO 0.00 0.00 0.00 -2.67 -0.39 0.00 0.00 177.20 174.14 2ekx n TRP 13 N -4.30 0.57 -1.53 1.24 4.27 -1.26 -4.09 117.44 112.34 2ekx n TRP 13 Ca -0.10 1.06 -0.32 0.00 -3.89 0.00 0.00 57.50 54.25 2ekx n TRP 13 Cb 0.38 -1.17 -0.10 0.00 -1.36 0.00 0.00 31.31 29.06 2ekx n TRP 13 CO 0.00 0.00 0.00 0.34 -2.29 0.00 0.00 177.69 175.74 2ekx n PHE 14 N -5.27 0.92 0.10 -2.67 -0.00 -1.26 -2.71 117.46 106.57 2ekx n PHE 14 Ca 0.21 0.16 -0.06 0.00 -0.00 0.00 0.00 57.45 57.76 2ekx n PHE 14 Cb 0.69 -2.26 0.06 0.00 -0.00 0.00 0.00 39.48 37.97 2ekx n PHE 14 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 2ekx h ALA 15 N 14.93 0.71 0.00 3.13 0.00 0.80 -3.47 119.26 135.37 2ekx h ALA 15 Ca -0.10 -0.65 0.00 0.00 0.00 0.00 0.00 54.91 54.16 2ekx h ALA 15 Cb 1.22 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.91 2ekx h ALA 15 CO 1.27 0.85 0.00 0.41 0.00 0.00 0.00 179.25 181.78 2ekx n GLY 16 N 0.58 0.90 3.57 0.00 0.00 -0.87 -4.83 105.19 104.55 2ekx n GLY 16 Ca -0.02 -1.41 -0.43 0.00 0.00 0.00 0.00 46.02 44.16 2ekx n GLY 16 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2ekx s ASN 17 N -4.00 6.50 0.04 1.61 3.84 -1.26 -1.31 114.94 120.36 2ekx s ASN 17 Ca 0.00 0.15 0.01 0.00 0.21 0.00 0.00 52.86 53.23 2ekx s ASN 17 Cb 0.00 -2.51 -0.02 0.00 -0.55 0.00 0.00 41.25 38.17 2ekx s ASN 17 CO 0.00 -1.27 -0.05 0.27 -2.79 0.00 0.00 177.10 173.26 2ekx s ILE 18 N 4.36 0.32 0.65 -5.21 -4.36 -1.26 -5.02 121.20 110.68 2ekx s ILE 18 Ca 0.41 -1.13 -0.08 0.00 -0.26 0.00 0.00 60.65 59.59 2ekx s ILE 18 Cb -0.09 -0.61 0.02 0.00 1.25 0.00 0.00 42.46 43.04 2ekx s ILE 18 CO 0.27 -0.53 0.99 -0.55 0.24 0.00 0.00 174.94 175.35 2ekx s SER 19 N -1.75 5.38 0.29 4.36 0.15 -1.26 -4.82 113.70 116.05 2ekx s SER 19 Ca -0.10 0.79 -0.02 0.00 0.70 0.00 0.00 55.95 57.32 2ekx s SER 19 Cb -0.07 -1.66 0.42 0.00 -1.71 0.00 0.00 66.02 63.00 2ekx s SER 19 CO -0.02 -1.26 1.96 0.03 1.20 0.00 0.00 173.24 175.16 2ekx h ARG 20 N -0.41 1.12 -0.17 5.44 2.47 -2.01 0.47 114.38 121.28 2ekx h ARG 20 Ca -0.45 -0.07 -0.06 0.00 -1.26 0.00 0.00 59.98 58.15 2ekx h ARG 20 Cb 1.27 -0.25 -0.00 0.00 -1.65 0.00 0.00 29.97 29.33 2ekx h ARG 20 CO 0.62 0.74 -0.11 1.03 0.56 0.00 0.00 179.97 182.81 2ekx h SER 21 N 1.15 0.40 0.70 7.04 0.87 -2.00 -3.14 113.55 118.58 2ekx h SER 21 Ca 0.31 -0.43 -0.03 0.00 -1.23 0.00 0.00 61.79 60.40 2ekx h SER 21 Cb -0.13 -0.11 0.01 0.00 -0.44 0.00 0.00 62.40 61.73 2ekx h SER 21 CO -0.07 0.75 -0.34 1.56 -0.53 0.00 0.00 176.83 178.20 2ekx h GLN 22 N 0.05 -0.91 -0.77 2.24 7.50 -1.86 -0.31 115.11 121.05 2ekx h GLN 22 Ca 0.04 0.06 0.19 0.00 0.50 0.00 0.00 58.65 59.44 2ekx h GLN 22 Cb 0.61 0.21 -0.14 0.00 0.05 0.00 0.00 27.48 28.20 2ekx h GLN 22 CO 0.03 -0.61 -0.05 -1.13 -1.50 0.00 0.00 178.83 175.57 2ekx n SER 23 N -4.98 -0.15 0.17 1.46 3.41 0.13 -0.51 113.62 113.14 2ekx n SER 23 Ca -0.12 1.31 -0.09 0.00 -0.26 0.00 0.00 58.87 59.71 2ekx n SER 23 Cb 0.37 -0.45 -0.05 0.00 -0.26 0.00 0.00 64.21 63.83 2ekx n SER 23 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 2ekx h GLU 24 N 0.00 -0.49 -0.99 4.33 5.08 -1.49 -3.15 114.58 117.88 2ekx h GLU 24 Ca 0.44 0.03 0.18 0.00 -1.00 0.00 0.00 59.36 59.01 2ekx h GLU 24 Cb 0.84 0.11 -0.18 0.00 0.50 0.00 0.00 28.75 30.02 2ekx h GLU 24 CO -0.74 -0.28 -0.31 0.37 -1.00 