#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 3.19 0.05 1.61 1.04 -1.26 -4.83 113.70 113.50 2dly s SER 2 Ca 0.00 2.07 -0.35 0.00 0.48 0.00 0.00 55.95 58.15 2dly s SER 2 Cb 0.00 -2.54 -0.18 0.00 0.10 0.00 0.00 66.02 63.40 2dly s SER 2 CO 0.00 -2.91 0.88 -1.54 0.98 0.00 0.00 173.24 170.65 2dly n SER 3 N -4.10 -0.29 0.00 7.02 3.41 -1.26 -4.89 113.62 113.51 2dly n SER 3 Ca 0.11 1.09 0.00 0.00 -0.26 0.00 0.00 58.87 59.80 2dly n SER 3 Cb 0.52 -0.87 0.00 0.00 -0.26 0.00 0.00 64.21 63.60 2dly n SER 3 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2dly n GLY 4 N 1.52 -0.41 3.05 5.00 0.00 -1.26 -5.17 105.19 107.92 2dly n GLY 4 Ca 0.18 0.67 -0.23 0.00 0.00 0.00 0.00 46.02 46.65 2dly n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dly s SER 5 N 0.00 1.62 0.29 1.61 0.01 -1.26 -5.15 113.70 110.81 2dly s SER 5 Ca 0.00 -0.26 0.10 0.00 1.31 0.00 0.00 55.95 57.10 2dly s SER 5 Cb 0.00 -0.50 -0.05 0.00 0.21 0.00 0.00 66.02 65.69 2dly s SER 5 CO 0.00 0.09 -0.04 -0.44 0.41 0.00 0.00 173.24 173.25 2dly s SER 6 N 0.23 4.25 0.00 2.44 0.01 -1.26 -5.13 113.70 114.25 2dly s SER 6 Ca -0.05 -0.80 0.00 0.00 1.31 0.00 0.00 55.95 56.40 2dly s SER 6 Cb -0.11 -0.65 0.00 0.00 0.21 0.00 0.00 66.02 65.47 2dly s SER 6 CO 0.02 -0.04 0.00 0.61 0.41 0.00 0.00 173.24 174.23 2dly n GLY 7 N -0.85 1.89 3.16 3.44 0.00 -1.26 -4.90 105.19 106.67 2dly n GLY 7 Ca -0.06 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.58 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 -3.98 3.46 -0.60 4.61 0.00 -1.26 -4.94 121.76 119.06 2dly s ALA 8 Ca 0.00 -2.86 0.01 0.00 0.00 0.00 0.00 51.96 49.12 2dly s ALA 8 Cb 0.00 -2.73 0.42 0.00 0.00 0.00 0.00 23.12 20.81 2dly s ALA 8 CO 0.00 -1.98 1.68 -1.91 0.00 0.00 0.00 175.76 173.55 2dly n GLU 9 N 4.26 3.05 -3.77 0.00 4.07 -1.26 -4.92 120.64 122.07 2dly n GLU 9 Ca 0.01 -3.79 -0.23 0.00 -0.06 0.00 0.00 57.16 53.10 2dly n GLU 9 Cb 0.40 -2.27 -0.05 0.00 -0.06 0.00 0.00 31.44 29.46 2dly n GLU 9 CO 0.00 0.00 0.00 -0.25 -0.06 0.00 0.00 177.13 176.82 2dly n ASP 10 N -0.67 0.09 0.24 4.31 8.00 -1.26 -4.74 116.55 122.52 2dly n ASP 10 Ca 0.52 -0.87 0.07 0.00 0.71 0.00 0.00 54.79 55.22 2dly n ASP 10 Cb 0.59 -1.07 0.59 0.00 -0.02 0.00 0.00 41.12 41.21 2dly n ASP 10 CO 0.00 0.00 0.00 0.03 -0.39 0.00 0.00 177.20 176.84 2dly h ARG 11 N -0.87 0.00 0.00 -1.24 -0.00 -1.96 -1.43 114.38 108.88 2dly h ARG 11 Ca -0.45 0.00 -0.07 0.00 -0.50 0.00 0.00 59.98 58.96 2dly h ARG 11 Cb 0.94 0.00 -0.01 0.00 0.00 0.00 0.00 29.97 30.90 2dly h ARG 11 CO 0.46 0.12 -0.33 0.66 0.00 0.00 0.00 179.97 180.87 2dly h SER 12 N 0.00 0.00 -0.64 7.04 4.64 -2.03 -3.06 113.55 119.51 2dly h SER 12 Ca -0.00 0.00 0.19 0.00 -0.47 0.00 0.00 61.79 61.50 2dly h SER 12 Cb 0.23 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.29 2dly h SER 12 CO 0.02 0.33 0.74 0.25 -0.87 0.00 0.00 176.83 177.30 2dly h LEU 13 N 0.00 0.00 -1.70 5.97 6.46 -1.60 0.24 115.31 124.68 2dly h LEU 13 Ca -0.00 0.00 0.20 0.00 -0.12 0.00 0.00 57.88 57.96 2dly h LEU 13 Cb 0.84 0.00 -0.05 0.00 -0.73 0.00 0.00 40.66 40.72 2dly h LEU 13 CO 0.04 0.00 0.56 1.56 -0.62 0.00 0.00 178.44 179.99 2dly h GLN 14 N 0.00 0.25 -0.26 1.25 1.08 -1.71 0.23 