#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dly s SER 2 N 0.00 6.20 -0.91 1.61 1.04 -1.26 -4.94 113.70 115.44 2dly s SER 2 Ca 0.00 0.51 -0.02 0.00 0.48 0.00 0.00 55.95 56.92 2dly s SER 2 Cb 0.00 -2.54 0.22 0.00 0.10 0.00 0.00 66.02 63.80 2dly s SER 2 CO 0.00 -1.61 0.80 -0.55 0.98 0.00 0.00 173.24 172.86 2dly s SER 3 N 4.28 6.07 0.00 7.02 0.15 -1.26 -4.92 113.70 125.04 2dly s SER 3 Ca 0.56 -3.73 0.00 0.00 0.70 0.00 0.00 55.95 53.48 2dly s SER 3 Cb -0.12 -1.92 0.00 0.00 -1.71 0.00 0.00 66.02 62.27 2dly s SER 3 CO 0.28 -0.18 0.00 0.61 1.20 0.00 0.00 173.24 175.15 2dly n GLY 4 N 2.33 -0.14 3.48 9.45 0.00 -1.26 -5.18 105.19 113.88 2dly n GLY 4 Ca 0.22 0.55 -0.11 0.00 0.00 0.00 0.00 46.02 46.68 2dly n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2dly s SER 5 N 2.00 -0.46 0.20 1.61 1.04 -1.26 -5.18 113.70 111.64 2dly s SER 5 Ca 0.00 0.12 0.08 0.00 0.48 0.00 0.00 55.95 56.63 2dly s SER 5 Cb 0.00 0.46 -0.05 0.00 0.10 0.00 0.00 66.02 66.54 2dly s SER 5 CO 0.00 -0.71 -0.15 -0.55 0.98 0.00 0.00 173.24 172.81 2dly s SER 6 N -2.29 2.64 -0.24 7.02 0.15 -1.26 -5.13 113.70 114.59 2dly s SER 6 Ca 0.01 -0.99 -0.07 0.00 0.70 0.00 0.00 55.95 55.60 2dly s SER 6 Cb -0.01 -0.15 -0.03 0.00 -1.71 0.00 0.00 66.02 64.12 2dly s SER 6 CO -0.07 -0.14 0.07 -0.83 1.20 0.00 0.00 173.24 173.47 2dly s GLY 7 N -3.22 1.78 0.27 9.45 0.00 -1.26 -5.10 107.32 109.25 2dly s GLY 7 Ca 0.22 -1.07 0.06 0.00 0.00 0.00 0.00 44.72 43.93 2dly s GLY 7 CO 0.07 0.45 0.29 0.00 0.00 0.00 0.00 173.10 173.92 2dly s ALA 8 N 1.41 3.81 -0.05 3.20 0.00 -1.26 -5.07 121.76 123.80 2dly s ALA 8 Ca 0.05 -1.40 -0.00 0.00 0.00 0.00 0.00 51.96 50.61 2dly s ALA 8 Cb -0.15 -1.46 -0.00 0.00 0.00 0.00 0.00 23.12 21.51 2dly s ALA 8 CO 0.04 0.18 -0.00 0.93 0.00 0.00 0.00 175.76 176.90 2dly h GLU 9 N 1.28 0.00 -7.18 0.00 5.08 -2.05 -3.47 114.58 108.25 2dly h GLU 9 Ca -0.49 0.00 -0.46 0.00 -1.00 0.00 0.00 59.36 57.41 2dly h GLU 9 Cb 1.24 0.00 0.21 0.00 0.50 0.00 0.00 28.75 30.70 2dly h GLU 9 CO 0.59 0.00 0.07 -0.51 -1.00 0.00 0.00 179.01 178.16 2dly s ASP 10 N -4.33 1.50 0.03 1.42 1.01 -1.26 -5.01 116.67 110.04 2dly s ASP 10 Ca -0.00 1.68 0.00 0.00 0.71 0.00 0.00 52.55 54.94 2dly s ASP 10 Cb 0.00 -2.36 0.00 0.00 1.01 0.00 0.00 42.92 41.57 2dly s ASP 10 CO 0.01 -3.90 0.00 0.54 0.21 0.00 0.00 175.17 172.02 2dly n ARG 11 N -4.73 0.00 0.06 8.23 1.74 -1.26 -4.82 116.66 115.89 2dly n ARG 11 Ca 0.05 0.00 0.04 0.00 -0.77 0.00 0.00 57.85 57.18 2dly n ARG 11 Cb 0.54 -0.02 0.23 0.00 -1.02 0.00 0.00 32.46 32.19 2dly n ARG 11 CO 0.00 0.00 0.00 0.43 -1.52 0.00 0.00 177.63 176.54 2dly n SER 12 N -2.63 0.22 0.27 0.55 7.64 -1.26 -1.53 113.62 116.88 2dly n SER 12 Ca 0.00 0.60 0.12 0.00 1.01 0.00 0.00 58.87 60.60 2dly n SER 12 Cb 0.00 -0.63 0.75 0.00 -1.01 0.00 0.00 64.21 63.32 2dly n SER 12 CO 0.00 0.00 0.00 0.25 -3.01 0.00 0.00 175.04 172.28 2dly h LEU 13 N 0.00 0.00 -2.16 -3.43 6.46 -1.99 -1.54 115.31 112.65 2dly h LEU 13 Ca 0.00 0.00 -0.01 0.00 -0.12 0.00 0.00 57.88 57.75 2dly h LEU 13 Cb 0.00 0.00 -0.00 0.00 -0.73 0.00 0.00 40.66 39.93 2dly h LEU 13 CO 0.00 0.08 -0.06 0.06 -0.62 0.00 0.00 178.44 177.90 2dly h GLN 14 N 0.00 0.00 -0.27 1.25 3.07 -1.63 -1.79 115.11 115.74 2dly h GLN 14 Ca -0.00 0.00 -0.09 0.00 0.09 0.00 0.00 58.65 58.65 2dly h GLN 14 Cb 0.19 0.00 -0.01 0.00 0.08 0.00 0.00 27.48 27.73 2dly h GLN 14 CO 0.01 0.06 -0.22 0.00 0.09 0.00 0.00 178.83 178.77 2dly h ALA 15 N 1.94 1.12 -1.39 0.06 0.00 -1.50 -3.45 119.26 116.04 2dly h ALA 15 Ca -0.00 -0.33 -0.72 0.00 0.00 0.00 0.00 54.91 53.86 2dly h ALA 15 Cb 0.15 -0.13 0.06 0.00 0.00 0.00 0.00 17.79 17.87 2dly h ALA 15 CO 0.01 0.55 0.24 0.39 0.00 0.00 0.00 179.25 180.44 2dly n GLU 16 N -4.14 0.65 -0.11 0.00 -0.58 -0.67 -4.87 120.64 110.92 2dly n GLU 16 Ca -0.00 0.23 -0.13 0.00 -0.42 0.00 0.00 57.16 56.84 2dly n GLU 16 Cb 0.39 -1.78 -0.03 0.00 -0.57 0.00 0.00 31.44 29.45 2dly n GLU 16 CO 0.00 0.00 0.00 -1.00 -0.48 0.00 0.00 