#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 6.12 -1.05 1.61 0.01 -1.26 -4.91 113.70 114.22 2dly s SER 2 Ca 0.00 1.88 -0.22 0.00 1.31 0.00 0.00 55.95 58.92 2dly s SER 2 Cb 0.00 -2.53 0.05 0.00 0.21 0.00 0.00 66.02 63.75 2dly s SER 2 CO 0.00 -1.43 1.52 -0.44 0.41 0.00 0.00 173.24 173.30 2dly s SER 3 N 5.46 6.45 0.00 2.44 0.01 -1.26 -3.99 113.70 122.81 2dly s SER 3 Ca 0.83 -1.54 0.00 0.00 1.31 0.00 0.00 55.95 56.55 2dly s SER 3 Cb -0.30 -2.57 0.00 0.00 0.21 0.00 0.00 66.02 63.35 2dly s SER 3 CO 0.34 -1.55 0.00 0.61 0.41 0.00 0.00 173.24 173.04 2dly n GLY 4 N 6.68 0.00 3.26 3.44 0.00 -1.26 -5.12 105.19 112.19 2dly n GLY 4 Ca 0.36 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.94 2dly n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2dly s SER 5 N 0.00 6.01 0.29 1.61 0.15 -1.26 -5.02 113.70 115.48 2dly s SER 5 Ca 0.00 -1.98 -0.16 0.00 0.70 0.00 0.00 55.95 54.51 2dly s SER 5 Cb 0.00 -2.11 0.02 0.00 -1.71 0.00 0.00 66.02 62.21 2dly s SER 5 CO 0.00 -0.74 0.63 -0.44 1.20 0.00 0.00 173.24 173.89 2dly s SER 6 N 2.94 -0.06 0.00 5.45 0.01 -1.26 -5.11 113.70 115.66 2dly s SER 6 Ca 0.06 -0.88 0.00 0.00 1.31 0.00 0.00 55.95 56.44 2dly s SER 6 Cb -0.26 0.70 0.00 0.00 0.21 0.00 0.00 66.02 66.67 2dly s SER 6 CO -0.00 -1.33 0.00 0.61 0.41 0.00 0.00 173.24 172.93 2dly n GLY 7 N -0.45 -0.73 3.62 3.44 0.00 -1.26 -5.15 105.19 104.65 2dly n GLY 7 Ca -0.04 -0.68 -0.09 0.00 0.00 0.00 0.00 46.02 45.21 2dly n GLY 7 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dly s ALA 8 N 0.00 -1.97 0.14 4.61 0.00 -1.26 -5.06 121.76 118.22 2dly s ALA 8 Ca 0.00 1.76 -0.26 0.00 0.00 0.00 0.00 51.96 53.46 2dly s ALA 8 Cb 0.00 -1.19 -0.02 0.00 0.00 0.00 0.00 23.12 21.92 2dly s ALA 8 CO 0.00 -0.26 1.60 0.93 0.00 0.00 0.00 175.76 178.03 2dly h GLU 9 N 3.54 -0.38 -5.80 0.00 5.08 -2.09 -3.36 114.58 111.57 2dly h GLU 9 Ca -0.24 0.03 -0.49 0.00 -1.00 0.00 0.00 59.36 57.66 2dly h GLU 9 Cb 1.17 0.09 -0.01 0.00 0.50 0.00 0.00 28.75 30.50 2dly h GLU 9 CO 0.19 -0.26 1.51 0.34 -1.00 0.00 0.00 179.01 179.79 2dly s ASP 10 N -4.94 4.85 0.12 1.42 2.15 -1.26 -4.64 116.67 114.37 2dly s ASP 10 Ca -0.15 0.82 0.00 0.00 0.43 0.00 0.00 52.55 53.65 2dly s ASP 10 Cb 0.11 -2.51 0.00 0.00 -0.30 0.00 0.00 42.92 40.21 2dly s ASP 10 CO 0.66 -2.61 0.00 0.54 -0.17 0.00 0.00 175.17 173.59 2dly n ARG 11 N 9.05 0.00 0.30 4.34 1.74 -1.26 -4.79 116.66 126.04 2dly n ARG 11 Ca 0.29 0.00 0.15 0.00 -0.77 0.00 0.00 57.85 57.53 2dly n ARG 11 Cb 0.53 -0.24 0.91 0.00 -1.02 0.00 0.00 32.46 32.64 2dly n ARG 11 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 2dly h SER 12 N 0.00 0.00 -0.69 0.55 4.64 -1.95 -2.17 113.55 113.94 2dly h SER 12 Ca 0.00 0.00 0.20 0.00 -0.47 0.00 0.00 61.79 61.52 2dly h SER 12 Cb 0.00 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.06 2dly h SER 12 CO 0.00 0.02 0.69 0.25 -0.87 0.00 0.00 176.83 176.92 2dly h LEU 13 N 0.00 0.00 -1.68 5.97 6.46 -1.92 0.34 115.31 124.48 2dly h LEU 13 Ca -0.00 0.00 0.08 0.00 -0.12 0.00 0.00 57.88 57.84 2dly h LEU 13 Cb 0.06 0.00 -0.03 0.00 -0.73 0.00 0.00 40.66 39.96 2dly h LEU 13 CO 0.00 0.00 0.36 1.56 -0.62 0.00 0.00 178.44 179.74 2dly h GLN 14 N 0.00 0.36 -0.13 1.25 4.20 -1.74 -0.15 115.11 118.90 2dly h GLN 14 Ca 0.33 -0.02 -0.01 0.00 0.06 0.00 0.00 58.65 59.01 2dly h GLN 14 Cb 1.69 -0.08 -0.01 0.00 0.30 0.00 0.00 27.48 29.39 2dly h GLN 14 CO -0.00 0.24 0.05 0.00 -0.67 0.00 0.00 178.83 178.44 2dly h ALA 15 N 1.72 1.84 -1.78 3.87 0.00 -0.55 -3.44 119.26 120.93 2dly h ALA 15 Ca 0.24 -0.04 -0.66 0.00 0.00 0.00 0.00 54.91 54.45 2dly h ALA 15 Cb 0.47 -0.06 0.06 0.00 0.00 0.00 0.00 17.79 18.27 2dly h ALA 15 CO -0.06 0.13 0.44 0.39 0.00 0.00 0.00 179.25 180.16 2dly n GLU 16 N -4.48 1.28 -0.06 0.00 -0.58 -0.07 -4.89 120.64 111.84 2dly n GLU 16 Ca -0.01 0.46 -0.13 0.00 -0.42 0.00 0.00 57.16 57.06 2dly n GLU 16 Cb 0.11 -2.08 -0.06 