115.11 115.95 2dly h GLN 14 Ca 0.30 -0.02 -0.01 0.00 -1.45 0.00 0.00 58.65 57.48 2dly h GLN 14 Cb 1.77 -0.06 -0.01 0.00 -0.05 0.00 0.00 27.48 29.13 2dly h GLN 14 CO -0.00 0.17 0.13 0.00 -0.95 0.00 0.00 178.83 178.17 2dly h ALA 15 N 1.62 1.74 -2.19 3.87 0.00 -0.78 -3.43 119.26 120.09 2dly h ALA 15 Ca 0.42 -0.05 -0.60 0.00 0.00 0.00 0.00 54.91 54.67 2dly h ALA 15 Cb 1.22 -0.11 0.07 0.00 0.00 0.00 0.00 17.79 18.97 2dly h ALA 15 CO -0.11 0.22 0.67 0.39 0.00 0.00 0.00 179.25 180.43 2dly n GLU 16 N -4.45 1.94 -0.06 0.00 -0.58 0.81 -4.91 120.64 113.39 2dly n GLU 16 Ca 0.01 0.70 -0.13 0.00 -0.42 0.00 0.00 57.16 57.31 2dly n GLU 16 Cb 0.11 -2.40 -0.06 0.00 -0.57 0.00 0.00 31.44 28.51 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 5.09 0.44 0.00 3.49 0.13 -1.87 -2.94 132.00 136.35 2dly h PRO 17 Ca -0.45 -0.23 0.00 0.00 -0.87 0.00 0.00 66.00 64.45 2dly h PRO 17 Cb 1.28 0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.41 2dly h PRO 17 CO 0.82 0.80 0.00 0.11 -0.23 0.00 0.00 178.00 179.50 2dly h TRP 18 N 0.10 0.00 -3.36 1.56 5.08 -1.84 -3.42 115.95 114.07 2dly h TRP 18 Ca 0.03 0.00 -0.56 0.00 1.08 0.00 0.00 58.89 59.44 2dly h TRP 18 Cb 0.72 0.00 -0.06 0.00 -3.00 0.00 0.00 29.16 26.82 2dly h TRP 18 CO 0.08 0.00 0.05 0.12 -1.28 0.00 0.00 178.44 177.41 2dly s PHE 19 N -3.47 3.58 -0.15 0.12 5.36 -1.11 0.17 117.98 122.47 2dly s PHE 19 Ca 0.01 1.20 0.17 0.00 -0.96 0.00 0.00 56.93 57.35 2dly s PHE 19 Cb 0.08 -2.76 0.44 0.00 -0.34 0.00 0.00 43.02 40.44 2dly s PHE 19 CO 0.31 0.11 1.18 1.19 -1.46 0.00 0.00 175.22 176.56 2dly n PHE 20 N 3.70 0.53 0.00 10.12 3.01 -0.85 -4.88 117.46 129.09 2dly n PHE 20 Ca -0.02 -1.33 0.00 0.00 1.01 0.00 0.00 57.45 57.11 2dly n PHE 20 Cb 0.51 -0.22 0.00 0.00 -0.01 0.00 0.00 39.48 39.76 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 -0.43 3.75 3.06 1.37 0.00 -1.26 -4.01 105.19 107.65 2dly n GLY 21 Ca 0.16 0.20 -0.32 0.00 0.00 0.00 0.00 46.02 46.06 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 -1.02 2.83 0.37 4.61 0.00 -1.26 0.12 121.76 127.40 2dly s ALA 22 Ca 0.00 -2.27 0.03 0.00 0.00 0.00 0.00 51.96 49.73 2dly s ALA 22 Cb 0.00 -1.91 -0.04 0.00 0.00 0.00 0.00 23.12 21.17 2dly s ALA 22 CO 0.00 -1.53 0.10 0.96 0.00 0.00 0.00 175.76 175.28 2dly s ILE 23 N 1.01 0.82 0.30 0.00 -4.36 -1.26 -4.87 121.20 112.84 2dly s ILE 23 Ca 0.04 -2.00 0.06 0.00 -0.26 0.00 0.00 60.65 58.49 2dly s ILE 23 Cb -0.20 -2.53 -0.02 0.00 1.25 0.00 0.00 42.46 40.96 2dly s ILE 23 CO -0.06 0.00 0.41 -0.54 0.24 0.00 0.00 174.94 174.98 2dly s LYS 24 N -3.81 3.17 0.43 0.37 1.02 -1.26 -4.61 119.74 115.04 2dly s LYS 24 Ca 0.29 -0.97 0.17 0.00 0.02 0.00 0.00 55.97 55.48 2dly s LYS 24 Cb 0.05 -2.79 1.08 0.00 -0.52 0.00 0.00 37.83 35.65 2dly s LYS 24 CO 0.15 0.19 1.89 0.07 -0.92 0.00 0.00 175.35 176.72 2dly h ARG 25 N 1.04 0.39 -0.03 1.68 0.11 -1.99 -0.20 114.38 115.37 2dly h ARG 25 Ca -0.48 -0.02 -0.00 0.00 0.10 0.00 0.00 59.98 59.58 2dly h ARG 25 Cb 1.25 -0.09 -0.00 0.00 1.11 0.00 0.00 29.97 32.24 2dly h ARG 25 CO 0.56 0.26 0.01 0.00 0.10 0.00 0.00 179.97 180.90 2dly h ALA 26 N 1.62 0.04 -0.30 0.08 0.00 -1.98 0.38 119.26 119.10 2dly h ALA 26 Ca 0.42 -0.08 -0.08 0.00 0.00 0.00 