0.00 0.00 179.01 177.05 2ekx h GLN 25 N -1.10 -0.00 0.05 2.33 5.75 0.10 -0.89 115.11 121.34 2ekx h GLN 25 Ca -0.05 0.00 0.01 0.00 -0.15 0.00 0.00 58.65 58.45 2ekx h GLN 25 Cb 0.44 0.00 -0.02 0.00 1.07 0.00 0.00 27.48 28.97 2ekx h GLN 25 CO 0.09 -0.00 -0.25 -0.07 -2.65 0.00 0.00 178.83 175.94 2ekx h LEU 26 N -0.00 -0.75 -0.87 -2.39 3.38 -0.89 0.13 115.31 113.92 2ekx h LEU 26 Ca 0.42 0.08 0.15 0.00 0.09 0.00 0.00 57.88 58.62 2ekx h LEU 26 Cb 0.67 0.28 -0.15 0.00 0.09 0.00 0.00 40.66 41.54 2ekx h LEU 26 CO -1.00 -0.26 -0.31 -0.07 0.09 0.00 0.00 178.44 176.88 2ekx h LEU 27 N -0.35 -1.14 -2.07 1.67 3.38 -1.16 1.55 115.31 117.18 2ekx h LEU 27 Ca -0.00 0.28 -0.01 0.00 0.09 0.00 0.00 57.88 58.24 2ekx h LEU 27 Cb 0.36 0.64 -0.00 0.00 0.09 0.00 0.00 40.66 41.74 2ekx h LEU 27 CO -0.14 -0.29 -0.04 0.03 0.09 0.00 0.00 178.44 178.09 2ekx h ARG 28 N -0.04 0.00 0.07 1.13 3.08 -0.84 -2.30 114.38 115.48 2ekx h ARG 28 Ca 0.35 0.00 -0.22 0.00 0.07 0.00 0.00 59.98 60.18 2ekx h ARG 28 Cb 0.61 0.00 0.02 0.00 0.08 0.00 0.00 29.97 30.68 2ekx h ARG 28 CO -0.89 0.04 -0.92 0.37 -1.07 0.00 0.00 179.97 177.49 2ekx h GLN 29 N 0.00 0.50 0.16 0.04 4.15 0.48 -3.34 115.11 117.11 2ekx h GLN 29 Ca -0.00 -0.63 0.02 0.00 0.77 0.00 0.00 58.65 58.80 2ekx h GLN 29 Cb 0.07 0.20 -0.04 0.00 0.21 0.00 0.00 27.48 27.93 2ekx h GLN 29 CO 0.00 1.25 -0.34 -0.22 -1.93 0.00 0.00 178.83 177.60 2ekx h LYS 30 N 0.04 -0.58 0.00 1.69 1.63 0.17 -3.46 116.57 116.06 2ekx h LYS 30 Ca -0.13 0.04 0.00 0.00 -0.85 0.00 0.00 60.65 59.70 2ekx h LYS 30 Cb 1.63 0.13 0.00 0.00 -0.60 0.00 0.00 32.23 33.39 2ekx h LYS 30 CO 0.18 -0.38 0.00 0.41 -3.45 0.00 0.00 179.45 176.20 2ekx n GLY 31 N -1.43 0.59 3.77 5.01 0.00 -1.05 -5.03 105.19 107.04 2ekx n GLY 31 Ca -0.07 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.55 2ekx n GLY 31 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2ekx s LYS 32 N -0.17 4.68 0.45 1.61 1.02 -1.26 -5.04 119.74 121.03 2ekx s LYS 32 Ca 0.00 1.29 -0.23 0.00 0.02 0.00 0.00 55.97 57.05 2ekx s LYS 32 Cb 0.00 -3.27 -0.08 0.00 -0.52 0.00 0.00 37.83 33.96 2ekx s LYS 32 CO 0.00 0.54 1.11 -1.21 -0.92 0.00 0.00 175.35 174.87 2ekx s GLU 33 N -1.12 3.84 -1.03 1.68 8.01 -1.26 -2.98 118.70 125.84 2ekx s GLU 33 Ca 0.38 1.63 0.00 0.00 0.01 0.00 0.00 54.97 56.99 2ekx s GLU 33 Cb -0.24 -2.37 0.00 0.00 -4.31 0.00 0.00 34.13 27.21 2ekx s GLU 33 CO 0.28 -0.45 0.00 0.41 0.01 0.00 0.00 175.26 175.51 2ekx n GLY 34 N 0.30 0.92 3.55 -1.39 0.00 -1.26 -3.93 105.19 103.38 2ekx n GLY 34 Ca 0.07 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.72 2ekx n GLY 34 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ekx n ALA 35 N 0.17 -0.50 -2.92 4.61 0.00 -1.16 -1.64 120.51 119.07 2ekx n ALA 35 Ca -0.10 -0.04 -0.10 0.00 0.00 0.00 0.00 53.44 53.20 2ekx n ALA 35 Cb 0.33 -1.98 -0.05 0.00 0.00 0.00 0.00 19.45 17.74 2ekx n ALA 35 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 177.50 176.91 2ekx s PHE 36 N -1.64 -0.13 0.36 0.00 -0.71 -0.38 -1.25 117.98 114.22 2ekx s PHE 36 Ca 0.73 -0.17 -0.10 0.00 -1.04 0.00 0.00 56.93 56.34 2ekx s PHE 36 Cb -0.42 0.18 0.03 0.00 -1.21 0.00 0.00 43.02 41.61 2ekx s PHE 36 CO 0.50 -0.65 0.64 0.00 -1.34 0.00 0.00 175.22 174.37 2ekx s MET 37 N -3.63 2.05 -0.08 1.99 0.23 -1.21 0.12 