177.13 175.65 2dly h PRO 17 N 3.68 0.85 0.00 3.49 0.13 -1.89 -2.93 132.00 135.34 2dly h PRO 17 Ca -0.48 -0.45 0.00 0.00 -0.87 0.00 0.00 66.00 64.20 2dly h PRO 17 Cb 1.38 0.02 0.00 0.00 0.13 0.00 0.00 31.00 32.53 2dly h PRO 17 CO 0.71 1.09 0.00 -2.67 -0.23 0.00 0.00 178.00 176.91 2dly n TRP 18 N -4.13 0.84 -2.96 1.56 4.27 -1.26 -4.70 117.44 111.06 2dly n TRP 18 Ca -0.03 0.29 -0.41 0.00 -3.89 0.00 0.00 57.50 53.46 2dly n TRP 18 Cb 0.52 -0.97 -0.05 0.00 -1.36 0.00 0.00 31.31 29.45 2dly n TRP 18 CO 0.00 0.00 0.00 0.12 -2.29 0.00 0.00 177.69 175.52 2dly s PHE 19 N -3.22 3.43 -0.41 -2.67 5.36 -1.11 0.45 117.98 119.81 2dly s PHE 19 Ca 0.07 1.18 0.08 0.00 -0.96 0.00 0.00 56.93 57.30 2dly s PHE 19 Cb 0.11 -2.94 0.43 0.00 -0.34 0.00 0.00 43.02 40.28 2dly s PHE 19 CO 0.47 -0.19 1.08 1.19 -1.46 0.00 0.00 175.22 176.31 2dly n PHE 20 N 5.02 2.91 0.00 10.12 3.01 -0.61 -4.84 117.46 133.08 2dly n PHE 20 Ca 0.02 -3.02 0.00 0.00 1.01 0.00 0.00 57.45 55.46 2dly n PHE 20 Cb 0.49 -0.15 0.00 0.00 -0.01 0.00 0.00 39.48 39.81 2dly n PHE 20 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2dly n GLY 21 N -0.40 1.89 2.98 1.37 0.00 -1.26 -3.65 105.19 106.13 2dly n GLY 21 Ca 0.33 0.30 -0.31 0.00 0.00 0.00 0.00 46.02 46.34 2dly n GLY 21 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dly s ALA 22 N -0.91 2.55 0.43 4.61 0.00 -1.26 -0.56 121.76 126.62 2dly s ALA 22 Ca 0.00 -2.13 0.03 0.00 0.00 0.00 0.00 51.96 49.86 2dly s ALA 22 Cb 0.00 -1.78 -0.03 0.00 0.00 0.00 0.00 23.12 21.31 2dly s ALA 22 CO 0.00 -1.53 0.08 0.96 0.00 0.00 0.00 175.76 175.27 2dly s ILE 23 N 1.09 0.86 0.05 0.00 -4.36 -1.24 -4.92 121.20 112.68 2dly s ILE 23 Ca 0.05 -2.00 0.01 0.00 -0.26 0.00 0.00 60.65 58.44 2dly s ILE 23 Cb -0.19 -2.35 -0.04 0.00 1.25 0.00 0.00 42.46 41.14 2dly s ILE 23 CO -0.09 0.00 0.15 -0.54 0.24 0.00 0.00 174.94 174.70 2dly s LYS 24 N -3.77 3.22 0.48 0.37 1.02 -1.26 -4.61 119.74 115.19 2dly s LYS 24 Ca 0.19 -0.51 0.34 0.00 0.02 0.00 0.00 55.97 56.01 2dly s LYS 24 Cb 0.03 -2.93 1.46 0.00 -0.52 0.00 0.00 37.83 35.87 2dly s LYS 24 CO 0.11 0.61 1.68 0.07 -0.92 0.00 0.00 175.35 176.90 2dly h ARG 25 N 3.35 0.10 -0.37 1.68 0.11 -1.99 0.60 114.38 117.87 2dly h ARG 25 Ca -0.46 -0.01 -0.03 0.00 0.10 0.00 0.00 59.98 59.58 2dly h ARG 25 Cb 1.17 -0.02 -0.02 0.00 1.11 0.00 0.00 29.97 32.21 2dly h ARG 25 CO 0.70 0.07 0.11 0.00 0.10 0.00 0.00 179.97 180.95 2dly h ALA 26 N 1.44 0.49 -0.56 0.08 0.00 -1.99 0.25 119.26 118.97 2dly h ALA 26 Ca 0.74 -0.17 -0.11 0.00 0.00 0.00 0.00 54.91 55.37 2dly h ALA 26 Cb 2.55 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 20.17 2dly h ALA 26 CO -0.22 0.14 -0.08 -0.44 0.00 0.00 0.00 179.25 178.65 2dly h ASP 27 N 0.46 1.03 -0.11 0.00 5.19 -0.21 -2.67 116.42 120.11 2dly h ASP 27 Ca 0.12 -0.33 -0.04 0.00 -0.62 0.00 0.00 57.03 56.16 2dly h ASP 27 Cb 0.27 -0.28 -0.00 0.00 0.18 0.00 0.00 39.33 39.50 2dly h ASP 27 CO -0.00 1.13 -0.11 0.00 -3.12 0.00 0.00 179.24 177.14 2dly h ALA 28 N 0.96 0.16 -0.24 3.45 0.00 -1.16 -3.07 119.26 119.37 2dly h ALA 28 Ca 0.15 -0.30 0.06 0.00 0.00 0.00 0.00 54.91 54.82 2dly h ALA 28 Cb 0.65 -0.03 -0.07 0.00 0.00 0.00 0.00 17.79 18.34 2dly h ALA 28 CO 0.04 0.00 -0.24 0.93 0.00 0.00 0.00 179.25 179.99 2dly h GLU 29 N -0.15 -0.24 -0.85 0.00 5.08 -0.49 -0.82 114.58 117.12 2dly h GLU 29 Ca 0.02 0.02 0.16 0.00 -1.00 0.00 0.00 59.36 58.55 2dly h GLU 29 Cb 0.63 0.05 -0.10 0.00 0.50 0.00 0.00 28.75 29.83 2dly h GLU 29 CO 0.03 -0.16 0.42 0.87 -1.00 0.00 0.00 179.01 179.17 2dly h LYS 30 N -0.25 0.55 -0.50 2.33 1.57 -1.53 0.36 116.57 119.11 2dly h LYS 30 Ca 0.14 -0.03 -0.06 0.00 -1.87 0.00 0.00 60.65 58.83 2dly h LYS 30 Cb 0.46 -0.12 -0.02 0.00 0.08 0.00 0.00 32.23 32.62 2dly h LYS 30 CO -0.38 0.37 0.08 1.96 -0.57 0.00 0.00 179.45 180.91 2dly h GLN 31 N 0.57 0.79 0.28 3.15 1.08 -1.10 -2.11 115.11 117.77 2dly h GLN 31 Ca 0.48 -0.17 -0.01 0.00 -1.45 0.00 0.00 58.65 57.49 2dly h GLN 31 Cb 0.72 -0.11 0.00 0.00 -0.05 0.00 0.00 27.48 28.04 2dly h GLN 31 CO -0.39 0.74 -0.14 -0.07 -0.95 0.00 0.00 178.83 178.02 2dly h LEU 32 N 0.75 -0.32 -1.44 1.46 3.38 0.45 -3.20 115.31 116.38 2dly h LEU 32 Ca 0.16 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.12 2dly h LEU 32 Cb 0.34 0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.17 2dly h LEU 32 CO 0.01 0.13 0.38 -0.07 0.09 0.00 0.00 178.44 178.98 2dly h LEU 33 N -1.10 0.00 -7.43 1.67 3.38 -0.46 -3.44 115.31 107.94 2dly h LEU 33 Ca -0.04 0.00 -0.48 0.00 0.09 0.00 0.00 57.88 57.45 2dly h LEU 33 Cb 0.31 0.00 0.17 0.00 0.09 0.00 0.00 40.66 41.23 2dly h LEU 33 CO 0.06 0.00 -1.22 0.00 0.09 0.00 0.00 178.44 177.37 2dly n TYR 34 N -2.57 -3.27 0.15 1.13 9.36 -0.79 -4.90 117.16 116.26 2dly n TYR 34 Ca -0.01 0.19 -0.06 0.00 3.32 0.00 0.00 57.90 61.33 2dly n TYR 34 Cb 0.41 -1.30 -0.03 0.00 -0.63 0.00 0.00 39.34 37.80 2dly n TYR 34 CO 0.00 0.00 0.00 1.03 0.22 0.00 0.00 176.86 178.11 2dly h SER 35 N -0.38 -0.36 -1.26 2.98 0.87 -1.90 -3.23 113.55 110.27 2dly h SER 35 Ca -0.35 0.01 0.39 0.00 -1.23 0.00 0.00 61.79 60.62 2dly h SER 35 Cb 1.14 0.09 -0.12 0.00 -0.44 0.00 0.00 62.40 63.08 2dly h SER 35 CO 0.27 -0.07 0.82 -0.33 -0.53 0.00 0.00 176.83 176.99 2dly h GLU 36 N -0.80 0.15 -6.73 2.24 5.08 -1.95 -3.38 114.58 109.20 2dly h GLU 36 Ca -0.04 -0.01 -0.49 0.00 -1.00 0.00 0.00 59.36 57.81 2dly h GLU 36 Cb 0.32 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.52 2dly h GLU 36 CO 0.07 0.10 0.35 -0.80 -1.00 0.00 0.00 179.01 177.73 2dly s ASN 37 N -4.68 7.62 0.32 1.42 0.01 -1.22 -5.06 114.94 113.34 2dly s ASN 37 Ca -0.08 1.93 0.03 0.00 -0.71 0.00 0.00 52.86 54.04 2dly s ASN 37 Cb 0.28 -2.61 -0.05 0.00 0.41 0.00 0.00 41.25 39.29 2dly s ASN 37 CO 0.82 0.12 0.09 -1.10 -1.51 0.00 0.00 177.10 175.52 2dly s GLN 38 N -1.02 1.62 -0.38 -0.60 -0.21 -1.26 -4.73 119.66 113.07 2dly s GLN 38 Ca 0.42 -1.91 -0.35 0.00 0.02 0.00 0.00 55.36 53.54 2dly s GLN 38 Cb -0.26 -0.59 -0.15 0.00 1.00 0.00 0.00 33.01 33.01 2dly s GLN 38 CO 0.32 -0.28 1.35 2.41 -2.12 0.00 0.00 175.29 176.97 2dly n THR 39 N -0.65 0.00 0.00 -0.19 -1.04 -1.26 -1.67 114.28 109.48 2dly n THR 39 Ca -0.02 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.99 2dly n THR 39 Cb 0.66 -0.38 0.00 0.00 -1.82 0.00 0.00 70.33 68.79 2dly n THR 39 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2dly n GLY 40 N 3.90 2.08 3.69 3.41 0.00 -0.47 -4.90 105.19 112.90 2dly n GLY 40 Ca 0.29 -0.44 -0.58 0.00 0.00 0.00 0.00 46.02 45.29 2dly n GLY 40 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dly n ALA 41 N 0.00 -0.22 -2.47 4.61 0.00 -0.67 -3.59 120.51 118.18 2dly n ALA 41 Ca 0.00 0.37 -0.24 0.00 0.00 0.00 0.00 53.44 53.57 2dly n ALA 41 Cb 0.00 -2.21 -0.12 0.00 0.00 0.00 0.00 19.45 17.12 2dly n ALA 41 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 177.50 176.91 2dly s PHE 42 N 3.76 1.94 -0.26 0.00 -0.71 -0.95 -0.43 117.98 121.33 2dly s PHE 42 Ca 1.00 -0.43 -0.14 0.00 -1.04 0.00 0.00 56.93 56.32 2dly s PHE 42 Cb -1.11 -1.00 0.08 0.00 -1.21 0.00 0.00 43.02 39.78 2dly s PHE 42 CO 0.67 0.33 0.64 -0.48 -1.34 0.00 0.00 175.22 175.04 2dly s LEU 43 N -2.43 -0.80 -0.11 -1.99 0.05 0.14 -0.26 118.68 113.28 2dly s LEU 43 Ca 0.14 1.40 -0.08 0.00 0.05 0.00 0.00 54.13 55.64 2dly s LEU 43 Cb -0.08 2.19 -0.04 0.00 -2.05 0.00 0.00 46.19 46.21 2dly s LEU 43 CO 0.07 -0.23 0.18 -0.63 -0.55 0.00 0.00 176.35 175.18 2dly s ILE 44 N 1.65 5.44 0.02 1.48 1.09 0.17 -0.25 121.20 130.81 2dly s ILE 44 Ca -0.10 0.30 -0.03 0.00 -1.10 0.00 0.00 60.65 59.72 2dly s ILE 44 Cb -0.06 -3.45 -0.02 0.00 -1.06 0.00 0.00 42.46 37.88 2dly s ILE 44 CO -0.19 0.60 0.03 0.00 -0.10 0.00 0.00 174.94 175.29 2dly s ARG 45 N -0.96 0.44 0.71 2.79 1.70 -0.50 -1.57 118.95 121.57 2dly s ARG 45 Ca 0.16 -0.67 -0.14 0.00 -0.47 0.00 0.00 55.73 54.61 2dly s ARG 45 Cb -0.13 0.17 0.03 0.00 -0.57 0.00 0.00 34.95 34.45 2dly s ARG 45 CO 0.05 -0.09 1.13 -1.21 -1.08 0.00 0.00 175.30 174.10 2dly s GLU 46 