0.00 54.91 55.17 2dly h ALA 26 Cb 1.04 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.80 2dly h ALA 26 CO -0.15 -0.38 -0.17 -0.44 0.00 0.00 0.00 179.25 178.12 2dly h ASP 27 N -0.09 0.52 -0.19 0.00 3.32 -1.62 -1.80 116.42 116.55 2dly h ASP 27 Ca 0.01 -0.15 -0.21 0.00 0.02 0.00 0.00 57.03 56.70 2dly h ASP 27 Cb 0.15 -0.14 0.01 0.00 0.22 0.00 0.00 39.33 39.57 2dly h ASP 27 CO -0.00 0.71 -0.71 0.00 -1.72 0.00 0.00 179.24 177.52 2dly h ALA 28 N 1.34 0.34 0.40 3.45 0.00 -0.88 -3.21 119.26 120.70 2dly h ALA 28 Ca 0.08 -0.57 -0.02 0.00 0.00 0.00 0.00 54.91 54.40 2dly h ALA 28 Cb 0.57 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.33 2dly h ALA 28 CO 0.04 0.67 -0.19 0.93 0.00 0.00 0.00 179.25 180.69 2dly h GLU 29 N 0.56 -0.52 -1.50 0.00 5.08 -0.09 -2.52 114.58 115.60 2dly h GLU 29 Ca -0.03 0.04 0.48 0.00 -1.00 0.00 0.00 59.36 58.84 2dly h GLU 29 Cb 1.33 0.12 -0.11 0.00 0.50 0.00 0.00 28.75 30.59 2dly h GLU 29 CO 0.15 -0.35 1.02 0.36 -1.00 0.00 0.00 179.01 179.19 2dly n LYS 30 N -3.85 -0.02 -0.03 2.33 2.85 -0.69 0.22 118.16 118.97 2dly n LYS 30 Ca -0.07 1.10 -0.16 0.00 -1.05 0.00 0.00 58.31 58.13 2dly n LYS 30 Cb 0.21 -2.30 -0.08 0.00 -0.65 0.00 0.00 35.03 32.22 2dly n LYS 30 CO 0.00 0.00 0.00 1.96 -0.05 0.00 0.00 177.40 179.31 2dly h GLN 31 N 0.00 0.58 -0.24 -1.58 1.08 -1.53 -2.73 115.11 110.69 2dly h GLN 31 Ca 0.84 -0.47 -0.14 0.00 -1.45 0.00 0.00 58.65 57.43 2dly h GLN 31 Cb 2.98 0.09 -0.00 0.00 -0.05 0.00 0.00 27.48 30.50 2dly h GLN 31 CO -0.26 1.09 -0.41 -0.07 -0.95 0.00 0.00 178.83 178.23 2dly h LEU 32 N 0.22 0.77 -2.35 1.46 3.38 0.31 -2.93 115.31 116.17 2dly h LEU 32 Ca -0.03 -0.53 -0.00 0.00 0.09 0.00 0.00 57.88 57.40 2dly h LEU 32 Cb 1.19 -0.22 -0.00 0.00 0.09 0.00 0.00 40.66 41.72 2dly h LEU 32 CO 0.11 1.16 -0.01 -0.07 0.09 0.00 0.00 178.44 179.72 2dly h LEU 33 N 0.42 0.00 -9.04 1.67 -0.00 -0.63 -3.44 115.31 104.30 2dly h LEU 33 Ca 0.02 0.00 -0.62 0.00 -0.00 0.00 0.00 57.88 57.27 2dly h LEU 33 Cb 1.01 0.00 0.16 0.00 -0.00 0.00 0.00 40.66 41.83 2dly h LEU 33 CO 0.09 0.01 -0.89 0.00 -0.00 0.00 0.00 178.44 177.66 2dly n TYR 34 N -3.14 -1.92 0.40 1.13 9.36 -1.03 -4.89 117.16 117.07 2dly n TYR 34 Ca -0.02 0.63 -0.17 0.00 3.32 0.00 0.00 57.90 61.66 2dly n TYR 34 Cb 0.17 -1.80 -0.08 0.00 -0.63 0.00 0.00 39.34 36.99 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 0.37 -0.88 -0.99 2.98 0.87 -1.89 -2.97 113.55 111.04 2dly h SER 35 Ca -0.37 0.01 0.37 0.00 -1.23 0.00 0.00 61.79 60.57 2dly h SER 35 Cb 1.44 0.23 -0.17 0.00 -0.44 0.00 0.00 62.40 63.46 2dly h SER 35 CO 0.47 -0.54 0.47 -0.33 -0.53 0.00 0.00 176.83 176.37 2dly h GLU 36 N -1.19 0.10 -7.11 2.24 4.39 -1.96 -3.39 114.58 107.66 2dly h GLU 36 Ca -0.11 -0.01 -0.47 0.00 0.34 0.00 0.00 59.36 59.11 2dly h GLU 36 Cb 0.81 -0.02 0.03 0.00 -0.10 0.00 0.00 28.75 29.47 2dly h GLU 36 CO 0.17 0.07 0.38 -0.80 -1.16 0.00 0.00 179.01 177.67 2dly s ASN 37 N -4.71 6.25 0.24 1.42 0.01 -1.12 -5.07 114.94 111.96 2dly s ASN 37 Ca -0.10 1.86 -0.00 0.00 -0.71 0.00 0.00 52.86 53.91 2dly s ASN 37 Cb 0.32 -2.55 -0.03 0.00 0.41 0.00 0.00 41.25 39.40 2dly s ASN 37 CO 0.78 -0.84 0.21 -1.10 -1.51 0.00 0.00 177.10 174.64 2dly s GLN 38 