119.30 118.77 2ekx s MET 37 Ca 0.02 -1.55 -0.05 0.00 -1.03 0.00 0.00 55.69 53.08 2ekx s MET 37 Cb 0.02 0.54 0.03 0.00 -1.53 0.00 0.00 34.83 33.89 2ekx s MET 37 CO -0.11 -0.91 0.19 0.08 -2.03 0.00 0.00 175.02 172.25 2ekx s VAL 38 N -2.77 -0.02 0.15 5.16 1.01 -1.10 -3.56 120.40 119.26 2ekx s VAL 38 Ca 0.22 0.08 0.07 0.00 0.00 0.00 0.00 61.98 62.35 2ekx s VAL 38 Cb -0.03 -0.29 -0.04 0.00 0.00 0.00 0.00 36.38 36.02 2ekx s VAL 38 CO 0.15 0.03 -0.15 0.00 0.00 0.00 0.00 175.10 175.13 2ekx s ARG 39 N 0.68 1.14 -0.24 2.72 1.70 -1.03 0.12 118.95 124.04 2ekx s ARG 39 Ca -0.05 -1.35 -0.07 0.00 -0.47 0.00 0.00 55.73 53.79 2ekx s ARG 39 Cb -0.06 -1.05 -0.03 0.00 -0.57 0.00 0.00 34.95 33.24 2ekx s ARG 39 CO -0.04 0.20 0.06 1.21 -1.08 0.00 0.00 175.30 175.66 2ekx s ASN 40 N -2.67 5.10 1.29 -2.89 2.47 -0.42 -2.73 114.94 115.09 2ekx s ASN 40 Ca 0.13 -0.20 -0.17 0.00 0.42 0.00 0.00 52.86 53.03 2ekx s ASN 40 Cb -0.04 -1.91 0.33 0.00 -1.45 0.00 0.00 41.25 38.17 2ekx s ASN 40 CO 0.04 -0.02 0.98 -0.55 -3.72 0.00 0.00 177.10 173.83 2ekx s SER 41 N 1.54 -0.06 0.37 -4.21 0.15 -0.42 -4.47 113.70 106.60 2ekx s SER 41 Ca 0.06 1.19 -0.28 0.00 0.70 0.00 0.00 55.95 57.62 2ekx s SER 41 Cb -0.15 -1.80 -0.10 0.00 -1.71 0.00 0.00 66.02 62.26 2ekx s SER 41 CO 0.03 -4.80 1.39 -0.55 1.20 0.00 0.00 173.24 170.52 2ekx s SER 42 N -2.79 6.46 -1.58 5.45 0.15 -1.26 -2.38 113.70 117.75 2ekx s SER 42 Ca 0.69 2.86 -0.02 0.00 0.70 0.00 0.00 55.95 60.17 2ekx s SER 42 Cb -0.20 -2.66 0.00 0.00 -1.71 0.00 0.00 66.02 61.46 2ekx s SER 42 CO 0.62 -0.77 0.33 0.00 1.20 0.00 0.00 173.24 174.62 2ekx n GLN 43 N 0.50 -3.35 -2.38 5.44 6.02 -1.26 -2.48 117.38 119.86 2ekx n GLN 43 Ca 0.01 0.91 -0.04 0.00 -0.01 0.00 0.00 57.00 57.87 2ekx n GLN 43 Cb 0.41 -5.61 -0.01 0.00 1.02 0.00 0.00 30.24 26.05 2ekx n GLN 43 CO 0.00 0.00 0.00 1.55 -1.01 0.00 0.00 177.06 177.60 2ekx n VAL 44 N -4.27 0.00 0.20 5.09 3.14 -1.00 -4.77 118.33 116.72 2ekx n VAL 44 Ca -0.16 0.00 -0.08 0.00 -2.96 0.00 0.00 64.34 61.13 2ekx n VAL 44 Cb 0.64 -0.05 -0.04 0.00 -1.06 0.00 0.00 33.84 33.34 2ekx n VAL 44 CO 0.00 0.00 0.00 1.23 -6.46 0.00 0.00 176.83 171.60 2ekx h GLY 45 N -0.08 -0.56 -0.82 7.55 0.00 -1.66 -3.48 103.07 104.02 2ekx h GLY 45 Ca -0.06 0.21 -0.62 0.00 0.00 0.00 0.00 47.33 46.86 2ekx h GLY 45 CO 0.08 -0.21 -0.52 1.06 0.00 0.00 0.00 176.54 176.96 2ekx s MET 46 N -3.45 2.06 0.07 4.80 -1.94 -1.26 -5.02 119.30 114.56 2ekx s MET 46 Ca -0.08 -2.29 0.03 0.00 -1.71 0.00 0.00 55.69 51.65 2ekx s MET 46 Cb 0.01 -1.13 -0.03 0.00 2.01 0.00 0.00 34.83 35.69 2ekx s MET 46 CO 0.24 -0.40 -0.10 0.71 -0.01 0.00 0.00 175.02 175.46 2ekx s TYR 47 N -3.02 0.93 0.10 -0.03 2.02 -1.26 -1.30 117.35 114.79 2ekx s TYR 47 Ca 0.15 -0.59 0.05 0.00 -0.37 0.00 0.00 57.07 56.32 2ekx s TYR 47 Cb 0.02 -0.53 -0.03 0.00 -0.40 0.00 0.00 41.96 41.02 2ekx s TYR 47 CO 0.09 -0.03 -0.14 0.99 -1.57 0.00 0.00 175.55 174.89 2ekx s THR 48 N -1.95 1.18 -0.27 -0.71 2.01 -1.11 -1.43 115.64 113.36 2ekx s THR 48 Ca -0.01 -1.53 0.02 0.00 0.31 0.00 0.00 61.69 60.48 2ekx s THR 48 Cb -0.06 -1.31 0.07 0.00 0.01 0.00 0.00 72.50 71.22 2ekx s THR 48 CO 0.00 -0.35 -0.03 -0.69 -0.69 0.00 0.00 174.62 172.86 2ekx s VAL 49 N -1.80 1.81 -0.67 3.82 1.01 0.04 -2.48 120.40 122.13 2ekx s VAL 49 Ca 