N -1.98 2.47 -0.29 3.89 0.41 0.27 -0.14 118.70 123.33 2dly s GLU 46 Ca -0.11 1.43 -0.29 0.00 -0.41 0.00 0.00 54.97 55.59 2dly s GLU 46 Cb -0.06 -1.91 0.01 0.00 -1.78 0.00 0.00 34.13 30.40 2dly s GLU 46 CO -0.02 -1.52 1.14 -1.54 -0.49 0.00 0.00 175.26 172.83 2dly s SER 47 N -2.64 6.89 0.72 -0.19 1.04 -1.20 -4.36 113.70 113.96 2dly s SER 47 Ca 0.67 1.18 -0.16 0.00 0.48 0.00 0.00 55.95 58.12 2dly s SER 47 Cb -0.22 -2.54 -0.04 0.00 0.10 0.00 0.00 66.02 63.33 2dly s SER 47 CO 0.46 -0.89 0.56 -1.84 0.98 0.00 0.00 173.24 172.51 2dly n GLU 48 N 6.88 0.32 -3.68 4.02 0.28 -1.26 -1.95 120.64 125.26 2dly n GLU 48 Ca 0.13 0.15 -0.28 0.00 -0.16 0.00 0.00 57.16 57.00 2dly n GLU 48 Cb 0.47 -1.85 -0.01 0.00 1.43 0.00 0.00 31.44 31.47 2dly n GLU 48 CO 0.00 0.00 0.00 0.45 -0.16 0.00 0.00 177.13 177.42 2dly n SER 49 N -0.37 -3.57 -3.64 -1.84 2.88 -1.26 -4.89 113.62 100.93 2dly n SER 49 Ca 0.10 -0.61 -0.05 0.00 -1.33 0.00 0.00 58.87 56.98 2dly n SER 49 Cb 0.50 -2.94 -0.06 0.00 -0.75 0.00 0.00 64.21 60.95 2dly n SER 49 CO 0.00 0.00 0.00 -1.58 -1.23 0.00 0.00 175.04 172.23 2dly s GLN 50 N -6.35 0.25 -0.24 -1.46 2.00 -0.82 -5.14 119.66 107.89 2dly s GLN 50 Ca 0.53 0.23 0.01 0.00 -2.00 0.00 0.00 55.36 54.14 2dly s GLN 50 Cb -0.28 0.12 0.06 0.00 0.80 0.00 0.00 33.01 33.71 2dly s GLN 50 CO 0.65 -0.04 -0.06 0.21 -0.50 0.00 0.00 175.29 175.55 2dly s LYS 51 N -0.16 1.77 0.00 1.67 2.47 -1.26 -4.22 119.74 120.00 2dly s LYS 51 Ca 0.05 -1.10 0.00 0.00 -1.56 0.00 0.00 55.97 53.36 2dly s LYS 51 Cb -0.04 -2.67 0.00 0.00 -1.46 0.00 0.00 37.83 33.66 2dly s LYS 51 CO -0.10 -0.60 0.00 0.41 0.16 0.00 0.00 175.35 175.22 2dly n GLY 52 N 4.60 0.75 3.97 5.54 0.00 -1.26 -5.12 105.19 113.68 2dly n GLY 52 Ca -0.12 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.68 2dly n GLY 52 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2dly s ASP 53 N 0.00 5.00 -0.06 1.61 2.15 -1.26 -4.93 116.67 119.18 2dly s ASP 53 Ca 0.00 -0.92 -0.23 0.00 0.43 0.00 0.00 52.55 51.84 2dly s ASP 53 Cb 0.00 0.13 0.05 0.00 -0.30 0.00 0.00 42.92 42.80 2dly s ASP 53 CO 0.00 -1.12 0.51 -0.36 -0.17 0.00 0.00 175.17 174.03 2dly s PHE 54 N -2.64 -0.46 -0.06 -5.34 0.40 -1.24 -3.26 117.98 105.38 2dly s PHE 54 Ca 0.51 0.86 0.03 0.00 -0.60 0.00 0.00 56.93 57.73 2dly s PHE 54 Cb -0.05 0.25 0.00 0.00 0.51 0.00 0.00 43.02 43.74 2dly s PHE 54 CO 0.31 -0.47 -0.17 0.45 0.70 0.00 0.00 175.22 176.05 2dly s SER 55 N -0.97 2.20 -0.32 1.36 0.15 0.81 -0.16 113.70 116.76 2dly s SER 55 Ca -0.10 -0.37 -0.16 0.00 0.70 0.00 0.00 55.95 56.01 2dly s SER 55 Cb -0.03 -0.86 -0.02 0.00 -1.71 0.00 0.00 66.02 63.41 2dly s SER 55 CO 0.06 0.11 0.42 -0.22 1.20 0.00 0.00 173.24 174.81 2dly s LEU 56 N 0.35 4.29 -0.32 3.45 2.96 0.65 -1.40 118.68 128.66 2dly s LEU 56 Ca -0.11 -0.01 -0.08 0.00 -0.22 0.00 0.00 54.13 53.71 2dly s LEU 56 Cb -0.15 -2.45 0.01 0.00 0.50 0.00 0.00 46.19 44.10 2dly s LEU 56 CO 0.04 -0.35 0.12 -0.44 -1.32 0.00 0.00 176.35 174.41 2dly s SER 57 N 1.71 5.37 0.16 3.68 0.01 0.66 -0.81 113.70 124.48 2dly s SER 57 Ca 0.15 -0.73 0.10 0.00 1.31 0.00 0.00 55.95 56.79 2dly s SER 57 Cb -0.16 -1.94 -0.04 0.00 0.21 0.00 0.00 66.02 64.09 2dly s SER 57 CO 0.12 -0.23 -0.24 -0.69 0.41 0.00 0.00 173.24 172.61 2dly s VAL 58 N 1.54 2.16 -0.17 3.43 1.01 -1.16 0.28 120.40 127.50 2dly s VAL 58 Ca 0.03 -1.86 -0.10 0.00 0.00 0.00 0.00 61.98 60.04 2dly s VAL 58 Cb -0.18 -1.97 -0.05 0.00 0.00 0.00 0.00 36.38 34.19 2dly s VAL 58 CO 0.04 -0.07 0.18 -0.22 0.00 0.00 0.00 175.10 175.03 2dly s LEU 59 N -2.37 4.27 -0.44 3.92 2.96 0.42 -1.07 118.68 126.36 2dly s LEU 59 Ca 0.16 0.37 0.03 0.00 -0.22 0.00 0.00 54.13 54.47 2dly s LEU 59 Cb -0.09 -2.17 0.16 0.00 0.50 0.00 0.00 46.19 44.59 2dly s LEU 59 CO 0.07 0.22 0.31 -0.62 -1.32 0.00 0.00 176.35 175.01 2dly s ASP 60 N 0.03 2.70 -0.71 3.68 2.15 0.35 -1.37 116.67 123.51 2dly s ASP 60 Ca 0.12 -2.89 -0.00 0.00 0.43 0.00 0.00 52.55 50.21 2dly s ASP 60 Cb -0.12 -0.72 -0.00 0.00 -0.30 