N -3.50 1.40 -0.49 -0.60 -0.21 -1.26 -4.82 119.66 110.18 2dly s GLN 38 Ca 0.66 -1.70 -0.44 0.00 0.02 0.00 0.00 55.36 53.89 2dly s GLN 38 Cb -0.15 0.31 -0.19 0.00 1.00 0.00 0.00 33.01 33.97 2dly s GLN 38 CO 0.24 -0.49 1.81 2.41 -2.12 0.00 0.00 175.29 177.14 2dly n THR 39 N -0.38 0.00 0.00 -0.19 -1.04 -1.26 -1.53 114.28 109.88 2dly n THR 39 Ca 0.03 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.04 2dly n THR 39 Cb 0.65 -0.49 0.00 0.00 -1.82 0.00 0.00 70.33 68.67 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 5.53 2.79 3.54 3.41 0.00 -0.24 -4.87 105.19 115.35 2dly n GLY 40 Ca 0.41 -0.64 -0.56 0.00 0.00 0.00 0.00 46.02 45.23 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 -2.55 -2.43 4.61 0.00 -0.58 -3.41 120.51 116.15 2dly n ALA 41 Ca 0.00 0.57 -0.14 0.00 0.00 0.00 0.00 53.44 53.87 2dly n ALA 41 Cb 0.00 -1.89 -0.11 0.00 0.00 0.00 0.00 19.45 17.46 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 0.19 1.04 -0.28 0.00 -0.71 -1.03 -0.18 117.98 117.00 2dly s PHE 42 Ca 0.88 -0.70 -0.16 0.00 -1.04 0.00 0.00 56.93 55.92 2dly s PHE 42 Cb -1.14 -0.57 0.10 0.00 -1.21 0.00 0.00 43.02 40.21 2dly s PHE 42 CO 0.53 -0.02 0.78 -0.48 -1.34 0.00 0.00 175.22 174.68 2dly s LEU 43 N -2.57 -0.82 0.03 -1.99 0.05 0.44 -0.43 118.68 113.39 2dly s LEU 43 Ca 0.07 1.31 -0.01 0.00 0.05 0.00 0.00 54.13 55.55 2dly s LEU 43 Cb -0.01 2.19 -0.04 0.00 -2.05 0.00 0.00 46.19 46.28 2dly s LEU 43 CO -0.01 -0.21 0.19 -0.63 -0.55 0.00 0.00 176.35 175.15 2dly s ILE 44 N 1.61 5.34 0.21 1.48 1.09 0.13 -0.63 121.20 130.42 2dly s ILE 44 Ca -0.09 -0.33 -0.05 0.00 -1.10 0.00 0.00 60.65 59.08 2dly s ILE 44 Cb -0.05 -3.56 -0.03 0.00 -1.06 0.00 0.00 42.46 37.77 2dly s ILE 44 CO -0.18 0.21 0.24 0.00 -0.10 0.00 0.00 174.94 175.11 2dly s ARG 45 N -2.27 1.31 -0.10 2.79 1.70 -0.07 -2.00 118.95 120.31 2dly s ARG 45 Ca 0.31 -1.50 -0.19 0.00 -0.47 0.00 0.00 55.73 53.88 2dly s ARG 45 Cb -0.13 0.33 -0.04 0.00 -0.57 0.00 0.00 34.95 34.54 2dly s ARG 45 CO 0.24 -0.47 0.52 -1.21 -1.08 0.00 0.00 175.30 173.30 2dly s GLU 46 N -4.11 4.34 0.00 3.89 2.02 0.32 -0.30 118.70 124.86 2dly s GLU 46 Ca 0.33 0.54 -0.37 0.00 0.02 0.00 0.00 54.97 55.49 2dly s GLU 46 Cb 0.05 -3.43 -0.16 0.00 0.10 0.00 0.00 34.13 30.69 2dly s GLU 46 CO 0.11 0.17 1.49 0.45 0.02 0.00 0.00 175.26 177.50 2dly n SER 47 N 3.58 2.08 0.04 -0.19 2.88 -1.15 -4.07 113.62 116.79 2dly n SER 47 Ca -0.06 1.10 -0.15 0.00 -1.33 0.00 0.00 58.87 58.42 2dly n SER 47 Cb 0.52 -1.22 -0.05 0.00 -0.75 0.00 0.00 64.21 62.71 2dly n SER 47 CO 0.00 0.00 0.00 1.05 -1.23 0.00 0.00 175.04 174.86 2dly h GLU 48 N 5.56 0.55 0.13 -1.46 -0.00 -1.95 -3.34 114.58 114.07 2dly h GLU 48 Ca -0.47 -0.54 -0.01 0.00 -0.00 0.00 0.00 59.36 58.35 2dly h GLU 48 Cb 1.32 0.14 0.00 0.00 -0.00 0.00 0.00 28.75 30.21 2dly h GLU 48 CO 0.84 1.16 -0.06 1.03 -0.00 0.00 0.00 179.01 181.98 2dly h SER 49 N 0.34 -0.15 -2.31 3.06 0.87 -1.98 -3.46 113.55 109.93 2dly h SER 49 Ca -0.08 -0.41 -0.50 0.00 -1.23 0.00 0.00 61.79 59.57 2dly h SER 49 Cb 1.52 0.04 -0.03 0.00 -0.44 0.00 0.00 62.40 63.49 2dly h SER 49 CO 0.17 0.43 -0.49 -1.58 -0.53 0.00 0.00 176.83 174.82 2dly s GLN 50 N -3.44 3.17 -0.20 2.24 -0.44 -1.25 -5.11 119.66 114.63 2dly s GLN 50 Ca -0.13 -0.87 -0.06 0.00 -2.50 0.00 0.00 55.36 51.80 2dly s GLN 50 Cb 0.00 -2.74 -0.03 0.00 -1.64 0.00 0.00 33.01 28.60 2dly s GLN 50 CO 0.51 0.44 0.03 0.21 0.50 0.00 0.00 175.29 176.98 2dly s LYS 51 N -3.71 3.74 0.00 1.67 2.36 -1.26 -4.21 119.74 118.33 2dly s LYS 51 Ca 0.33 -0.46 0.00 0.00 -2.55 0.00 0.00 55.97 53.29 2dly s LYS 51 Cb -0.09 -3.14 0.00 0.00 -1.05 0.00 0.00 37.83 33.55 2dly s LYS 51 CO 0.27 0.09 0.00 0.41 1.55 0.00 0.00 175.35 177.67 2dly n GLY 52 N 4.03 3.20 3.30 5.54 0.00 -1.26 -5.08 105.19 114.93 2dly n GLY 52 Ca -0.17 -0.98 -0.30 0.00 0.00 0.00 0.00 46.02 44.57 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 -0.94 0.03 1.61 2.15 -1.26 -4.90 116.67 113.36 2dly s ASP 53 Ca 0.00 1.00 -0.10 0.00 0.43 0.00 0.00 52.55 53.87 2dly s ASP 53 Cb 0.00 -1.45 0.01 0.00 -0.30 0.00 0.00 42.92 41.18 2dly s ASP 53 CO 0.00 -5.31 0.22 -0.36 -0.17 0.00 0.00 175.17 169.55 2dly s PHE 54 N -2.23 0.01 -0.03 -5.34 0.40 -1.25 -2.92 117.98 106.61 2dly s PHE 54 Ca 0.68 -0.17 0.05 0.00 -0.60 0.00 0.00 56.93 56.89 2dly s PHE 54 Cb -0.16 0.00 -0.01 0.00 0.51 0.00 0.00 43.02 43.36 2dly s PHE 54 CO 0.59 -0.42 -0.17 0.45 0.70 0.00 0.00 175.22 176.37 2dly s SER 55 N -1.93 2.09 -0.23 1.36 0.15 0.59 -1.91 113.70 113.82 2dly s SER 55 Ca -0.07 -0.33 -0.07 0.00 0.70 0.00 0.00 55.95 56.18 2dly s SER 55 Cb -0.02 -0.39 -0.03 0.00 -1.71 0.00 0.00 66.02 63.86 2dly s SER 55 CO -0.02 0.19 0.06 -0.22 1.20 0.00 0.00 173.24 174.44 2dly s LEU 56 N -0.20 3.49 -0.25 3.45 2.96 -0.54 -0.89 118.68 126.70 2dly s LEU 56 Ca 0.02 -0.15 -0.03 0.00 -0.22 0.00 0.00 54.13 53.76 2dly s LEU 56 Cb -0.09 -1.92 0.02 0.00 0.50 0.00 0.00 46.19 44.70 2dly s LEU 56 CO 0.01 0.02 -0.04 -0.55 -1.32 0.00 0.00 176.35 174.46 2dly s SER 57 N 1.29 4.41 0.12 3.68 0.15 0.20 -1.17 113.70 122.38 2dly s SER 57 Ca 0.05 -0.80 0.10 0.00 0.70 0.00 0.00 55.95 56.00 2dly s SER 57 Cb -0.15 -1.70 -0.04 0.00 -1.71 0.00 0.00 66.02 62.43 2dly s SER 57 CO 0.03 -0.13 -0.26 -0.69 1.20 0.00 0.00 173.24 173.40 2dly s VAL 58 N 1.36 2.13 -0.14 4.45 1.01 -1.15 -0.42 120.40 127.65 2dly s VAL 58 Ca 0.01 -1.71 -0.12 0.00 0.00 0.00 0.00 61.98 60.16 2dly s VAL 58 Cb -0.16 -1.90 -0.05 0.00 0.00 0.00 0.00 36.38 34.27 2dly s VAL 58 CO -0.03 0.06 0.26 -0.22 0.00 0.00 0.00 175.10 175.16 2dly s LEU 59 N -2.02 4.30 -0.47 3.92 2.96 0.74 -1.27 118.68 126.84 2dly s LEU 59 Ca 0.12 0.53 0.06 0.00 -0.22 0.00 0.00 54.13 54.62 2dly s LEU 59 Cb -0.10 -2.31 0.21 0.00 0.50 0.00 0.00 46.19 44.49 2dly s LEU 59 CO 0.06 0.20 0.48 -0.67 -1.32 0.00 0.00 176.35 175.09 2dly n ASP 60 N 3.05 0.74 -1.76 3.68 2.03 -0.17 -1.08 116.55 123.04 2dly n ASP 60 Ca -0.14 -2.74 -0.04 0.00 0.52 0.00 0.00 54.79 52.39 2dly n ASP 60 Cb 0.52 -0.63 0.02 0.00 -0.72 0.00 0.00 41.12 40.32 2dly n ASP 60 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 2dly n GLU 61 N 1.92 -1.13 -0.42 -0.67 1.02 -1.26 -3.44 120.64 116.66 2dly n GLU 61 Ca 0.25 0.21 0.00 0.00 -0.02 0.00 0.00 57.16 57.61 2dly n GLU 61 Cb 0.47 -2.97 0.00 0.00 -0.02 0.00 0.00 31.44 28.92 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 -1.22 1.83 3.94 0.62 0.00 -1.26 -4.99 105.19 104.11 2dly n