0.04 -1.61 -0.13 0.00 0.00 0.00 0.00 61.98 60.27 2ekx s VAL 49 Cb -0.07 -2.12 0.17 0.00 0.00 0.00 0.00 36.38 34.37 2ekx s VAL 49 CO 0.02 -0.26 0.60 -0.94 0.00 0.00 0.00 175.10 174.52 2ekx s SER 50 N 1.22 6.32 -0.08 3.32 1.04 -1.23 -2.39 113.70 121.90 2ekx s SER 50 Ca -0.01 -2.30 -0.00 0.00 0.48 0.00 0.00 55.95 54.12 2ekx s SER 50 Cb -0.19 -2.16 -0.03 0.00 0.10 0.00 0.00 66.02 63.74 2ekx s SER 50 CO -0.08 -0.67 -0.05 -1.48 0.98 0.00 0.00 173.24 171.93 2ekx s LEU 51 N 0.79 3.25 0.10 2.42 0.05 -1.17 -3.32 118.68 120.81 2ekx s LEU 51 Ca 0.11 0.00 -0.21 0.00 0.05 0.00 0.00 54.13 54.08 2ekx s LEU 51 Cb -0.20 -1.72 -0.07 0.00 -2.05 0.00 0.00 46.19 42.15 2ekx s LEU 51 CO -0.03 0.35 0.64 0.12 -0.55 0.00 0.00 176.35 176.88 2ekx s PHE 52 N -0.72 3.84 0.41 3.48 5.36 -0.38 -1.87 117.98 128.11 2ekx s PHE 52 Ca 0.11 1.40 0.07 0.00 -0.96 0.00 0.00 56.93 57.55 2ekx s PHE 52 Cb -0.11 -2.59 -0.07 0.00 -0.34 0.00 0.00 43.02 39.90 2ekx s PHE 52 CO 0.02 0.56 0.04 -1.54 -1.46 0.00 0.00 175.22 172.84 2ekx s SER 53 N -1.11 3.99 -0.28 6.13 1.04 -0.90 -3.78 113.70 118.80 2ekx s SER 53 Ca 0.31 -1.31 -0.23 0.00 0.48 0.00 0.00 55.95 55.21 2ekx s SER 53 Cb -0.21 -0.41 0.09 0.00 0.10 0.00 0.00 66.02 65.59 2ekx s SER 53 CO 0.22 -0.47 0.78 -0.75 0.98 0.00 0.00 173.24 174.00 2ekx s LYS 54 N -3.75 0.73 0.84 4.02 2.20 -1.26 -3.40 119.74 119.12 2ekx s LYS 54 Ca 0.36 0.96 -0.09 0.00 -0.36 0.00 0.00 55.97 56.84 2ekx s LYS 54 Cb 0.09 0.30 0.16 0.00 -1.51 0.00 0.00 37.83 36.87 2ekx s LYS 54 CO 0.19 -0.10 1.16 0.00 -0.36 0.00 0.00 175.35 176.24 2ekx s ALA 55 N 0.68 2.92 -0.48 3.13 0.00 -1.26 -4.97 121.76 121.78 2ekx s ALA 55 Ca -0.02 -1.38 0.26 0.00 0.00 0.00 0.00 51.96 50.81 2ekx s ALA 55 Cb -0.05 -2.45 0.88 0.00 0.00 0.00 0.00 23.12 21.50 2ekx s ALA 55 CO -0.06 -1.93 1.76 -0.24 0.00 0.00 0.00 175.76 175.30 2ekx h VAL 56 N -1.09 0.00 0.00 0.00 3.04 -2.04 -3.39 116.25 112.78 2ekx h VAL 56 Ca -0.41 -0.48 0.00 0.00 -1.01 0.00 0.00 66.70 64.80 2ekx h VAL 56 Cb 1.26 1.39 0.00 0.00 -2.01 0.00 0.00 31.29 31.93 2ekx h VAL 56 CO 0.41 0.00 -0.04 -3.20 -1.01 0.00 0.00 177.57 173.73 2ekx n ASN 57 N -2.51 0.89 -4.45 3.17 5.15 -1.26 -5.05 115.26 111.20 2ekx n ASN 57 Ca 0.03 0.11 -0.53 0.00 -0.60 0.00 0.00 54.58 53.60 2ekx n ASN 57 Cb 0.36 -0.28 -0.05 0.00 -0.53 0.00 0.00 39.78 39.28 2ekx n ASN 57 CO 0.00 0.00 0.00 -0.67 1.40 0.00 0.00 177.26 177.99 2ekx n ASP 58 N -3.30 -0.64 -0.07 1.20 -0.08 -1.26 -4.89 116.55 107.51 2ekx n ASP 58 Ca -0.01 1.14 -0.17 0.00 -1.51 0.00 0.00 54.79 54.25 2ekx n ASP 58 Cb 0.02 -0.94 -0.13 0.00 2.34 0.00 0.00 41.12 42.40 2ekx n ASP 58 CO 0.00 0.00 0.00 1.17 0.12 0.00 0.00 177.20 178.49 2ekx n LYS 59 N 1.23 0.69 -3.18 -0.67 4.81 -1.26 -4.22 118.16 115.56 2ekx n LYS 59 Ca 0.19 0.18 -0.46 0.00 -0.87 0.00 0.00 58.31 57.35 2ekx n LYS 59 Cb 0.18 -1.61 -0.02 0.00 0.02 0.00 0.00 35.03 33.59 2ekx n LYS 59 CO 0.00 0.00 0.00 0.21 1.17 0.00 0.00 177.40 178.78 2ekx s LYS 60 N -2.54 3.67 1.19 1.64 2.20 -1.26 -5.02 119.74 119.62 2ekx s LYS 60 Ca -0.24 -2.29 -0.18 0.00 -0.36 0.00 0.00 55.97 52.90 2ekx s LYS 60 Cb 0.08 -4.63 0.28 0.00 -1.51 0.00 0.00 37.83 32.05 2ekx s LYS 60 CO 0.71 -1.47 1.07 0.20 -0.36 0.00 0.00 175.35 175.50 2ekx s GLY 61 N 2.62 1.55 0.16 5.54 0.00 -1.26 -5.03 107.32 