0.00 -0.57 0.00 0.00 31.44 28.84 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 4.37 0.43 0.00 3.49 0.13 -1.88 -2.93 132.00 135.62 2dly h PRO 17 Ca -0.46 -0.23 0.00 0.00 -0.87 0.00 0.00 66.00 64.44 2dly h PRO 17 Cb 1.33 0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.47 2dly h PRO 17 CO 0.77 0.79 0.00 -2.67 -0.23 0.00 0.00 178.00 176.66 2dly n TRP 18 N -4.50 0.01 -3.19 1.56 4.27 -1.26 -4.58 117.44 109.76 2dly n TRP 18 Ca -0.06 0.01 -0.41 0.00 -3.89 0.00 0.00 57.50 53.15 2dly n TRP 18 Cb 0.38 -0.51 -0.07 0.00 -1.36 0.00 0.00 31.31 29.75 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 -3.01 3.18 -0.40 -2.67 5.36 -1.11 0.50 117.98 119.84 2dly s PHE 19 Ca 0.07 0.31 0.05 0.00 -0.96 0.00 0.00 56.93 56.40 2dly s PHE 19 Cb 0.09 -2.98 0.45 0.00 -0.34 0.00 0.00 43.02 40.25 2dly s PHE 19 CO 0.27 -0.54 1.39 1.19 -1.46 0.00 0.00 175.22 176.07 2dly n PHE 20 N 5.83 2.91 0.00 10.12 3.01 -0.88 -4.82 117.46 133.64 2dly n PHE 20 Ca -0.03 -2.47 0.00 0.00 1.01 0.00 0.00 57.45 55.96 2dly n PHE 20 Cb 0.49 -0.59 0.00 0.00 -0.01 0.00 0.00 39.48 39.37 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 -0.74 2.77 3.10 1.37 0.00 -1.26 -3.79 105.19 106.64 2dly n GLY 21 Ca 0.48 0.28 -0.34 0.00 0.00 0.00 0.00 46.02 46.45 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 -1.00 2.91 0.18 4.61 0.00 -1.26 0.28 121.76 127.48 2dly s ALA 22 Ca 0.00 -2.21 0.04 0.00 0.00 0.00 0.00 51.96 49.79 2dly s ALA 22 Cb 0.00 -2.04 -0.05 0.00 0.00 0.00 0.00 23.12 21.03 2dly s ALA 22 CO 0.00 -1.54 -0.05 0.96 0.00 0.00 0.00 175.76 175.13 2dly s ILE 23 N 1.10 1.04 0.41 0.00 -4.36 -1.25 -4.90 121.20 113.24 2dly s ILE 23 Ca 0.03 -2.04 -0.01 0.00 -0.26 0.00 0.00 60.65 58.37 2dly s ILE 23 Cb -0.20 -2.05 -0.02 0.00 1.25 0.00 0.00 42.46 41.43 2dly s ILE 23 CO -0.04 -0.57 0.63 -0.54 0.24 0.00 0.00 174.94 174.66 2dly s LYS 24 N -3.81 3.35 0.44 0.37 1.02 -1.26 -4.67 119.74 115.18 2dly s LYS 24 Ca 0.22 -0.29 0.22 0.00 0.02 0.00 0.00 55.97 56.14 2dly s LYS 24 Cb 0.04 -2.58 1.20 0.00 -0.52 0.00 0.00 37.83 35.98 2dly s LYS 24 CO 0.04 -0.06 1.81 0.07 -0.92 0.00 0.00 175.35 176.29 2dly h ARG 25 N 0.54 0.29 -0.15 1.68 0.11 -1.98 0.50 114.38 115.37 2dly h ARG 25 Ca -0.48 -0.02 -0.01 0.00 0.10 0.00 0.00 59.98 59.57 2dly h ARG 25 Cb 1.23 -0.07 -0.01 0.00 1.11 0.00 0.00 29.97 32.24 2dly h ARG 25 CO 0.60 0.19 0.06 0.00 0.10 0.00 0.00 179.97 180.92 2dly h ALA 26 N 1.58 0.20 -0.50 0.08 0.00 -1.98 0.42 119.26 119.05 2dly h ALA 26 Ca 0.54 -0.11 -0.07 0.00 0.00 0.00 0.00 54.91 55.26 2dly h ALA 26 Cb 1.54 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 19.25 2dly h ALA 26 CO -0.19 -0.21 0.02 -0.44 0.00 0.00 0.00 179.25 178.43 2dly h ASP 27 N 0.08 0.79 -0.06 0.00 5.19 -1.33 -2.00 116.42 119.08 2dly h ASP 27 Ca 0.05 -0.19 -0.21 0.00 -0.62 0.00 0.00 57.03 56.06 2dly h ASP 27 Cb 0.19 -0.21 0.01 0.00 0.18 0.00 0.00 39.33 39.50 2dly h ASP 27 CO -0.00 0.85 -0.76 0.00 -3.12 0.00 0.00 179.24 176.20 2dly h ALA 28 N 1.24 0.38 0.28 3.45 0.00 -1.02 -3.14 119.26 120.45 2dly h ALA 28 Ca 0.15 -0.60 -0.01 0.00 0.00 0.00 0.00 54.91 54.45 2dly h ALA 28 Cb 0.44 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.21 2dly h ALA 28 CO 0.02 0.70 -0.13 0.93 0.00 0.00 0.00 179.25 180.77 2dly h GLU 29 N 0.49 -0.36 -1.55 0.00 5.08 0.02 -1.72 114.58 116.53 2dly h GLU 29 Ca -0.05 0.02 0.47 0.00 -1.00 0.00 0.00 59.36 58.81 2dly h GLU 29 Cb 1.38 0.08 -0.10 0.00 0.50 0.00 0.00 28.75 30.62 2dly h GLU 29 CO 0.15 -0.24 1.07 0.87 -1.00 0.00 0.00 179.01 179.87 2dly h LYS 30 N -0.42 0.04 -0.10 2.33 1.57 -1.51 1.67 116.57 120.16 2dly h LYS 30 Ca -0.04 -0.00 -0.20 0.00 -1.87 0.00 0.00 60.65 58.54 2dly h LYS 30 Cb 0.29 -0.01 -0.00 0.00 0.08 0.00 0.00 32.23 32.59 2dly h LYS 30 CO 0.06 0.03 -0.75 1.96 -0.57 0.00 0.00 179.45 180.18 2dly h GLN 31 N 0.04 0.52 0.03 3.15 1.08 -1.46 -2.91 115.11 115.56 2dly h GLN 31 Ca 