GLY 62 Ca -0.05 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.72 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 -3.13 5.21 -0.29 1.61 0.11 -1.22 -4.88 120.40 117.80 2dly s VAL 63 Ca 0.00 -0.55 0.03 0.00 -2.93 0.00 0.00 61.98 58.53 2dly s VAL 63 Cb 0.00 -3.79 0.08 0.00 -1.53 0.00 0.00 36.38 31.14 2dly s VAL 63 CO 0.00 -0.27 -0.03 -0.69 -3.33 0.00 0.00 175.10 170.77 2dly s VAL 64 N -1.97 2.15 -0.46 2.04 1.01 -1.26 -1.00 120.40 120.91 2dly s VAL 64 Ca 0.37 -1.91 -0.24 0.00 0.00 0.00 0.00 61.98 60.20 2dly s VAL 64 Cb -0.10 -2.41 0.03 0.00 0.00 0.00 0.00 36.38 33.89 2dly s VAL 64 CO 0.30 -0.29 0.83 -0.54 0.00 0.00 0.00 175.10 175.40 2dly s LYS 65 N 1.04 3.42 -0.42 2.72 3.01 -0.40 -4.93 119.74 124.18 2dly s LYS 65 Ca 0.00 -0.08 -0.24 0.00 -1.01 0.00 0.00 55.97 54.64 2dly s LYS 65 Cb -0.19 -3.95 0.02 0.00 -1.01 0.00 0.00 37.83 32.69 2dly s LYS 65 CO -0.07 -1.18 0.83 -1.01 0.51 0.00 0.00 175.35 174.43 2dly s HIS 66 N 3.44 3.02 -0.13 3.18 3.76 -1.26 -2.94 115.29 124.37 2dly s HIS 66 Ca 0.31 0.38 -0.04 0.00 -0.15 0.00 0.00 55.06 55.56 2dly s HIS 66 Cb -0.12 -3.65 -0.03 0.00 1.11 0.00 0.00 32.58 29.89 2dly s HIS 66 CO 0.23 -0.92 0.01 0.71 -0.85 0.00 0.00 174.74 173.92 2dly s TYR 67 N 3.35 3.15 -0.22 1.40 2.02 -0.32 -4.99 117.35 121.75 2dly s TYR 67 Ca 0.33 0.04 -0.22 0.00 -0.37 0.00 0.00 57.07 56.84 2dly s TYR 67 Cb -0.12 -1.90 -0.02 0.00 -0.40 0.00 0.00 41.96 39.52 2dly s TYR 67 CO 0.21 0.27 0.72 0.50 -1.57 0.00 0.00 175.55 175.68 2dly s ARG 68 N -0.26 4.19 -0.50 -0.62 6.06 -1.26 -1.47 118.95 125.08 2dly s ARG 68 Ca 0.06 0.75 -0.18 0.00 -2.50 0.00 0.00 55.73 53.86 2dly s ARG 68 Cb -0.12 -3.62 0.06 0.00 0.06 0.00 0.00 34.95 31.33 2dly s ARG 68 CO 0.02 -0.38 0.57 0.42 -2.50 0.00 0.00 175.30 173.43 2dly s ILE 69 N 2.39 4.96 0.11 4.11 1.01 -0.80 -4.77 121.20 128.20 2dly s ILE 69 Ca 0.31 -0.62 -0.13 0.00 0.00 0.00 0.00 60.65 60.21 2dly s ILE 69 Cb -0.16 -4.26 -0.06 0.00 0.01 0.00 0.00 42.46 37.99 2dly s ILE 69 CO 0.09 -0.75 0.49 -0.13 0.00 0.00 0.00 174.94 174.64 2dly s ARG 70 N 2.40 3.92 0.16 2.79 0.52 -1.10 -3.85 118.95 123.79 2dly s ARG 70 Ca 0.13 0.40 0.06 0.00 -0.52 0.00 0.00 55.73 55.79 2dly s ARG 70 Cb -0.20 -3.00 -0.04 0.00 0.52 0.00 0.00 34.95 32.23 2dly s ARG 70 CO 0.11 0.53 0.08 1.03 0.02 0.00 0.00 175.30 177.06 2dly s ARG 71 N -1.82 2.69 0.49 3.54 0.52 -1.26 -1.68 118.95 121.43 2dly s ARG 71 Ca 0.34 -0.96 0.07 0.00 -0.52 0.00 0.00 55.73 54.67 2dly s ARG 71 Cb -0.15 -2.53 0.07 0.00 0.52 0.00 0.00 34.95 32.86 2dly s ARG 71 CO 0.18 0.48 0.59 1.28 0.02 0.00 0.00 175.30 177.85 2dly n LEU 72 N -0.20 0.00 -0.00 2.53 7.99 -1.10 -5.00 117.00 121.21 2dly n LEU 72 Ca -0.09 -2.24 0.08 0.00 -0.01 0.00 0.00 56.01 53.75 2dly n LEU 72 Cb 0.55 -0.27 -0.11 0.00 -0.11 0.00 0.00 43.42 43.48 2dly n LEU 72 CO 0.41 -0.64 -0.15 0.47 -1.51 0.00 0.00 177.39 175.97 2dly n ASP 73 N -2.26 0.83 -0.00 -1.43 9.92 -1.26 -4.49 116.55 117.86 2dly n ASP 73 Ca 0.09 -0.76 0.00 0.00 -0.53 0.00 0.00 54.79 53.59 2dly n ASP 73 Cb 0.52 1.14 -0.01 0.00 -0.64 0.00 0.00 41.12 42.13 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 -1.53 1.16 0.00 -1.24 0.28 -1.26 -5.04 120.64 113.00 2dly n GLU 74 