110.89 2ekx s GLY 61 Ca 0.25 -0.73 0.09 0.00 0.00 0.00 0.00 44.72 44.33 2ekx s GLY 61 CO -0.09 0.11 -0.19 -1.59 0.00 0.00 0.00 173.10 171.34 2ekx s THR 62 N -2.83 1.84 -0.03 0.90 2.01 -1.22 -4.94 115.64 111.37 2ekx s THR 62 Ca 0.69 -1.87 -0.19 0.00 0.31 0.00 0.00 61.69 60.63 2ekx s THR 62 Cb -0.14 -1.82 -0.05 0.00 0.01 0.00 0.00 72.50 70.50 2ekx s THR 62 CO 0.58 -0.27 0.54 -0.69 -0.69 0.00 0.00 174.62 174.09 2ekx s VAL 63 N -1.90 4.99 -0.19 3.82 1.01 -1.26 -2.11 120.40 124.76 2ekx s VAL 63 Ca 0.15 1.12 -0.06 0.00 0.00 0.00 0.00 61.98 63.18 2ekx s VAL 63 Cb -0.06 -3.87 -0.03 0.00 0.00 0.00 0.00 36.38 32.41 2ekx s VAL 63 CO 0.06 0.42 0.04 -0.54 0.00 0.00 0.00 175.10 175.08 2ekx s LYS 64 N -0.12 3.82 -0.26 2.72 3.01 -0.78 -5.00 119.74 123.13 2ekx s LYS 64 Ca 0.29 -0.42 -0.13 0.00 -1.01 0.00 0.00 55.97 54.70 2ekx s LYS 64 Cb -0.17 -3.17 -0.05 0.00 -1.01 0.00 0.00 37.83 33.43 2ekx s LYS 64 CO 0.15 0.14 0.26 -3.38 0.51 0.00 0.00 175.35 173.03 2ekx s HIS 65 N 0.70 3.27 -0.12 3.18 -3.43 -1.26 -3.02 115.29 114.61 2ekx s HIS 65 Ca 0.02 0.29 0.02 0.00 -0.80 0.00 0.00 55.06 54.59 2ekx s HIS 65 Cb -0.14 -2.42 0.01 0.00 -1.43 0.00 0.00 32.58 28.60 2ekx s HIS 65 CO 0.02 -0.10 -0.19 0.71 -2.00 0.00 0.00 174.74 173.18 2ekx s TYR 66 N 1.61 2.30 -0.21 0.38 2.02 -1.00 -4.99 117.35 117.45 2ekx s TYR 66 Ca 0.11 -1.09 -0.15 0.00 -0.37 0.00 0.00 57.07 55.57 2ekx s TYR 66 Cb -0.15 -1.60 -0.04 0.00 -0.40 0.00 0.00 41.96 39.77 2ekx s TYR 66 CO 0.09 -0.51 0.35 -1.01 -1.57 0.00 0.00 175.55 172.89 2ekx s HIS 67 N 0.81 3.35 -0.33 2.71 3.76 -1.26 -0.78 115.29 123.55 2ekx s HIS 67 Ca -0.09 0.53 -0.29 0.00 -0.15 0.00 0.00 55.06 55.06 2ekx s HIS 67 Cb -0.16 -2.48 0.02 0.00 1.11 0.00 0.00 32.58 31.07 2ekx s HIS 67 CO 0.00 -0.01 1.08 0.08 -0.85 0.00 0.00 174.74 175.04 2ekx s VAL 68 N 1.31 4.48 0.80 -0.90 1.01 -0.52 -4.90 120.40 121.69 2ekx s VAL 68 Ca 0.17 1.69 -0.08 0.00 0.00 0.00 0.00 61.98 63.75 2ekx s VAL 68 Cb -0.15 -4.43 0.13 0.00 0.00 0.00 0.00 36.38 31.94 2ekx s VAL 68 CO 0.07 -0.53 1.12 -1.00 0.00 0.00 0.00 175.10 174.77 2ekx s HIS 69 N 3.72 1.97 -0.11 5.22 3.76 -1.22 -4.41 115.29 124.22 2ekx s HIS 69 Ca 0.46 0.15 -0.01 0.00 -0.15 0.00 0.00 55.06 55.51 2ekx s HIS 69 Cb -0.12 -3.47 0.03 0.00 1.11 0.00 0.00 32.58 30.14 2ekx s HIS 69 CO 0.17 -1.97 -0.04 0.99 -0.85 0.00 0.00 174.74 173.04 2ekx s THR 70 N -3.45 0.77 0.72 1.30 2.01 -1.26 -3.74 115.64 112.00 2ekx s THR 70 Ca 0.67 -0.23 -0.11 0.00 0.31 0.00 0.00 61.69 62.34 2ekx s THR 70 Cb -0.06 -0.91 0.03 0.00 0.01 0.00 0.00 72.50 71.57 2ekx s THR 70 CO 0.48 0.24 1.08 0.21 -0.69 0.00 0.00 174.62 175.93 2ekx s ASN 71 N 1.80 4.99 0.66 3.53 3.84 -0.58 -4.85 114.94 124.34 2ekx s ASN 71 Ca 0.04 1.74 0.27 0.00 0.21 0.00 0.00 52.86 55.12 2ekx s ASN 71 Cb -0.13 -2.51 1.48 0.00 -0.55 0.00 0.00 41.25 39.54 2ekx s ASN 71 CO -0.07 -1.70 1.84 0.00 -2.79 0.00 0.00 177.10 174.37 2ekx h ALA 72 N -0.80 1.44 -0.72 1.71 0.00 -2.01 0.75 119.26 119.63 2ekx h ALA 72 Ca -0.44 -0.00 -0.18 0.00 0.00 0.00 0.00 54.91 54.29 2ekx h ALA 72 Cb 1.22 0.00 -0.11 0.00 0.00 0.00 0.00 17.79 18.90 2ekx h ALA 72 CO 0.54 -0.41 0.23 0.39 0.00 0.00 0.00 179.25 180.00 2ekx n GLU 73 N -2.90 3.94 -2.29 0.00 1.02 -1.26 -4.89 120.64 114.26 2ekx n GLU 73 Ca -0.01 -3.07 -0.19 