0.83 -0.42 -0.14 0.00 -1.45 0.00 0.00 58.65 57.47 2dly h GLN 31 Cb 2.99 0.09 0.01 0.00 -0.05 0.00 0.00 27.48 30.52 2dly h GLN 31 CO -0.20 1.05 -0.55 -0.07 -0.95 0.00 0.00 178.83 178.12 2dly h LEU 32 N 0.35 0.44 -0.35 1.46 3.38 0.32 -3.15 115.31 117.76 2dly h LEU 32 Ca -0.04 -0.81 0.00 0.00 0.09 0.00 0.00 57.88 57.13 2dly h LEU 32 Cb 1.34 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.95 2dly h LEU 32 CO 0.14 1.19 0.00 0.18 0.09 0.00 0.00 178.44 180.04 2dly n LEU 33 N -4.27 0.18 -4.05 1.67 7.99 0.66 -4.60 117.00 114.58 2dly n LEU 33 Ca -0.11 0.57 -0.36 0.00 -0.01 0.00 0.00 56.01 56.10 2dly n LEU 33 Cb 0.66 -0.57 0.04 0.00 -0.11 0.00 0.00 43.42 43.44 2dly n LEU 33 CO 0.45 -0.53 -1.18 0.00 -1.51 0.00 0.00 177.39 174.62 2dly n TYR 34 N -1.73 -4.74 0.16 -1.77 9.36 -1.10 -4.92 117.16 112.42 2dly n TYR 34 Ca 0.01 0.02 -0.08 0.00 3.32 0.00 0.00 57.90 61.17 2dly n TYR 34 Cb 0.07 -1.48 -0.04 0.00 -0.63 0.00 0.00 39.34 37.26 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 -0.96 -0.41 -1.01 2.98 0.87 -1.90 -3.27 113.55 109.85 2dly h SER 35 Ca -0.44 -0.02 0.24 0.00 -1.23 0.00 0.00 61.79 60.34 2dly h SER 35 Cb 1.31 0.11 -0.10 0.00 -0.44 0.00 0.00 62.40 63.28 2dly h SER 35 CO 0.25 0.04 0.64 -0.33 -0.53 0.00 0.00 176.83 176.91 2dly h GLU 36 N -1.11 0.47 -6.90 2.24 4.39 -1.96 -3.40 114.58 108.31 2dly h GLU 36 Ca -0.05 -0.03 -0.46 0.00 0.34 0.00 0.00 59.36 59.16 2dly h GLU 36 Cb 0.40 -0.11 -0.02 0.00 -0.10 0.00 0.00 28.75 28.93 2dly h GLU 36 CO 0.08 0.31 0.32 -0.80 -1.16 0.00 0.00 179.01 177.76 2dly s ASN 37 N -5.34 7.18 0.26 1.42 0.01 -1.23 -5.07 114.94 112.18 2dly s ASN 37 Ca -0.09 1.74 0.03 0.00 -0.71 0.00 0.00 52.86 53.82 2dly s ASN 37 Cb 0.25 -2.55 -0.01 0.00 0.41 0.00 0.00 41.25 39.35 2dly s ASN 37 CO 0.80 -0.15 0.29 0.00 -1.51 0.00 0.00 177.10 176.53 2dly n GLN 38 N 0.19 0.42 -1.44 -0.60 10.64 -1.26 -4.67 117.38 120.65 2dly n GLN 38 Ca 0.03 -2.41 -0.61 0.00 -1.83 0.00 0.00 57.00 52.18 2dly n GLN 38 Cb 0.51 2.12 -0.10 0.00 -0.86 0.00 0.00 30.24 31.91 2dly n GLN 38 CO 0.00 0.00 0.00 2.41 -1.83 0.00 0.00 177.06 177.64 2dly n THR 39 N -0.47 0.00 0.00 -0.39 -1.04 -1.26 -1.22 114.28 109.89 2dly n THR 39 Ca 0.04 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.05 2dly n THR 39 Cb 0.46 -0.47 0.00 0.00 -1.82 0.00 0.00 70.33 68.50 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 5.32 2.12 3.41 3.41 0.00 0.81 -4.93 105.19 115.32 2dly n GLY 40 Ca 0.40 -0.51 -0.54 0.00 0.00 0.00 0.00 46.02 45.36 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 0.70 -2.57 4.61 0.00 -0.36 -3.69 120.51 119.20 2dly n ALA 41 Ca 0.00 0.06 -0.25 0.00 0.00 0.00 0.00 53.44 53.25 2dly n ALA 41 Cb 0.00 -2.37 -0.09 0.00 0.00 0.00 0.00 19.45 16.99 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 6.57 2.58 -0.29 0.00 -0.71 -0.98 -1.07 117.98 124.07 2dly s PHE 42 Ca 1.12 -0.25 -0.17 0.00 -1.04 0.00 0.00 56.93 56.59 2dly s PHE 42 Cb -1.08 -1.21 0.13 0.00 -1.21 0.00 0.00 43.02 39.65 2dly s PHE 42 CO 0.56 0.57 0.91 -0.48 -1.34 0.00 0.00 175.22 175.43 2dly s LEU 43 N -3.14 -0.61 0.08 -1.99 0.05 -0.36 -0.66 118.68 112.06 2dly s LEU 43 Ca 0.27 1.00 -0.00 0.00 0.05 0.00 0.00 54.13 55.45 2dly s LEU 43 Cb -0.08 1.92 -0.04 0.00 -2.05 0.00 0.00 46.19 45.95 2dly s LEU 43 CO 0.16 -0.16 0.24 -0.63 -0.55 0.00 0.00 176.35 175.41 2dly s ILE 44 N 1.29 5.35 0.06 1.48 1.09 0.18 -0.80 121.20 129.86 2dly s ILE 44 Ca -0.08 -0.37 -0.08 0.00 -1.10 0.00 0.00 60.65 59.02 2dly s ILE 44 Cb -0.04 -3.64 -0.00 0.00 -1.06 0.00 0.00 42.46 37.71 2dly s ILE 44 CO -0.15 0.09 0.16 0.00 -0.10 0.00 0.00 174.94 174.94 2dly s ARG 45 N -2.63 0.75 0.20 2.79 1.70 -0.78 -2.06 118.95 118.92 2dly s ARG 45 Ca 0.36 -0.86 -0.30 0.00 -0.47 0.00 0.00 55.73 54.46 2dly s ARG 45 Cb -0.13 0.30 -0.08 0.00 -0.57 0.00 0.00 34.95 34.47 2dly s ARG 45 CO 0.28 -0.22 1.00 -1.21 -1.08 0.00 0.00 175.30 174.07 2dly s