0.00 0.00 42.92 41.78 2dly s ASP 60 CO 0.01 -0.21 0.59 -0.62 -0.17 0.00 0.00 175.17 174.78 2dly n GLU 61 N 3.14 -3.84 0.00 4.34 1.02 -1.26 -2.77 120.64 121.26 2dly n GLU 61 Ca 0.20 0.51 0.00 0.00 -0.02 0.00 0.00 57.16 57.85 2dly n GLU 61 Cb 0.41 -4.49 0.00 0.00 -0.02 0.00 0.00 31.44 27.34 2dly n GLU 61 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2dly n GLY 62 N -1.09 2.75 3.93 0.62 0.00 -1.26 -5.00 105.19 105.14 2dly n GLY 62 Ca -0.17 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.61 2dly n GLY 62 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2dly s VAL 63 N -2.47 4.62 -0.28 1.61 0.11 -1.11 -4.81 120.40 118.07 2dly s VAL 63 Ca 0.00 -0.27 0.02 0.00 -2.93 0.00 0.00 61.98 58.80 2dly s VAL 63 Cb 0.00 -3.72 0.08 0.00 -1.53 0.00 0.00 36.38 31.21 2dly s VAL 63 CO 0.00 -0.56 -0.02 -0.69 -3.33 0.00 0.00 175.10 170.50 2dly s VAL 64 N -2.55 1.78 -0.55 2.04 1.01 -1.26 -0.49 120.40 120.38 2dly s VAL 64 Ca 0.45 -1.64 -0.23 0.00 0.00 0.00 0.00 61.98 60.56 2dly s VAL 64 Cb -0.10 -2.12 0.04 0.00 0.00 0.00 0.00 36.38 34.20 2dly s VAL 64 CO 0.40 -0.30 0.90 -0.54 0.00 0.00 0.00 175.10 175.56 2dly s LYS 65 N 1.23 3.30 -0.46 2.72 3.01 -0.23 -4.92 119.74 124.38 2dly s LYS 65 Ca 0.00 -0.37 -0.27 0.00 -1.01 0.00 0.00 55.97 54.33 2dly s LYS 65 Cb -0.19 -4.06 0.03 0.00 -1.01 0.00 0.00 37.83 32.59 2dly s LYS 65 CO -0.09 -1.46 0.99 -1.01 0.51 0.00 0.00 175.35 174.29 2dly s HIS 66 N 3.78 2.90 -0.32 3.18 3.76 -1.26 -2.97 115.29 124.36 2dly s HIS 66 Ca 0.28 0.53 -0.08 0.00 -0.15 0.00 0.00 55.06 55.63 2dly s HIS 66 Cb -0.14 -4.09 0.01 0.00 1.11 0.00 0.00 32.58 29.48 2dly s HIS 66 CO 0.18 -1.13 0.13 0.71 -0.85 0.00 0.00 174.74 173.78 2dly s TYR 67 N 3.95 3.19 0.03 1.40 2.02 0.01 -4.96 117.35 123.00 2dly s TYR 67 Ca 0.41 -0.96 -0.30 0.00 -0.37 0.00 0.00 57.07 55.85 2dly s TYR 67 Cb -0.09 -2.32 -0.06 0.00 -0.40 0.00 0.00 41.96 39.09 2dly s TYR 67 CO 0.27 -0.59 1.40 1.03 -1.57 0.00 0.00 175.55 176.09 2dly s ARG 68 N 1.52 4.30 -0.20 -0.62 1.81 -1.26 -0.25 118.95 124.24 2dly s ARG 68 Ca 0.02 2.00 -0.09 0.00 -1.72 0.00 0.00 55.73 55.94 2dly s ARG 68 Cb -0.18 -3.49 -0.05 0.00 -0.45 0.00 0.00 34.95 30.79 2dly s ARG 68 CO 0.04 -0.53 0.11 0.42 -0.68 0.00 0.00 175.30 174.66 2dly s ILE 69 N 2.03 5.18 0.35 1.52 1.01 0.77 -4.79 121.20 127.27 2dly s ILE 69 Ca 0.64 0.11 0.09 0.00 0.00 0.00 0.00 60.65 61.49 2dly s ILE 69 Cb -0.33 -3.37 -0.05 0.00 0.01 0.00 0.00 42.46 38.72 2dly s ILE 69 CO 0.28 0.43 0.06 0.00 0.00 0.00 0.00 174.94 175.70 2dly s ARG 70 N 0.50 2.16 0.07 2.79 1.70 -1.15 -3.63 118.95 121.40 2dly s ARG 70 Ca 0.06 -1.71 0.07 0.00 -0.47 0.00 0.00 55.73 53.69 2dly s ARG 70 Cb -0.12 -1.99 -0.03 0.00 -0.57 0.00 0.00 34.95 32.24 2dly s ARG 70 CO -0.00 0.11 -0.20 1.03 -1.08 0.00 0.00 175.30 175.16 2dly s ARG 71 N -3.76 1.21 0.32 3.89 0.52 -1.26 -0.63 118.95 119.25 2dly s ARG 71 Ca 0.36 -1.01 0.02 0.00 -0.52 0.00 0.00 55.73 54.58 2dly s ARG 71 Cb -0.00 -1.38 0.06 0.00 0.52 0.00 0.00 34.95 34.15 2dly s ARG 71 CO 0.20 0.34 0.45 1.28 0.02 0.00 0.00 175.30 177.59 2dly n LEU 72 N 1.52 0.00 -0.45 2.53 7.99 0.24 -5.00 117.00 123.83 2dly n LEU 72 Ca -0.18 -1.12 0.05 0.00 -0.01 0.00 0.00 56.01 54.75 2dly n LEU 72 Cb 0.54 -0.27 0.06 0.00 -0.11 0.00 0.00 43.42 43.63 2dly n LEU 72 CO 0.23 -0.68 0.44 0.47 -1.51 0.00 0.00 177.39 176.34 2dly n ASP 73 N -2.83 2.00 0.00 -1.43 9.92 -1.26 -4.55 116.55 118.40 2dly n ASP 73 Ca 0.08 -1.50 0.00 0.00 -0.53 0.00 0.00 54.79 52.84 2dly n ASP 73 Cb 0.29 -0.02 0.00 0.00 -0.64 0.00 0.00 41.12 40.75 2dly n ASP 73 CO 0.00 0.00 0.00 -1.84 0.13 0.00 0.00 177.20 175.49 2dly n GLU 74 N 0.59 1.93 0.00 -1.24 0.28 -1.26 -5.06 120.64 115.87 2dly n GLU 74 Ca 0.07 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.07 2dly n GLU 74 Cb 0.28 -0.87 0.00 0.00 1.43 0.00 0.00 31.44 32.28 2dly n GLU 74 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 2dly n GLY 75 N 1.99 1.74 0.00 -1.84 0.00 -1.26 -5.18 105.19 100.65 2dly