0.00 -0.02 0.00 0.00 57.16 53.86 2ekx n GLU 73 Cb 0.45 -2.23 -0.02 0.00 -0.02 0.00 0.00 31.44 29.62 2ekx n GLU 73 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 2ekx n ASN 74 N -0.00 -5.46 -4.67 1.62 4.13 0.26 -4.93 115.26 106.21 2ekx n ASN 74 Ca 0.39 0.09 -0.41 0.00 1.68 0.00 0.00 54.58 56.33 2ekx n ASN 74 Cb 1.36 -4.60 -0.04 0.00 -1.54 0.00 0.00 39.78 34.96 2ekx n ASN 74 CO 0.00 0.00 0.00 -0.54 0.28 0.00 0.00 177.26 177.00 2ekx s LYS 75 N -4.85 4.28 -0.14 3.52 1.02 -1.23 -4.80 119.74 117.55 2ekx s LYS 75 Ca 0.00 0.95 -0.16 0.00 0.02 0.00 0.00 55.97 56.78 2ekx s LYS 75 Cb 0.00 -3.58 -0.04 0.00 -0.52 0.00 0.00 37.83 33.69 2ekx s LYS 75 CO 0.00 -0.32 0.40 -0.51 -0.92 0.00 0.00 175.35 174.00 2ekx s LEU 76 N 2.12 4.25 0.33 3.17 1.43 -1.26 -1.52 118.68 127.20 2ekx s LEU 76 Ca 0.37 0.66 -0.09 0.00 -1.03 0.00 0.00 54.13 54.04 2ekx s LEU 76 Cb -0.16 -2.55 0.01 0.00 0.03 0.00 0.00 46.19 43.52 2ekx s LEU 76 CO 0.12 0.03 0.56 -0.72 0.23 0.00 0.00 176.35 176.57 2ekx s TYR 77 N 0.65 0.62 -0.06 0.29 -0.85 -1.25 -3.35 117.35 113.40 2ekx s TYR 77 Ca 0.22 -1.01 0.04 0.00 -0.52 0.00 0.00 57.07 55.80 2ekx s TYR 77 Cb -0.14 0.24 -0.07 0.00 0.38 0.00 0.00 41.96 42.37 2ekx s TYR 77 CO 0.07 -1.22 -0.00 1.28 -1.52 0.00 0.00 175.55 174.17 2ekx n LEU 78 N -0.51 0.73 -4.13 -3.49 4.77 -1.26 -3.38 117.00 109.73 2ekx n LEU 78 Ca -0.02 -0.01 -0.33 0.00 -0.03 0.00 0.00 56.01 55.62 2ekx n LEU 78 Cb 0.61 0.05 -0.16 0.00 -2.33 0.00 0.00 43.42 41.59 2ekx n LEU 78 CO 0.27 0.27 -0.52 0.00 -1.33 0.00 0.00 177.39 176.08 2ekx s ALA 79 N -2.15 2.38 0.17 -1.18 0.00 -1.26 -4.89 121.76 114.82 2ekx s ALA 79 Ca -0.05 -1.26 -0.24 0.00 0.00 0.00 0.00 51.96 50.41 2ekx s ALA 79 Cb 0.02 -1.24 0.05 0.00 0.00 0.00 0.00 23.12 21.95 2ekx s ALA 79 CO 0.23 -0.42 1.58 0.93 0.00 0.00 0.00 175.76 178.09 2ekx h GLU 80 N 7.94 -0.25 -1.28 0.00 5.08 -1.99 0.47 114.58 124.55 2ekx h GLU 80 Ca -0.44 0.02 0.37 0.00 -1.00 0.00 0.00 59.36 58.31 2ekx h GLU 80 Cb 1.13 0.06 -0.05 0.00 0.50 0.00 0.00 28.75 30.39 2ekx h GLU 80 CO 0.63 -0.16 1.08 -0.97 -1.00 0.00 0.00 179.01 178.58 2ekx h ASN 81 N -0.25 0.00 -0.53 1.42 -0.73 -2.04 -3.40 115.58 110.05 2ekx h ASN 81 Ca 0.17 0.00 -0.65 0.00 1.87 0.00 0.00 56.30 57.69 2ekx h ASN 81 Cb 0.56 0.00 -0.11 0.00 0.27 0.00 0.00 38.32 39.04 2ekx h ASN 81 CO -0.61 0.00 -0.48 -0.31 -0.37 0.00 0.00 177.43 175.66 2ekx s TYR 82 N -4.73 1.89 -0.12 0.67 2.02 0.17 -5.16 117.35 112.08 2ekx s TYR 82 Ca -0.04 -0.90 -0.29 0.00 -0.37 0.00 0.00 57.07 55.47 2ekx s TYR 82 Cb 0.21 -1.70 0.07 0.00 -0.40 0.00 0.00 41.96 40.14 2ekx s TYR 82 CO 0.70 0.10 0.69 0.00 -1.57 0.00 0.00 175.55 175.47 2ekx n PHE 84 N 1.46 0.38 -0.04 0.00 3.01 -1.21 -5.04 117.46 116.01 2ekx n PHE 84 Ca -0.17 -1.62 -0.22 0.00 1.01 0.00 0.00 57.45 56.45 2ekx n PHE 84 Cb 0.56 -0.10 -0.13 0.00 -0.01 0.00 0.00 39.48 39.81 2ekx n PHE 84 CO 0.00 0.00 0.00 -3.47 1.01 0.00 0.00 176.76 174.30 2ekx n ASP 85 N -1.49 2.03 -3.32 4.37 2.03 -1.26 -4.14 116.55 114.77 2ekx n ASP 85 Ca -0.08 0.26 -0.13 0.00 0.52 0.00 0.00 54.79 55.36 2ekx n ASP 85 Cb 0.39 -0.86 -0.03 0.00 -0.72 0.00 0.00 41.12 39.90 2ekx n ASP 85 CO 0.00 0.00 0.00 -0.44 -1.92 0.00 0.00 177.20 174.84 2ekx s SER 86 N -6.97 0.61 0.02 1.67 0.01 -1.26 -4.27 113.70 103.51 2ekx