GLU 46 N -3.34 4.73 -0.42 3.89 2.02 0.14 -0.61 118.70 125.13 2dly s GLU 46 Ca 0.01 1.57 -0.28 0.00 0.02 0.00 0.00 54.97 56.29 2dly s GLU 46 Cb 0.03 -3.29 -0.02 0.00 0.10 0.00 0.00 34.13 30.95 2dly s GLU 46 CO -0.08 0.30 1.80 0.45 0.02 0.00 0.00 175.26 177.75 2dly s SER 47 N -0.61 5.73 0.26 -0.19 0.15 0.43 -4.15 113.70 115.31 2dly s SER 47 Ca 0.45 1.00 -0.03 0.00 0.70 0.00 0.00 55.95 58.07 2dly s SER 47 Cb -0.27 -2.53 0.40 0.00 -1.71 0.00 0.00 66.02 61.91 2dly s SER 47 CO 0.33 -1.89 1.87 -0.08 1.20 0.00 0.00 173.24 174.67 2dly h GLU 48 N 13.40 1.07 0.81 5.44 4.57 -1.90 -2.97 114.58 135.00 2dly h GLU 48 Ca -0.31 -0.06 -0.04 0.00 -1.18 0.00 0.00 59.36 57.77 2dly h GLU 48 Cb 1.16 -0.24 0.01 0.00 -0.16 0.00 0.00 28.75 29.52 2dly h GLU 48 CO 1.09 0.71 -0.41 1.03 -1.18 0.00 0.00 179.01 180.25 2dly h SER 49 N 1.11 -0.99 -3.54 1.04 0.87 -1.99 -3.41 113.55 106.64 2dly h SER 49 Ca 0.42 0.04 -0.67 0.00 -1.23 0.00 0.00 61.79 60.35 2dly h SER 49 Cb 0.20 0.26 -0.36 0.00 -0.44 0.00 0.00 62.40 62.07 2dly h SER 49 CO -0.18 -0.68 -0.82 -1.58 -0.53 0.00 0.00 176.83 173.04 2dly s GLN 50 N -5.48 2.57 0.82 2.24 2.00 -1.12 -5.11 119.66 115.57 2dly s GLN 50 Ca -0.17 -1.13 -0.13 0.00 -2.00 0.00 0.00 55.36 51.93 2dly s GLN 50 Cb 0.02 -2.79 0.08 0.00 0.80 0.00 0.00 33.01 31.12 2dly s GLN 50 CO 0.50 -0.43 1.12 1.63 -0.50 0.00 0.00 175.29 177.62 2dly n LYS 51 N 4.52 0.12 0.00 1.67 5.02 -1.22 -3.04 118.16 125.23 2dly n LYS 51 Ca -0.17 0.11 0.00 0.00 -2.02 0.00 0.00 58.31 56.24 2dly n LYS 51 Cb 0.45 -2.37 0.00 0.00 -0.02 0.00 0.00 35.03 33.09 2dly n LYS 51 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2dly n GLY 52 N 0.64 2.54 3.90 0.72 0.00 -1.26 -4.99 105.19 106.73 2dly n GLY 52 Ca 0.13 -0.29 -0.28 0.00 0.00 0.00 0.00 46.02 45.58 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 0.29 5.84 0.13 1.61 2.15 -1.17 -4.95 116.67 120.58 2dly s ASP 53 Ca 0.00 0.97 -0.00 0.00 0.43 0.00 0.00 52.55 53.95 2dly s ASP 53 Cb 0.00 -2.02 -0.04 0.00 -0.30 0.00 0.00 42.92 40.56 2dly s ASP 53 CO 0.00 -0.96 0.03 -0.36 -0.17 0.00 0.00 175.17 173.71 2dly s PHE 54 N -3.03 0.91 -0.04 -5.34 0.40 -1.24 -0.43 117.98 109.21 2dly s PHE 54 Ca 0.53 -1.16 0.01 0.00 -0.60 0.00 0.00 56.93 55.71 2dly s PHE 54 Cb -0.11 -0.52 0.02 0.00 0.51 0.00 0.00 43.02 42.92 2dly s PHE 54 CO 0.48 -0.43 -0.04 0.45 0.70 0.00 0.00 175.22 176.38 2dly s SER 55 N -3.07 0.87 -0.28 1.36 0.15 0.22 0.00 113.70 112.96 2dly s SER 55 Ca 0.22 -0.12 -0.18 0.00 0.70 0.00 0.00 55.95 56.58 2dly s SER 55 Cb 0.07 -0.42 -0.02 0.00 -1.71 0.00 0.00 66.02 63.94 2dly s SER 55 CO 0.01 -0.05 0.50 -0.22 1.20 0.00 0.00 173.24 174.68 2dly s LEU 56 N 0.85 4.12 -0.38 3.45 2.96 0.50 -1.86 118.68 128.32 2dly s LEU 56 Ca -0.11 0.35 -0.08 0.00 -0.22 0.00 0.00 54.13 54.07 2dly s LEU 56 Cb -0.14 -2.61 0.06 0.00 0.50 0.00 0.00 46.19 44.00 2dly s LEU 56 CO 0.00 -0.32 0.19 -0.44 -1.32 0.00 0.00 176.35 174.46 2dly s SER 57 N 1.62 5.51 -0.07 3.68 0.01 0.02 -0.59 113.70 123.88 2dly s SER 57 Ca 0.20 -1.32 0.02 0.00 1.31 0.00 0.00 55.95 56.16 2dly s SER 57 Cb -0.16 -1.94 -0.02 0.00 0.21 0.00 0.00 66.02 64.11 2dly s SER 57 CO 0.10 -0.44 -0.13 -0.69 0.41 0.00 0.00 173.24 172.50 2dly s VAL 58 N 1.42 3.18 -0.06 3.43 1.01 -1.14 -1.22 120.40 127.03 2dly s VAL 58 Ca 0.01 -0.66 -0.19 0.00 0.00 0.00 0.00 61.98 61.14 2dly s VAL 58 Cb -0.21 -2.28 -0.05 0.00 0.00 0.00 0.00 36.38 33.84 2dly s VAL 58 CO 0.03 0.58 0.52 -0.22 0.00 0.00 0.00 175.10 176.00 2dly s LEU 59 N -0.50 4.36 -0.48 3.92 2.96 -0.24 -1.34 118.68 127.36 2dly s LEU 59 Ca 0.07 0.98 0.04 0.00 -0.22 0.00 0.00 54.13 55.00 2dly s LEU 59 Cb -0.12 -2.77 0.17 0.00 0.50 0.00 0.00 46.19 43.97 2dly s LEU 59 CO 0.02 0.09 0.37 -0.62 -1.32 0.00 0.00 176.35 174.89 2dly s ASP 60 N 0.06 2.33 -0.51 3.68 2.15 0.11 -0.14 116.67 124.36 2dly s ASP 60 Ca 0.28 -3.24 -0.03 0.00 0.43 0.00 0.00 52.55 49.99 2dly s