n GLY 75 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.01 2dly n GLY 75 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2dly n GLY 76 N 4.92 4.02 3.90 -0.02 0.00 -0.81 -4.80 105.19 112.40 2dly n GLY 76 Ca 0.00 -0.43 -0.34 0.00 0.00 0.00 0.00 46.02 45.25 2dly n GLY 76 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2dly s PHE 77 N 2.87 3.56 -0.18 1.61 0.40 -0.86 -0.59 117.98 124.79 2dly s PHE 77 Ca 0.00 0.46 -0.09 0.00 -0.60 0.00 0.00 56.93 56.69 2dly s PHE 77 Cb 0.00 -1.90 0.06 0.00 0.51 0.00 0.00 43.02 41.69 2dly s PHE 77 CO 0.00 0.63 0.42 -0.59 0.70 0.00 0.00 175.22 176.38 2dly s PHE 78 N -1.31 -0.63 -0.17 0.36 -0.71 0.20 0.04 117.98 115.75 2dly s PHE 78 Ca 0.27 1.33 0.18 0.00 -1.04 0.00 0.00 56.93 57.68 2dly s PHE 78 Cb -0.13 0.28 -0.05 0.00 -1.21 0.00 0.00 43.02 41.91 2dly s PHE 78 CO 0.17 -0.36 1.00 1.25 -1.34 0.00 0.00 175.22 175.95 2dly h LEU 79 N 7.19 0.00 -7.32 -1.99 5.85 -1.84 -3.04 115.31 114.17 2dly h LEU 79 Ca -0.35 0.00 -0.25 0.00 0.84 0.00 0.00 57.88 58.12 2dly h LEU 79 Cb 1.18 0.00 -0.33 0.00 0.37 0.00 0.00 40.66 41.88 2dly h LEU 79 CO 0.28 0.39 -0.58 0.28 -0.34 0.00 0.00 178.44 178.47 2dly s THR 80 N -3.06 -0.18 0.62 1.05 -1.32 -1.25 -4.94 115.64 106.55 2dly s THR 80 Ca -0.01 0.25 0.21 0.00 -1.21 0.00 0.00 61.69 60.93 2dly s THR 80 Cb 0.09 -0.32 0.30 0.00 -1.51 0.00 0.00 72.50 71.06 2dly s THR 80 CO 0.79 0.10 1.33 0.03 -2.21 0.00 0.00 174.62 174.67 2dly h ARG 81 N 7.79 0.00 -0.53 7.08 2.47 -2.03 0.77 114.38 129.93 2dly h ARG 81 Ca -0.28 0.00 -0.01 0.00 -1.26 0.00 0.00 59.98 58.43 2dly h ARG 81 Cb 1.13 0.00 -0.03 0.00 -1.65 0.00 0.00 29.97 29.43 2dly h ARG 81 CO 0.27 0.00 0.29 0.00 0.56 0.00 0.00 179.97 181.09 2dly h ARG 82 N 0.00 0.75 -5.40 0.04 3.08 -2.00 -3.44 114.38 107.41 2dly h ARG 82 Ca 0.33 -0.09 -0.42 0.00 0.07 0.00 0.00 59.98 59.87 2dly h ARG 82 Cb 2.43 -0.14 -0.21 0.00 0.08 0.00 0.00 29.97 32.12 2dly h ARG 82 CO -0.00 0.58 -0.78 0.21 -1.07 0.00 0.00 179.97 178.91 2dly s LYS 83 N -5.83 0.84 0.00 0.04 2.47 0.27 -5.16 119.74 112.38 2dly s LYS 83 Ca -0.13 -0.98 -0.02 0.00 -1.56 0.00 0.00 55.97 53.29 2dly s LYS 83 Cb 0.12 -0.87 -0.01 0.00 -1.46 0.00 0.00 37.83 35.62 2dly s LYS 83 CO 0.76 0.19 0.03 0.08 0.16 0.00 0.00 175.35 176.57 2dly s VAL 84 N -1.29 0.05 0.35 4.02 1.01 -1.26 -3.97 120.40 119.31 2dly s VAL 84 Ca -0.01 -0.43 0.00 0.00 0.00 0.00 0.00 61.98 61.54 2dly s VAL 84 Cb -0.10 -0.18 -0.00 0.00 0.00 0.00 0.00 36.38 36.10 2dly s VAL 84 CO 0.02 -0.24 0.01 0.49 0.00 0.00 0.00 175.10 175.39 2dly n PHE 85 N 2.31 0.75 -0.12 5.22 3.72 0.11 -5.00 117.46 124.45 2dly n PHE 85 Ca -0.18 -1.77 -0.24 0.00 -0.05 0.00 0.00 57.45 55.21 2dly n PHE 85 Cb 0.57 -0.21 -0.08 0.00 -0.94 0.00 0.00 39.48 38.82 2dly n PHE 85 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 176.76 177.14 2dly n SER 86 N -1.26 1.72 -4.37 4.37 7.64 -1.26 -1.93 113.62 118.52 2dly n SER 86 Ca -0.14 0.30 -0.19 0.00 1.01 0.00 0.00 58.87 59.85 2dly n SER 86 Cb 0.45 -0.71 -0.10 0.00 -1.01 0.00 0.00 64.21 62.83 2dly n SER 86 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 2dly s THR 87 N -2.48 1.20 0.57 0.44 -4.23 -1.26 -3.61 115.64 106.27 2dly s THR 87 Ca -0.33 -2.05 0.28 0.00 -1.18 0.00 0.00 61.69 58.41 2dly s THR 87 Cb 0.12 -2.44 0.40 0.00 1.34 0.00 0.00 72.50 71.91 2dly s THR 87 CO 0.42 -0.26 1.94 -0.07 -0.54 0.00 0.00 174.62 176.11 2dly h LEU 88 N 2.37 0.00 0.26 4.79 3.38 -1.97 -1.64 115.31 122.51 2dly h LEU 88 Ca -0.39 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.57 2dly h LEU 88 Cb 1.23 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.98 2dly h LEU 88 CO 0.66 0.00 -0.13 -1.13 0.09 0.00 0.00 178.44 177.93 2dly h ASN 89 N 0.00 -0.30 -0.03 -0.43 -0.73 -2.00 -2.80 115.58 109.29 2dly h ASN 89 Ca 0.23 0.01 0.01 0.00 1.87 0.00 0.00 56.30 58.42 2dly h ASN 89 Cb 1.14 0.08 -0.00 0.00 0.27 0.00 0.00 38.32 39.80 2dly h ASN 89 CO -0.00 -0.20 0.08 -0.33 -0.37 0.00 0.00 177.43 176.61 2dly h GLU 