s SER 86 Ca -0.26 -1.35 -0.28 0.00 1.31 0.00 0.00 55.95 55.37 2ekx s SER 86 Cb 0.07 0.68 -0.16 0.00 0.21 0.00 0.00 66.02 66.81 2ekx s SER 86 CO 0.69 -1.33 1.26 0.40 0.41 0.00 0.00 173.24 174.67 2ekx h ILE 87 N 2.12 0.25 0.00 1.44 2.04 -1.97 -2.49 117.51 118.90 2ekx h ILE 87 Ca -0.29 -0.30 0.00 0.00 1.00 0.00 0.00 64.86 65.27 2ekx h ILE 87 Cb 1.24 0.32 0.00 0.00 -0.74 0.00 0.00 36.82 37.65 2ekx h ILE 87 CO 0.39 0.03 0.00 -0.81 0.00 0.00 0.00 178.15 177.76 2ekx n PRO 88 N -5.37 0.18 0.13 2.37 -0.04 -1.26 -2.15 135.00 128.87 2ekx n PRO 88 Ca -0.12 0.42 0.12 0.00 -0.04 0.00 0.00 63.50 63.88 2ekx n PRO 88 Cb 0.36 -1.85 0.15 0.00 -0.04 0.00 0.00 33.50 32.12 2ekx n PRO 88 CO 0.00 0.00 0.00 0.87 -0.04 0.00 0.00 175.50 176.33 2ekx h LYS 89 N 0.00 0.00 0.11 0.54 1.79 -1.93 -3.29 116.57 113.79 2ekx h LYS 89 Ca 0.00 0.00 -0.33 0.00 -2.18 0.00 0.00 60.65 58.14 2ekx h LYS 89 Cb 0.35 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 30.99 2ekx h LYS 89 CO 0.00 0.00 -1.71 1.25 -1.08 0.00 0.00 179.45 177.91 2ekx h LEU 90 N 0.00 0.37 -1.91 2.94 6.46 -0.97 -3.33 115.31 118.88 2ekx h LEU 90 Ca 0.00 -0.62 -0.01 0.00 -0.12 0.00 0.00 57.88 57.12 2ekx h LEU 90 Cb 0.90 -0.12 -0.00 0.00 -0.73 0.00 0.00 40.66 40.71 2ekx h LEU 90 CO 0.00 1.54 -0.06 0.40 -0.62 0.00 0.00 178.44 179.70 2ekx h ILE 91 N 0.06 0.23 0.00 4.05 1.08 -1.65 -1.80 117.51 119.49 2ekx h ILE 91 Ca -0.31 -0.47 -0.02 0.00 -0.39 0.00 0.00 64.86 63.67 2ekx h ILE 91 Cb 2.03 1.37 -0.00 0.00 -3.07 0.00 0.00 36.82 37.15 2ekx h ILE 91 CO 0.13 0.06 -0.11 -0.74 -0.69 0.00 0.00 178.15 176.80 2ekx h HIS 92 N 0.00 0.00 0.00 1.37 2.76 -1.66 -2.99 115.15 114.62 2ekx h HIS 92 Ca -0.00 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.17 2ekx h HIS 92 Cb 0.37 0.00 0.00 0.00 1.55 0.00 0.00 27.41 29.33 2ekx h HIS 92 CO 0.00 0.11 -0.29 0.98 -1.30 0.00 0.00 177.93 177.43 2ekx n TYR 93 N -3.19 0.45 -0.31 5.26 9.36 -0.71 -4.34 117.16 123.68 2ekx n TYR 93 Ca 0.01 0.20 -0.11 0.00 3.32 0.00 0.00 57.90 61.32 2ekx n TYR 93 Cb 0.42 -0.50 -0.08 0.00 -0.63 0.00 0.00 39.34 38.55 2ekx n TYR 93 CO 0.00 0.00 0.00 0.45 0.22 0.00 0.00 176.86 177.53 2ekx h HIS 94 N -0.52 -1.69 -0.82 2.98 3.86 -1.55 0.43 115.15 117.82 2ekx h HIS 94 Ca 0.00 0.11 0.33 0.00 -1.16 0.00 0.00 60.37 59.64 2ekx h HIS 94 Cb 0.29 0.84 -0.13 0.00 1.06 0.00 0.00 27.41 29.47 2ekx h HIS 94 CO -0.12 -0.42 0.47 0.94 0.86 0.00 0.00 177.93 179.66 2ekx n GLN 95 N -5.33 -0.04 0.05 2.45 0.00 -1.13 0.17 117.38 113.55 2ekx n GLN 95 Ca 0.01 1.01 -0.22 0.00 -0.00 0.00 0.00 57.00 57.80 2ekx n GLN 95 Cb 0.31 -1.86 -0.14 0.00 0.00 0.00 0.00 30.24 28.55 2ekx n GLN 95 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.06 177.51 2ekx h HIS 96 N 0.00 0.60 -2.07 3.69 3.86 -0.42 -3.44 115.15 117.37 2ekx h HIS 96 Ca 0.64 -0.44 0.05 0.00 -1.16 0.00 0.00 60.37 59.47 2ekx h HIS 96 Cb 1.80 -0.02 -0.21 0.00 1.06 0.00 0.00 27.41 30.04 2ekx h HIS 96 CO -0.01 1.56 -0.15 0.54 0.86 0.00 0.00 177.93 180.73 2ekx s ASN 97 N -7.16 -1.02 1.07 2.45 4.22 0.45 -5.10 114.94 109.85 2ekx s ASN 97 Ca -0.17 1.50 -0.17 0.00 -2.14 0.00 0.00 52.86 51.88 2ekx s ASN 97 Cb 0.04 2.11 0.13 0.00 1.28 0.00 0.00 41.25 44.81 2ekx s ASN 97 CO 0.82 -0.22 0.08 -0.24 -2.04 0.00 0.00 177.10 175.50 2ekx n SER 98 N 5.35 -2.78 