ASP 60 Cb -0.17 -0.74 0.00 0.00 -0.30 0.00 0.00 42.92 41.72 2dly s ASP 60 CO 0.14 -0.15 0.45 -0.62 -0.17 0.00 0.00 175.17 174.81 2dly n GLU 61 N 2.66 -3.00 0.00 4.34 1.02 -1.26 -3.05 120.64 121.35 2dly n GLU 61 Ca 0.27 0.31 0.00 0.00 -0.02 0.00 0.00 57.16 57.72 2dly n GLU 61 Cb 0.44 -3.78 0.00 0.00 -0.02 0.00 0.00 31.44 28.08 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 -1.07 1.41 3.83 0.62 0.00 -1.26 -5.04 105.19 103.68 2dly n GLY 62 Ca 0.00 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.64 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 -2.37 4.97 -0.38 1.61 0.11 -1.17 -4.85 120.40 118.32 2dly s VAL 63 Ca 0.00 0.89 -0.08 0.00 -2.93 0.00 0.00 61.98 59.86 2dly s VAL 63 Cb 0.00 -3.74 0.06 0.00 -1.53 0.00 0.00 36.38 31.17 2dly s VAL 63 CO 0.00 0.55 0.19 -0.69 -3.33 0.00 0.00 175.10 171.82 2dly s VAL 64 N -1.11 4.01 -0.48 2.04 1.01 -1.26 0.07 120.40 124.68 2dly s VAL 64 Ca 0.26 -1.31 -0.21 0.00 0.00 0.00 0.00 61.98 60.71 2dly s VAL 64 Cb -0.17 -3.39 0.04 0.00 0.00 0.00 0.00 36.38 32.85 2dly s VAL 64 CO 0.15 -0.38 0.72 -0.54 0.00 0.00 0.00 175.10 175.05 2dly s LYS 65 N 1.40 3.27 -0.43 2.72 3.01 -0.45 -4.93 119.74 124.34 2dly s LYS 65 Ca 0.02 -0.43 -0.26 0.00 -1.01 0.00 0.00 55.97 54.28 2dly s LYS 65 Cb -0.21 -4.00 0.02 0.00 -1.01 0.00 0.00 37.83 32.63 2dly s LYS 65 CO 0.02 -1.17 0.97 -1.01 0.51 0.00 0.00 175.35 174.67 2dly s HIS 66 N 3.06 2.96 -0.36 3.18 3.76 -1.26 -2.86 115.29 123.77 2dly s HIS 66 Ca 0.23 0.59 -0.09 0.00 -0.15 0.00 0.00 55.06 55.65 2dly s HIS 66 Cb -0.15 -3.94 0.04 0.00 1.11 0.00 0.00 32.58 29.64 2dly s HIS 66 CO 0.18 -1.03 0.16 0.71 -0.85 0.00 0.00 174.74 173.90 2dly s TYR 67 N 3.78 3.25 -0.31 1.40 2.02 0.24 -4.94 117.35 122.79 2dly s TYR 67 Ca 0.39 -1.23 -0.28 0.00 -0.37 0.00 0.00 57.07 55.59 2dly s TYR 67 Cb -0.10 -2.37 -0.04 0.00 -0.40 0.00 0.00 41.96 39.04 2dly s TYR 67 CO 0.24 -0.70 2.13 1.03 -1.57 0.00 0.00 175.55 176.69 2dly s ARG 68 N 1.47 2.97 -0.71 -0.62 3.00 -1.26 -0.37 118.95 123.43 2dly s ARG 68 Ca 0.00 1.70 -0.26 0.00 0.00 0.00 0.00 55.73 57.17 2dly s ARG 68 Cb -0.19 -4.37 -0.00 0.00 0.00 0.00 0.00 34.95 30.38 2dly s ARG 68 CO 0.05 -2.29 1.64 0.42 0.00 0.00 0.00 175.30 175.11 2dly s ILE 69 N 8.71 3.53 0.59 1.52 1.01 0.10 -4.84 121.20 131.82 2dly s ILE 69 Ca 0.93 0.17 -0.16 0.00 0.00 0.00 0.00 60.65 61.59 2dly s ILE 69 Cb -0.27 -4.36 -0.04 0.00 0.01 0.00 0.00 42.46 37.81 2dly s ILE 69 CO 0.32 -1.31 1.07 -0.13 0.00 0.00 0.00 174.94 174.89 2dly s ARG 70 N 6.45 3.28 0.06 2.79 1.81 -0.79 -3.64 118.95 128.91 2dly s ARG 70 Ca 0.55 1.27 0.05 0.00 -1.72 0.00 0.00 55.73 55.88 2dly s ARG 70 Cb -0.10 -2.02 -0.03 0.00 -0.45 0.00 0.00 34.95 32.35 2dly s ARG 70 CO 0.15 -0.85 -0.15 1.03 -0.68 0.00 0.00 175.30 174.80 2dly s ARG 71 N -3.96 0.92 0.63 3.54 0.52 -1.26 -0.05 118.95 119.28 2dly s ARG 71 Ca 0.65 -0.88 0.07 0.00 -0.52 0.00 0.00 55.73 55.05 2dly s ARG 71 Cb -0.17 -0.95 0.11 0.00 0.52 0.00 0.00 34.95 34.45 2dly s ARG 71 CO 0.36 0.22 0.87 -0.51 0.02 0.00 0.00 175.30 176.26 2dly s LEU 72 N -1.46 3.02 0.00 2.53 2.01 -0.79 -4.99 118.68 119.00 2dly s LEU 72 Ca 0.01 -0.78 0.16 0.00 0.01 0.00 0.00 54.13 53.53 2dly s LEU 72 Cb -0.09 -1.60 0.06 0.00 0.01 0.00 0.00 46.19 44.57 2dly s LEU 72 CO 0.02 -1.55 0.92 -0.67 1.01 0.00 0.00 176.35 176.07 2dly n ASP 73 N -2.45 1.94 0.00 2.29 2.03 -1.26 -4.53 116.55 114.58 2dly n ASP 73 Ca 0.16 -1.47 0.00 0.00 0.52 0.00 0.00 54.79 54.00 2dly n ASP 73 Cb 0.62 0.25 0.00 0.00 -0.72 0.00 0.00 41.12 41.26 2dly n ASP 73 CO 0.00 0.00 0.00 -1.84 -1.92 0.00 0.00 177.20 173.44 2dly n GLU 74 N 0.36 2.44 0.00 -0.67 0.28 -1.26 -5.06 120.64 116.73 2dly n GLU 74 Ca 0.08 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.08 2dly n GLU 74 Cb 0.36 -0.84 0.00 0.00 1.43 0.00 0.00 31.44 32.39 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 2.03 0.66 0.00 -1.84 0.00 -1.26 -5.15 105.19 99.63 2dly n GLY 75 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 5.00 1.15 3.50 -0.02 0.00 -1.18 -4.85 105.19 108.79 2dly n GLY 76 Ca 0.00 -0.04 -0.25 0.00 0.00 0.00 0.00 46.02 45.73 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 0.90 2.42 -0.28 1.61 0.40 -1.22 -1.89 117.98 119.92 2dly s PHE 77 Ca 0.00 -0.30 -0.16 0.00 -0.60 0.00 0.00 56.93 55.87 2dly s PHE 77 Cb 0.00 -1.13 0.10 0.00 0.51 0.00 0.00 43.02 42.49 2dly s PHE 77 CO 0.00 0.59 0.75 -0.59 0.70 0.00 0.00 175.22 176.66 2dly s PHE 78 N -2.02 -0.98 -0.24 0.36 -0.12 0.93 -1.17 117.98 114.75 2dly s PHE 78 Ca 0.26 1.94 0.21 0.00 -0.05 0.00 0.00 56.93 59.28 2dly s PHE 78 Cb -0.07 0.59 0.04 0.00 -0.63 0.00 0.00 43.02 42.94 2dly s PHE 78 CO 0.14 -0.49 1.14 1.25 -0.05 0.00 0.00 175.22 177.21 2dly h LEU 79 N 6.88 0.00 -7.60 -1.99 5.85 -1.82 -2.11 115.31 114.52 2dly h LEU 79 Ca -0.29 0.00 -0.13 0.00 0.84 0.00 0.00 57.88 58.30 2dly h LEU 79 Cb 1.21 0.00 -0.20 0.00 0.37 0.00 0.00 40.66 42.04 2dly h LEU 79 CO 0.16 0.17 -0.36 0.28 -0.34 0.00 0.00 178.44 178.36 2dly s THR 80 N -3.20 0.07 -1.52 1.05 -1.32 -1.26 -4.86 115.64 104.59 2dly s THR 80 Ca 0.01 -0.56 0.10 0.00 -1.21 0.00 0.00 61.69 60.03 2dly s THR 80 Cb 0.08 -0.54 0.19 0.00 -1.51 0.00 0.00 72.50 70.72 2dly s THR 80 CO 0.77 -0.31 1.18 0.54 -2.21 0.00 0.00 174.62 174.59 2dly n ARG 81 N 1.35 0.17 -0.48 7.08 5.12 -1.26 -1.39 116.66 127.24 2dly n ARG 81 Ca -0.22 0.16 0.10 0.00 -1.93 0.00 0.00 57.85 55.96 2dly n ARG 81 Cb 0.56 -1.50 0.33 0.00 -1.16 0.00 0.00 32.46 30.69 2dly n ARG 81 CO 0.00 0.00 0.00 2.89 -1.93 0.00 0.00 177.63 178.59 2dly n ARG 82 N -1.24 3.16 -3.53 5.56 1.85 -1.26 -4.94 116.66 116.25 2dly n ARG 82 Ca 0.05 -2.67 -0.10 0.00 -1.00 0.00 0.00 57.85 54.14 2dly n ARG 82 Cb 0.07 -1.72 -0.03 0.00 -1.05 0.00 0.00 32.46 29.73 2dly n ARG 82 CO 0.00 0.00 0.00 0.21 -0.01 0.00 0.00 177.63 177.83 2dly s LYS 83 N -1.45 0.74 -0.16 2.89 2.47 -0.49 -5.17 119.74 118.56 2dly s LYS 83 Ca 0.49 -0.09 -0.25 0.00 -1.56 0.00 0.00 55.97 54.56 2dly s LYS 83 Cb 0.28 0.34 0.06 0.00 -1.46 0.00 0.00 37.83 37.06 2dly s LYS 83 CO 0.28 -0.28 0.64 0.08 0.16 0.00 0.00 175.35 176.22 2dly s VAL 84 N -2.20 0.00 0.24 4.02 1.01 -1.26 -4.32 120.40 117.90 2dly s VAL 84 Ca 0.01 -0.03 0.01 0.00 0.00 0.00 0.00 61.98 61.97 2dly s VAL 84 Cb -0.01 -0.92 -0.00 0.00 0.00 0.00 0.00 36.38 35.45 2dly s VAL 84 CO -0.04 -0.02 0.03 0.49 0.00 0.00 0.00 175.10 175.57 2dly n PHE 85 N 2.03 0.39 -0.08 5.22 3.72 -0.31 -5.03 117.46 123.41 2dly n PHE 85 Ca -0.16 -1.32 -0.10 0.00 -0.05 0.00 0.00 57.45 55.82 2dly n PHE 85 Cb 0.56 -0.11 -0.07 0.00 -0.94 0.00 0.00 39.48 38.92 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 -1.41 2.77 -4.07 4.37 7.64 -1.26 -3.09 113.62 118.57 2dly n SER 86 Ca -0.08 -0.08 -0.10 0.00 1.01 0.00 0.00 58.87 59.63 2dly n SER 86 Cb 0.33 -0.18 -0.11 0.00 -1.01 0.00 0.00 64.21 63.24 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 -2.30 0.39 0.58 0.44 -4.23 -1.26 -4.43 115.64 104.83 2dly s THR 87 Ca -0.20 -1.42 0.31 0.00 -1.18 0.00 0.00 61.69 59.20 2dly s THR 87 Cb 0.05 -1.00 0.43 0.00 1.34 0.00 0.00 72.50 73.32 2dly s THR 87 CO 0.36 -0.68 1.76 -0.07 -0.54 0.00 0.00 174.62 175.45 2dly h LEU 88 N 3.84 0.00 0.58 4.79 3.38 -1.97 -1.44 115.31 124.49 2dly h LEU 88 Ca -0.34 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.60 2dly h LEU 88 Cb 1.18 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.94 2dly h LEU 88 CO 0.53 0.00 -0.28 -1.13 0.09 0.00 0.00 178.44 177.65 2dly h ASN 89 N 0.00 -0.66 0.11 -0.43 -0.73 -2.00 -2.69 115.58 109.18 2dly h ASN 89 Ca 0.36 0.02 0.00 0.00 1.87 0.00 0.00 56.30 58.55 2dly h ASN 89 Cb 1.80 0.17 0.00 0.00 0.27 0.00 0.00 38.32 40.56 2dly h ASN 89 CO -0.00 -0.40 0.00 -0.62 -0.37 0.00 0.00 177.43 176.04 2dly n GLU 90 N -4.50 0.00 0.07 6.67 1.02 -0.61 -1.26 120.64 122.04 2dly n GLU 90 Ca -0.10 