90 N -0.39 0.00 -0.75 6.67 5.08 -1.88 0.48 114.58 123.80 2dly h GLU 90 Ca -0.04 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.28 2dly h GLU 90 Cb 0.27 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.49 2dly h GLU 90 CO 0.06 0.00 0.30 0.35 -1.00 0.00 0.00 179.01 178.72 2dly h PHE 91 N 0.00 1.14 0.08 4.33 3.04 -1.11 -2.73 116.94 121.69 2dly h PHE 91 Ca 0.01 -0.09 -0.36 0.00 3.98 0.00 0.00 57.97 61.52 2dly h PHE 91 Cb 0.18 -0.34 -0.03 0.00 2.56 0.00 0.00 35.95 38.32 2dly h PHE 91 CO 0.00 0.87 -2.06 0.28 -2.02 0.00 0.00 178.31 175.38 2dly n VAL 92 N -4.33 1.68 0.27 1.41 0.31 -0.53 -3.67 118.33 113.48 2dly n VAL 92 Ca 0.06 -0.67 0.15 0.00 -0.01 0.00 0.00 64.34 63.86 2dly n VAL 92 Cb 0.18 -1.50 0.78 0.00 -0.91 0.00 0.00 33.84 32.39 2dly n VAL 92 CO 0.00 0.00 0.00 0.78 -1.32 0.00 0.00 176.83 176.29 2dly h ASN 93 N 0.04 0.00 0.00 4.52 2.35 -0.97 0.48 115.58 122.00 2dly h ASN 93 Ca -0.44 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.31 2dly h ASN 93 Cb 2.02 0.00 0.00 0.00 0.05 0.00 0.00 38.32 40.39 2dly h ASN 93 CO 0.05 0.00 -0.30 0.00 -1.65 0.00 0.00 177.43 175.53 2dly n TYR 94 N -2.66 0.39 -0.09 1.19 4.19 -1.03 -4.33 117.16 114.82 2dly n TYR 94 Ca -0.02 0.17 0.26 0.00 3.31 0.00 0.00 57.90 61.62 2dly n TYR 94 Cb 0.24 -0.47 0.72 0.00 0.49 0.00 0.00 39.34 40.32 2dly n TYR 94 CO 0.00 0.00 0.00 1.88 0.91 0.00 0.00 176.86 179.65 2dly h TYR 95 N -0.51 0.00 -0.08 2.98 0.05 -1.59 0.22 116.97 118.04 2dly h TYR 95 Ca 0.00 0.00 0.02 0.00 0.05 0.00 0.00 58.73 58.80 2dly h TYR 95 Cb 0.30 0.00 -0.00 0.00 1.01 0.00 0.00 36.73 38.04 2dly h TYR 95 CO -0.13 0.00 0.29 1.79 -1.05 0.00 0.00 178.16 179.06 2dly h THR 96 N 0.00 0.12 0.14 -2.88 1.35 -1.07 -0.62 112.91 109.95 2dly h THR 96 Ca 0.35 0.00 -0.35 0.00 -0.55 0.00 0.00 66.41 65.86 2dly h THR 96 Cb 1.53 0.73 -0.01 0.00 -1.73 0.00 0.00 68.15 68.67 2dly h THR 96 CO -0.00 0.00 -1.83 0.71 -0.25 0.00 0.00 175.52 174.15 2dly h THR 97 N 0.00 0.78 -3.72 6.82 1.35 -0.77 -3.44 112.91 113.94 2dly h THR 97 Ca 0.04 -2.40 -0.08 0.00 -0.55 0.00 0.00 66.41 63.42 2dly h THR 97 Cb 0.62 2.61 -0.12 0.00 -1.73 0.00 0.00 68.15 69.52 2dly h THR 97 CO -0.00 0.85 -0.24 0.28 -0.25 0.00 0.00 175.52 176.16 2dly s THR 98 N -2.55 0.07 -0.51 6.82 -1.32 -0.24 -5.04 115.64 112.87 2dly s THR 98 Ca -0.20 -1.15 0.02 0.00 -1.21 0.00 0.00 61.69 59.15 2dly s THR 98 Cb 0.06 -1.62 0.49 0.00 -1.51 0.00 0.00 72.50 69.91 2dly s THR 98 CO 0.79 -0.34 1.77 -1.54 -2.21 0.00 0.00 174.62 173.09 2dly n SER 99 N -0.21 5.97 -4.50 8.08 3.41 -1.26 -4.32 113.62 120.79 2dly n SER 99 Ca -0.10 -3.76 -0.35 0.00 -0.26 0.00 0.00 58.87 54.40 2dly n SER 99 Cb 0.63 -0.78 -0.16 0.00 -0.26 0.00 0.00 64.21 63.64 2dly n SER 99 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 2dly n ASP 100 N -0.93 -0.00 0.00 4.04 9.92 -1.26 0.29 116.55 128.61 2dly n ASP 100 Ca 0.55 -0.08 0.00 0.00 -0.53 0.00 0.00 54.79 54.73 2dly n ASP 100 Cb 0.91 -0.88 0.00 0.00 -0.64 0.00 0.00 41.12 40.51 2dly n ASP 100 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2dly n GLY 101 N 6.23 2.58 3.74 0.44 0.00 -1.26 -5.02 105.19 111.90 2dly n GLY 101 Ca 0.64 -0.62 -0.36 0.00 0.00 0.00 0.00 46.02 45.68 2dly n GLY 101 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2dly s LEU 102 N 0.00 3.58 0.29 0.99 1.43 0.15 -4.91 118.68 120.20 2dly s LEU 102 Ca 0.00 2.54 -0.02 0.00 -1.03 0.00 0.00 54.13 55.62 2dly s LEU 102 Cb 0.00 -4.61 0.42 0.00 0.03 0.00 0.00 46.19 42.03 2dly s LEU 102 CO 0.00 -1.92 1.95 0.00 0.23 0.00 0.00 176.35 176.61 2dly s VAL 104 N -5.96 0.29 -0.14 0.00 0.11 -1.26 -5.08 120.40 108.35 2dly s VAL 104 Ca -0.12 -1.85 -0.19 0.00 -2.93 0.00 0.00 61.98 56.90 2dly s VAL 104 Cb 0.18 -1.62 -0.04 0.00 -1.53 0.00 0.00 36.38 33.37 2dly s VAL 104 CO 0.80 -0.91 0.51 -0.75 -3.33 0.00 0.00 175.10 171.42 2dly s LYS 105 N -3.92 4.29 -0.13 1.54 2.20 -1.26 -4.63 119.74 117.84 2dly s LYS 105 Ca 0.10 0.47 -0.31 0.00 -0.36 0.00 0.00 55.97 55.88 2dly s LYS 105 