0.00 3.54 2.88 -1.17 -3.69 113.62 117.74 2ekx n SER 98 Ca -0.12 -0.27 0.00 0.00 -1.33 0.00 0.00 58.87 57.14 2ekx n SER 98 Cb 0.50 -0.83 0.00 0.00 -0.75 0.00 0.00 64.21 63.12 2ekx n SER 98 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2ekx n ALA 99 N -4.41 2.10 -2.44 -1.46 0.00 -1.26 -4.88 120.51 108.16 2ekx n ALA 99 Ca 0.03 -0.07 0.00 0.00 0.00 0.00 0.00 53.44 53.40 2ekx n ALA 99 Cb 0.50 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.95 2ekx n ALA 99 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2ekx n GLY 100 N 2.94 1.61 0.09 0.00 0.00 -1.26 -5.02 105.19 103.54 2ekx n GLY 100 Ca 0.00 -0.01 -0.15 0.00 0.00 0.00 0.00 46.02 45.86 2ekx n GLY 100 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 173.32 175.30 2ekx h MET 101 N 0.00 0.13 -4.48 1.61 1.85 -2.02 -3.46 114.93 108.57 2ekx h MET 101 Ca 0.00 -0.15 -0.62 0.00 -0.61 0.00 0.00 59.70 58.32 2ekx h MET 101 Cb 0.00 0.05 -0.01 0.00 0.43 0.00 0.00 31.60 32.07 2ekx h MET 101 CO 0.00 0.94 0.72 -0.89 -0.40 0.00 0.00 176.91 177.28 2ekx n ILE 102 N -4.52 0.00 -1.67 1.77 2.08 -1.26 -4.74 119.36 111.02 2ekx n ILE 102 Ca -0.10 0.00 -0.45 0.00 0.56 0.00 0.00 62.75 62.76 2ekx n ILE 102 Cb 0.51 -0.37 -0.03 0.00 -0.75 0.00 0.00 39.64 38.99 2ekx n ILE 102 CO 0.00 0.00 0.00 0.41 0.56 0.00 0.00 176.55 177.52 2ekx n THR 103 N 3.79 0.71 -0.81 1.39 -1.04 -1.26 -4.59 114.28 112.47 2ekx n THR 103 Ca 0.31 -0.18 -0.34 0.00 -2.04 0.00 0.00 64.05 61.80 2ekx n THR 103 Cb -0.04 -1.45 0.11 0.00 -1.82 0.00 0.00 70.33 67.13 2ekx n THR 103 CO 0.00 0.00 0.00 -2.11 -0.64 0.00 0.00 175.07 172.32 2ekx n ARG 104 N 2.34 -0.55 -4.05 -2.82 0.00 -1.26 -4.97 116.66 105.35 2ekx n ARG 104 Ca 0.13 -0.13 -0.35 0.00 -0.00 0.00 0.00 57.85 57.49 2ekx n ARG 104 Cb 0.30 -1.61 -0.09 0.00 -0.00 0.00 0.00 32.46 31.07 2ekx n ARG 104 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.63 177.12 2ekx s LEU 105 N 1.09 3.93 0.00 2.89 1.43 -1.26 -4.90 118.68 121.86 2ekx s LEU 105 Ca 0.52 0.21 0.00 0.00 -1.03 0.00 0.00 54.13 53.83 2ekx s LEU 105 Cb -0.16 -1.96 0.00 0.00 0.03 0.00 0.00 46.19 44.10 2ekx s LEU 105 CO 0.70 0.29 0.00 0.54 0.23 0.00 0.00 176.35 178.11 2ekx n ARG 106 N 2.74 0.00 -4.38 1.70 1.74 -0.65 -4.62 116.66 113.18 2ekx n ARG 106 Ca -0.18 0.00 -0.21 0.00 -0.77 0.00 0.00 57.85 56.69 2ekx n ARG 106 Cb 0.53 -0.30 -0.13 0.00 -1.02 0.00 0.00 32.46 31.55 2ekx n ARG 106 CO 0.00 0.00 0.00 -1.01 -1.52 0.00 0.00 177.63 175.10 2ekx s HIS 107 N -0.84 1.37 0.78 -1.55 3.76 -1.25 -4.99 115.29 112.56 2ekx s HIS 107 Ca 0.00 -0.37 -0.11 0.00 -0.15 0.00 0.00 55.06 54.43 2ekx s HIS 107 Cb 0.00 -0.80 0.06 0.00 1.11 0.00 0.00 32.58 32.95 2ekx s HIS 107 CO 0.00 0.06 1.09 -1.25 -0.85 0.00 0.00 174.74 173.79 2ekx s PRO 108 N -1.26 2.22 -0.12 8.40 0.04 -1.26 -1.25 135.00 141.77 2ekx s PRO 108 Ca 0.03 1.16 -0.06 0.00 0.04 0.00 0.00 61.00 62.17 2ekx s PRO 108 Cb -0.08 -1.89 0.05 0.00 0.04 0.00 0.00 34.50 32.62 2ekx s PRO 108 CO 0.02 -1.67 0.27 0.08 0.04 0.00 0.00 177.00 175.74 2ekx s VAL 109 N -2.90 -0.13 -2.70 -0.36 1.01 0.34 -4.66 120.40 111.00 2ekx s VAL 109 Ca 0.61 0.17 0.26 0.00 0.00 0.00 0.00 61.98 63.03 2ekx s VAL 109 Cb -0.17 -0.43 0.41 0.00 0.00 0.00 0.00 36.38 36.19 2ekx s VAL 109 CO 0.56 0.07 1.55 -1.20 0.00 0.00 0.00 175.10 176.08