0.45 -0.11 0.00 -0.02 0.00 0.00 57.16 57.39 2dly n GLU 90 Cb 0.31 -1.51 -0.13 0.00 -0.02 0.00 0.00 31.44 30.09 2dly n GLU 90 CO 0.00 0.00 0.00 0.35 1.18 0.00 0.00 177.13 178.66 2dly h PHE 91 N 0.00 0.20 0.04 -0.32 3.04 -1.07 -3.21 116.94 115.63 2dly h PHE 91 Ca 0.00 -0.15 -0.34 0.00 3.98 0.00 0.00 57.97 61.47 2dly h PHE 91 Cb 0.05 -0.01 -0.05 0.00 2.56 0.00 0.00 35.95 38.51 2dly h PHE 91 CO 0.00 1.12 -1.97 0.28 -2.02 0.00 0.00 178.31 175.72 2dly n VAL 92 N -3.41 1.62 0.31 1.41 0.31 -0.39 -3.79 118.33 114.39 2dly n VAL 92 Ca -0.04 -0.74 0.13 0.00 -0.01 0.00 0.00 64.34 63.67 2dly n VAL 92 Cb 0.98 -1.19 0.57 0.00 -0.91 0.00 0.00 33.84 33.29 2dly n VAL 92 CO 0.00 0.00 0.00 -0.55 -1.32 0.00 0.00 176.83 174.96 2dly h ASN 93 N 0.02 0.00 0.01 4.52 7.08 -1.43 -1.44 115.58 124.34 2dly h ASN 93 Ca -0.40 0.00 -0.20 0.00 -3.08 0.00 0.00 56.30 52.63 2dly h ASN 93 Cb 2.05 0.00 -0.03 0.00 -2.08 0.00 0.00 38.32 38.26 2dly h ASN 93 CO 0.06 0.00 -1.06 0.22 -2.08 0.00 0.00 177.43 174.57 2dly h TYR 94 N 0.00 0.05 0.00 4.14 5.03 -1.69 -3.35 116.97 121.16 2dly h TYR 94 Ca 0.00 -0.04 0.00 0.00 2.58 0.00 0.00 58.73 61.27 2dly h TYR 94 Cb 0.25 -0.00 0.00 0.00 1.55 0.00 0.00 36.73 38.52 2dly h TYR 94 CO 0.00 1.42 0.00 0.66 -1.32 0.00 0.00 178.16 178.92 2dly n TYR 95 N -4.40 0.00 0.40 -3.82 4.01 -1.13 -2.78 117.16 109.45 2dly n TYR 95 Ca -0.27 0.00 0.13 0.00 -0.16 0.00 0.00 57.90 57.60 2dly n TYR 95 Cb 0.67 -0.20 0.41 0.00 -0.31 0.00 0.00 39.34 39.91 2dly n TYR 95 CO 0.00 0.00 0.00 1.79 -0.46 0.00 0.00 176.86 178.19 2dly h THR 96 N 0.00 0.00 0.00 -0.72 1.35 -1.39 -2.93 112.91 109.22 2dly h THR 96 Ca 0.00 -0.58 -0.04 0.00 -0.55 0.00 0.00 66.41 65.24 2dly h THR 96 Cb 0.16 1.53 -0.01 0.00 -1.73 0.00 0.00 68.15 68.09 2dly h THR 96 CO 0.00 0.00 -1.91 0.35 -0.25 0.00 0.00 175.52 173.71 2dly n THR 97 N -2.65 0.14 -3.55 6.82 -2.24 -1.12 -4.82 114.28 106.86 2dly n THR 97 Ca 0.03 -0.47 -0.14 0.00 -2.27 0.00 0.00 64.05 61.21 2dly n THR 97 Cb 0.39 -0.00 -0.06 0.00 -2.10 0.00 0.00 70.33 68.57 2dly n THR 97 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 2dly s THR 98 N -3.22 0.00 -0.14 4.28 -1.32 -1.19 -5.04 115.64 109.01 2dly s THR 98 Ca -0.07 0.00 0.17 0.00 -1.21 0.00 0.00 61.69 60.57 2dly s THR 98 Cb 0.11 -1.00 -0.08 0.00 -1.51 0.00 0.00 72.50 70.02 2dly s THR 98 CO 0.78 0.00 0.99 0.77 -2.21 0.00 0.00 174.62 174.96 2dly h SER 99 N 2.76 0.00 -6.84 8.08 4.64 -1.85 -3.37 113.55 116.97 2dly h SER 99 Ca -0.22 0.00 -0.57 0.00 -0.47 0.00 0.00 61.79 60.53 2dly h SER 99 Cb 1.15 0.00 -0.16 0.00 -0.31 0.00 0.00 62.40 63.08 2dly h SER 99 CO 0.34 0.53 -0.92 -0.90 -0.87 0.00 0.00 176.83 175.01 2dly n ASP 100 N -2.96 0.00 0.00 4.97 5.68 -1.26 -0.97 116.55 122.01 2dly n ASP 100 Ca -0.06 -1.15 0.00 0.00 -0.50 0.00 0.00 54.79 53.08 2dly n ASP 100 Cb 0.80 -2.25 0.00 0.00 -1.14 0.00 0.00 41.12 38.53 2dly n ASP 100 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2dly n GLY 101 N -2.18 3.17 3.06 6.12 0.00 -1.26 -5.06 105.19 109.05 2dly n GLY 101 Ca -0.27 -0.90 -0.49 0.00 0.00 0.00 0.00 46.02 44.36 2dly n GLY 101 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2dly n LEU 102 N 0.00 -0.36 -0.23 0.99 4.77 -0.15 -4.67 117.00 117.35 2dly n LEU 102 Ca 0.00 1.02 0.23 0.00 -0.03 0.00 0.00 56.01 57.22 2dly n LEU 102 Cb 0.00 -0.82 0.42 0.00 -2.33 0.00 0.00 43.42 40.69 2dly n LEU 102 CO 0.00 -1.99 0.75 0.00 -1.33 0.00 0.00 177.39 174.82 2dly s VAL 104 N -5.08 0.10 -0.12 0.00 0.11 -1.26 -5.10 120.40 109.06 2dly s VAL 104 Ca -0.06 -0.82 -0.20 0.00 -2.93 0.00 0.00 61.98 57.97 2dly s VAL 104 Cb 0.24 -1.23 -0.04 0.00 -1.53 0.00 0.00 36.38 33.82 2dly s VAL 104 CO 0.55 -0.45 0.56 -0.75 -3.33 0.00 0.00 175.10 171.68 2dly s LYS 105 N -3.81 4.34 0.09 1.54 2.20 -1.26 -4.74 119.74 118.11 2dly s LYS 105 Ca 0.04 0.58 -0.34 0.00 -0.36 0.00 0.00 55.97 55.89 2dly s LYS 105 Cb 0.03 -3.46 -0.13 0.00 -1.51 0.00 0.00 37.83 32.75 2dly s LYS 105 CO -0.11 0.07 1.67 1.28 -0.36 0.00 0.00 175.35 177.90 2dly n LEU 106 N 3.94 3.24 -0.01 5.43 4.77 -1.11 -4.80 117.00 128.46 2dly n LEU 106 Ca -0.05 1.05 -0.01 0.00 -0.03 0.00 0.00 56.01 56.97 2dly n LEU 106 Cb 0.51 -1.42 -0.00 0.00 -2.33 0.00 0.00 43.42 40.18 2dly n LEU 106 CO 0.44 -0.20 -0.09 -0.62 -1.33 0.00 0.00 177.39 175.59 2dly n GLU 107 N 4.42 0.07 -4.06 3.23 -0.58 -1.24 -4.28 120.64 118.20 2dly n GLU 107 Ca 0.19 0.03 -0.12 0.00 -0.42 0.00 0.00 57.16 56.83 2dly n GLU 107 Cb 0.29 -0.43 -0.11 0.00 -0.57 0.00 0.00 31.44 30.62 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 -1.36 0.51 0.42 3.49 -0.14 -1.26 -5.06 119.74 116.34 2dly s LYS 108 Ca -0.04 -0.79 -0.24 0.00 -1.36 0.00 0.00 55.97 53.54 2dly s LYS 108 Cb 0.01 -0.19 -0.08 0.00 -1.68 0.00 0.00 37.83 35.88 2dly s LYS 108 CO 0.05 0.02 1.18 -1.25 -0.76 0.00 0.00 175.35 174.60 2dly s PRO 109 N -1.81 3.93 0.90 -1.68 0.04 -1.26 -2.33 135.00 132.79 2dly s PRO 109 Ca -0.09 1.85 -0.12 0.00 0.04 0.00 0.00 61.00 62.68 2dly s PRO 109 Cb -0.08 -2.58 0.09 0.00 0.04 0.00 0.00 34.50 31.96 2dly s PRO 109 CO -0.01 -0.43 0.85 0.00 0.04 0.00 0.00 177.00 177.46 2dly s LEU 111 N -4.08 3.32 -0.42 0.00 1.43 -1.26 -4.68 118.68 112.99 2dly s LEU 111 Ca 0.64 0.79 0.02 0.00 -1.03 0.00 0.00 54.13 54.55 2dly s LEU 111 Cb -0.24 -3.65 0.11 0.00 0.03 0.00 0.00 46.19 42.44 2dly s LEU 111 CO 0.60 -0.95 0.16 -0.54 0.23 0.00 0.00 176.35 175.85 2dly s LYS 112 N -4.94 1.80 0.44 1.70 1.02 -1.26 -4.99 119.74 113.51 2dly s LYS 112 Ca 0.52 -2.07 -0.23 0.00 0.02 0.00 0.00 55.97 54.21 2dly s LYS 112 Cb -0.10 -3.37 -0.10 0.00 -0.52 0.00 0.00 37.83 33.74 2dly s LYS 112 CO 0.45 -1.03 0.96 -0.89 -0.92 0.00 0.00 175.35 173.93 2dly n ILE 113 N 4.05 2.50 -3.89 2.17 5.41 -1.26 -4.97 119.36 123.37 2dly n ILE 113 Ca 0.03 -0.50 -0.35 0.00 1.00 0.00 0.00 62.75 62.93 2dly n ILE 113 Cb 0.40 -1.10 -0.14 0.00 -0.71 0.00 0.00 39.64 38.09 2dly n ILE 113 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2dly s GLN 114 N -2.05 2.62 -0.11 0.38 -2.07 -1.26 -5.09 119.66 112.08 2dly s GLN 114 Ca 0.65 -1.14 0.01 0.00 -1.82 0.00 0.00 55.36 53.05 2dly s GLN 114 Cb -0.54 -3.18 -0.02 0.00 -1.09 0.00 0.00 33.01 28.17 2dly s GLN 114 CO 0.56 -0.55 -0.12 0.14 -1.32 0.00 0.00 175.29 173.99 2dly s VAL 115 N 1.32 3.15 -0.36 3.63 -7.23 -1.26 -5.02 120.40 114.62 2dly s VAL 115 Ca -0.03 -0.65 0.07 0.00 -1.81 0.00 0.00 61.98 59.57 2dly s VAL 115 Cb -0.19 -2.30 0.44 0.00 0.56 0.00 0.00 36.38 34.89 2dly s VAL 115 CO -0.01 0.54 1.13 -0.24 -0.31 0.00 0.00 175.10 176.22 2dly n SER 116 N 3.11 4.46 0.00 4.85 2.88 -1.26 -5.09 113.62 122.57 2dly n SER 116 Ca -0.18 -3.59 0.00 0.00 -1.33 0.00 0.00 58.87 53.77 2dly n SER 116 Cb 0.53 -0.42 0.00 0.00 -0.75 0.00 0.00 64.21 63.57 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 -0.56 -0.88 0.00 0.46 0.00 -1.26 -3.91 105.19 99.04 2dly n GLY 117 Ca 0.38 -1.44 0.06 0.00 0.00 0.00 0.00 46.02 45.01 2dly n GLY 117 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2dly n PRO 118 N 0.00 0.49 -1.28 1.61 -0.04 -1.26 -4.87 135.00 129.64 2dly n PRO 118 Ca 0.00 0.00 -0.51 0.00 -0.04 0.00 0.00 63.50 62.95 2dly n PRO 118 Cb 0.00 -1.36 -0.08 0.00 -0.04 0.00 0.00 33.50 32.02 2dly n PRO 118 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2dly n SER 119 N -0.86 0.88 -3.82 3.54 2.88 -1.25 -4.92 113.62 110.07 2dly n SER 119 Ca 0.08 0.86 -0.13 0.00 -1.33 0.00 0.00 58.87 58.36 2dly n SER 119 Cb 0.04 -0.67 -0.14 0.00 -0.75 0.00 0.00 64.21 62.70 2dly n SER 119 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 2dly s SER 120 N 2.51 -0.08 0.00 -3.46 0.01 -1.26 -4.98 113.70 106.44 2dly s SER 120 Ca 0.81 0.18 0.00 0.00 1.31 0.00 0.00 55.95 58.25 2dly s SER 120 Cb -1.13 0.15 0.00 0.00 0.21 0.00 0.00 66.02 65.25 2dly s SER 120 CO 0.61 -0.06 0.41 0.61 0.41 0.00 0.00 173.24 175.22