Cb 0.07 -3.48 -0.08 0.00 -1.51 0.00 0.00 37.83 32.83 2dly s LYS 105 CO -0.08 0.03 2.07 1.28 -0.36 0.00 0.00 175.35 178.30 2dly n LEU 106 N 4.10 3.47 -0.01 5.43 4.77 -1.25 -4.79 117.00 128.72 2dly n LEU 106 Ca -0.06 0.60 -0.01 0.00 -0.03 0.00 0.00 56.01 56.51 2dly n LEU 106 Cb 0.51 -1.48 -0.00 0.00 -2.33 0.00 0.00 43.42 40.12 2dly n LEU 106 CO 0.43 -0.28 -0.09 -0.62 -1.33 0.00 0.00 177.39 175.50 2dly n GLU 107 N 7.89 0.09 -4.05 3.23 -0.58 -1.24 -4.22 120.64 121.76 2dly n GLU 107 Ca 0.27 0.19 -0.11 0.00 -0.42 0.00 0.00 57.16 57.09 2dly n GLU 107 Cb 0.38 -0.81 -0.11 0.00 -0.57 0.00 0.00 31.44 30.33 2dly n GLU 107 CO 0.00 0.00 0.00 0.15 -0.48 0.00 0.00 177.13 176.80 2dly s LYS 108 N -1.27 0.50 0.34 3.49 1.02 -1.26 -5.05 119.74 117.51 2dly s LYS 108 Ca -0.04 -0.84 -0.28 0.00 0.02 0.00 0.00 55.97 54.83 2dly s LYS 108 Cb 0.01 -0.08 -0.10 0.00 -0.52 0.00 0.00 37.83 37.14 2dly s LYS 108 CO 0.05 -0.01 1.21 -1.25 -0.92 0.00 0.00 175.35 174.43 2dly s PRO 109 N -2.14 4.33 0.50 -1.68 0.04 -1.26 -2.25 135.00 132.54 2dly s PRO 109 Ca -0.07 2.00 -0.21 0.00 0.04 0.00 0.00 61.00 62.76 2dly s PRO 109 Cb -0.06 -2.98 -0.09 0.00 0.04 0.00 0.00 34.50 31.41 2dly s PRO 109 CO -0.02 -0.13 0.79 0.00 0.04 0.00 0.00 177.00 177.68 2dly s LEU 111 N -0.11 2.13 -0.43 0.00 1.43 -1.26 -4.73 118.68 115.72 2dly s LEU 111 Ca 0.67 1.72 0.03 0.00 -1.03 0.00 0.00 54.13 55.53 2dly s LEU 111 Cb -0.51 -4.02 0.11 0.00 0.03 0.00 0.00 46.19 41.81 2dly s LEU 111 CO 0.54 -3.11 0.16 -0.54 0.23 0.00 0.00 176.35 173.63 2dly s LYS 112 N -4.74 1.75 0.41 1.70 1.02 -1.26 -5.00 119.74 113.62 2dly s LYS 112 Ca 0.65 -2.20 -0.26 0.00 0.02 0.00 0.00 55.97 54.18 2dly s LYS 112 Cb -0.21 -3.29 -0.09 0.00 -0.52 0.00 0.00 37.83 33.72 2dly s LYS 112 CO 0.59 -1.02 1.31 0.42 -0.92 0.00 0.00 175.35 175.73 2dly s ILE 113 N 0.40 2.58 -0.68 2.17 1.01 -1.26 -4.93 121.20 120.48 2dly s ILE 113 Ca 0.13 0.52 -0.01 0.00 0.00 0.00 0.00 60.65 61.29 2dly s ILE 113 Cb -0.22 -3.30 0.43 0.00 0.01 0.00 0.00 42.46 39.38 2dly s ILE 113 CO -0.04 0.07 1.98 1.67 0.00 0.00 0.00 174.94 178.62 2dly n GLN 114 N 0.09 2.76 -5.14 2.79 0.00 -1.26 -4.93 117.38 111.69 2dly n GLN 114 Ca 0.04 -3.39 -0.32 0.00 -0.00 0.00 0.00 57.00 53.32 2dly n GLN 114 Cb 0.43 -2.29 -0.16 0.00 0.00 0.00 0.00 30.24 28.23 2dly n GLN 114 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.06 177.14 2dly s VAL 115 N -4.87 2.34 -1.27 1.69 1.01 -1.26 -4.65 120.40 113.38 2dly s VAL 115 Ca 0.62 -0.96 -0.06 0.00 0.00 0.00 0.00 61.98 61.58 2dly s VAL 115 Cb 0.49 -1.88 0.01 0.00 0.00 0.00 0.00 36.38 34.99 2dly s VAL 115 CO -0.08 0.57 0.81 -0.24 0.00 0.00 0.00 175.10 176.15 2dly n SER 116 N 2.98 -5.74 0.00 3.32 2.88 -1.26 -5.00 113.62 110.81 2dly n SER 116 Ca -0.18 -0.37 0.00 0.00 -1.33 0.00 0.00 58.87 56.99 2dly n SER 116 Cb 0.52 -4.45 0.00 0.00 -0.75 0.00 0.00 64.21 59.53 2dly n SER 116 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2dly n GLY 117 N -1.65 4.04 3.77 0.46 0.00 -1.26 -5.10 105.19 105.45 2dly n GLY 117 Ca -0.04 -1.96 -0.38 0.00 0.00 0.00 0.00 46.02 43.64 2dly n GLY 117 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2dly s PRO 118 N 2.54 4.03 1.19 1.61 0.04 -1.26 -5.02 135.00 138.14 2dly s PRO 118 Ca 0.00 1.88 -0.15 0.00 0.04 0.00 0.00 61.00 62.77 2dly s PRO 118 Cb 0.00 -2.68 0.29 0.00 0.04 0.00 0.00 34.50 32.15 2dly s PRO 118 CO 0.00 -0.35 1.02 -1.12 0.04 0.00 0.00 177.00 176.59 2dly s SER 119 N -1.09 0.79 -0.28 6.66 0.01 -1.26 -5.07 113.70 113.46 2dly s SER 119 Ca 0.57 1.29 -0.14 0.00 1.31 0.00 0.00 55.95 58.99 2dly s SER 119 Cb -0.32 -1.99 0.10 0.00 0.21 0.00 0.00 66.02 64.02 2dly s SER 119 CO 0.40 -4.28 0.67 -0.94 0.41 0.00 0.00 173.24 169.49 2dly s SER 120 N -2.81 -1.00 0.00 2.44 1.04 -1.26 -5.27 113.70 106.84 2dly s SER 120 Ca 0.68 1.52 0.00 0.00 0.48 0.00 0.00 55.95 58.64 2dly s SER 120 Cb -0.22 1.69 0.00 0.00 0.10 0.00 0.00 66.02 67.59 2dly s SER 120 CO 0.62 -0.23 0.00 0.61 0.98 0.00 0.00 173.24 175.22