Ca 0.02 -0.01 0.00 0.00 -0.16 0.00 0.00 57.16 57.01 2dly n GLU 74 Cb 0.31 -1.03 0.00 0.00 1.43 0.00 0.00 31.44 32.15 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 2.58 0.85 0.00 -1.84 0.00 -1.26 -5.15 105.19 100.37 2dly n GLY 75 Ca -0.01 0.00 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 5.00 -0.17 3.18 -0.02 0.00 -1.11 -4.81 105.19 107.26 2dly n GLY 76 Ca 0.00 0.19 -0.24 0.00 0.00 0.00 0.00 46.02 45.97 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 0.00 1.55 -0.19 1.61 0.08 -0.67 -2.71 117.98 117.64 2dly s PHE 77 Ca 0.00 -0.32 -0.10 0.00 0.12 0.00 0.00 56.93 56.63 2dly s PHE 77 Cb 0.00 -0.96 0.07 0.00 -0.57 0.00 0.00 43.02 41.55 2dly s PHE 77 CO 0.00 0.02 0.47 -0.59 -0.10 0.00 0.00 175.22 175.01 2dly s PHE 78 N -0.58 -0.71 -0.17 0.36 -0.71 -0.68 0.33 117.98 115.82 2dly s PHE 78 Ca 0.06 1.47 0.17 0.00 -1.04 0.00 0.00 56.93 57.60 2dly s PHE 78 Cb -0.07 0.34 -0.02 0.00 -1.21 0.00 0.00 43.02 42.06 2dly s PHE 78 CO 0.00 -0.39 1.13 1.25 -1.34 0.00 0.00 175.22 175.87 2dly h LEU 79 N 7.19 0.00 -7.17 -1.99 5.85 -1.83 -2.91 115.31 114.45 2dly h LEU 79 Ca -0.34 0.00 -0.13 0.00 0.84 0.00 0.00 57.88 58.25 2dly h LEU 79 Cb 1.19 0.00 -0.28 0.00 0.37 0.00 0.00 40.66 41.93 2dly h LEU 79 CO 0.26 0.44 -0.39 0.28 -0.34 0.00 0.00 178.44 178.69 2dly s THR 80 N -3.01 -0.41 0.22 1.05 -1.32 -1.26 -4.88 115.64 106.03 2dly s THR 80 Ca 0.01 0.17 0.04 0.00 -1.21 0.00 0.00 61.69 60.69 2dly s THR 80 Cb 0.08 -0.60 0.28 0.00 -1.51 0.00 0.00 72.50 70.75 2dly s THR 80 CO 0.78 0.07 1.06 0.54 -2.21 0.00 0.00 174.62 174.85 2dly n ARG 81 N 5.03 -0.05 -0.32 7.08 5.12 -1.26 0.80 116.66 133.06 2dly n ARG 81 Ca -0.13 0.99 0.06 0.00 -1.93 0.00 0.00 57.85 56.85 2dly n ARG 81 Cb 0.51 -1.62 0.13 0.00 -1.16 0.00 0.00 32.46 30.33 2dly n ARG 81 CO 0.00 0.00 0.00 0.54 -1.93 0.00 0.00 177.63 176.24 2dly n ARG 82 N -4.83 -0.08 -4.24 5.56 5.12 -1.26 -4.41 116.66 112.52 2dly n ARG 82 Ca 0.18 1.38 -0.20 0.00 -1.93 0.00 0.00 57.85 57.28 2dly n ARG 82 Cb 0.59 -2.07 -0.12 0.00 -1.16 0.00 0.00 32.46 29.69 2dly n ARG 82 CO 0.00 0.00 0.00 0.21 -1.93 0.00 0.00 177.63 175.91 2dly s LYS 83 N -6.10 0.91 0.02 5.56 2.47 0.24 -5.16 119.74 117.69 2dly s LYS 83 Ca -0.13 -0.96 0.02 0.00 -1.56 0.00 0.00 55.97 53.34 2dly s LYS 83 Cb 0.24 -0.98 -0.02 0.00 -1.46 0.00 0.00 37.83 35.62 2dly s LYS 83 CO 0.69 0.22 -0.06 0.08 0.16 0.00 0.00 175.35 176.45 2dly s VAL 84 N -1.16 0.44 0.49 4.02 1.01 -1.26 -4.02 120.40 119.92 2dly s VAL 84 Ca 0.01 -0.74 0.02 0.00 0.00 0.00 0.00 61.98 61.26 2dly s VAL 84 Cb -0.10 -0.47 -0.01 0.00 0.00 0.00 0.00 36.38 35.80 2dly s VAL 84 CO 0.02 -0.21 0.03 -0.36 0.00 0.00 0.00 175.10 174.58 2dly s PHE 85 N -0.92 1.85 -0.20 5.22 0.08 0.15 -5.00 117.98 119.17 2dly s PHE 85 Ca -0.06 -1.03 -0.10 0.00 0.12 0.00 0.00 56.93 55.86 2dly s PHE 85 Cb -0.07 -1.52 -0.09 0.00 -0.57 0.00 0.00 43.02 40.78 2dly s PHE 85 CO 0.00 0.12 -0.26 0.43 -0.10 0.00 0.00 175.22 175.41 2dly n SER 86 N -1.28 1.44 -4.30 1.36 7.64 -1.26 -1.68 113.62 115.55 2dly n SER 86 Ca -0.17 0.25 -0.20 0.00 1.01 0.00 0.00 58.87 59.77 2dly n SER 86 Cb 0.67 -0.60 -0.11 0.00 -1.01 0.00 0.00 64.21 63.16 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 -2.38 1.61 0.60 0.44 -4.23 -1.26 -3.76 115.64 106.66 2dly s THR 87 Ca -0.28 -1.88 0.28 0.00 -1.18 0.00 0.00 61.69 58.63 2dly s THR 87 Cb 0.11 -1.75 0.38 0.00 1.34 0.00 0.00 72.50 72.58 2dly s THR 87 CO 0.36 -0.39 1.67 -0.07 -0.54 0.00 0.00 174.62 175.64 2dly h LEU 88 N 3.26 0.00 0.56 4.79 3.38 -1.96 -1.08 115.31 124.26 2dly h LEU 88 Ca -0.41 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.53 2dly h LEU 88 Cb 1.20 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.96 2dly h LEU 88 CO 0.52 0.00 -0.27 -1.13 0.09 0.00 0.00 178.44 177.65 2dly h ASN 89 N 0.00 -0.64 0.27 -0.43 -0.73 -2.00 -2.76 115.58 109.29 2dly h ASN 89 Ca 0.31 0.02 0.00 0.00 1.87 0.00 0.00 56.30 58.51 2dly h ASN 89 Cb 1.84 0.16 0.00 0.00 0.27 0.00 0.00 38.32 40.60 2dly h ASN 89 CO -0.00 -0.39 0.00 -0.33 -0.37 0.00 0.00 177.43 176.33 2dly h GLU 90 N -0.88 0.00 -0.48 6.67 5.08 -1.65 0.40 114.58 123.73 2dly h GLU 90 Ca -0.08 0.00 -0.11 0.00 -1.00 0.00 0.00 59.36 58.17 2dly h GLU 90 Cb 0.58 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.81 2dly h GLU 90 CO 0.13 0.00 -0.13 0.35 -1.00 0.00 0.00 179.01 178.36 2dly h PHE 91 N 0.00 1.05 0.05 4.33 3.04 -1.12 -2.86 116.94 121.43 2dly h PHE 91 Ca 0.00 -0.23 -0.34 0.00 3.98 0.00 0.00 57.97 61.38 2dly h PHE 91 Cb 0.13 -0.26 -0.04 0.00 2.56 0.00 0.00 35.95 38.35 2dly h PHE 91 CO 0.00 1.02 -1.98 0.28 -2.02 0.00 0.00 178.31 175.61 2dly n VAL 92 N -4.21 1.64 0.29 1.41 0.31 -0.84 -3.73 118.33 113.21 2dly n VAL 92 Ca 0.00 -0.73 0.19 0.00 -0.01 0.00 0.00 64.34 63.80 2dly n VAL 92 Cb 0.40 -1.28 1.04 0.00 -0.91 0.00 0.00 33.84 33.09 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 0.03 0.00 0.00 4.52 2.35 -1.00 -1.02 115.58 120.46 2dly h ASN 93 Ca -0.40 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.35 2dly h ASN 93 Cb 2.04 0.00 0.00 0.00 0.05 0.00 0.00 38.32 40.41 2dly h ASN 93 CO 0.06 0.00 -0.24 0.22 -1.65 0.00 0.00 177.43 175.82 2dly h TYR 94 N 0.00 0.00 -1.03 1.19 3.20 -1.64 -3.39 116.97 115.31 2dly h TYR 94 Ca 0.00 0.00 0.26 0.00 3.14 0.00 0.00 58.73 62.13 2dly h TYR 94 Cb 0.02 0.00 -0.08 0.00 1.54 0.00 0.00 36.73 38.21 2dly h TYR 94 CO 0.00 0.00 0.68 1.88 -1.64 0.00 0.00 178.16 179.08 2dly h TYR 95 N -0.54 0.50 0.00 -3.82 0.05 -1.62 0.25 116.97 111.79 2dly h TYR 95 Ca 0.00 0.02 0.00 0.00 0.05 0.00 0.00 58.73 58.80 2dly h TYR 95 Cb 0.24 -0.15 0.00 0.00 1.01 0.00 0.00 36.73 37.84 2dly h TYR 95 CO -0.10 0.06 0.50 1.79 -1.05 0.00 0.00 178.16 179.36 2dly h THR 96 N 0.32 0.00 0.02 -2.88 1.35 -1.37 0.68 112.91 111.02 2dly h THR 96 Ca 0.56 0.00 -0.34 0.00 -0.55 0.00 0.00 66.41 66.08 2dly h THR 96 Cb 1.56 0.38 -0.05 0.00 -1.73 0.00 0.00 68.15 68.31 2dly h THR 96 CO -0.22 0.00 -2.05 0.35 -0.25 0.00 0.00 175.52 173.36 2dly n THR 97 N -2.51 1.55 -3.53 6.82 -2.24 0.88 -4.80 114.28 110.44 2dly n THR 97 Ca -0.01 -0.78 -0.18 0.00 -2.27 0.00 0.00 64.05 60.81 2dly n THR 97 Cb 0.53 -0.97 -0.06 0.00 -2.10 0.00 0.00 70.33 67.73 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 -2.55 0.00 -0.43 4.28 -1.32 0.24 -5.04 115.64 110.81 2dly s THR 98 Ca -0.12 0.00 -0.02 0.00 -1.21 0.00 0.00 61.69 60.35 2dly s THR 98 Cb 0.07 -1.00 0.24 0.00 -1.51 0.00 0.00 72.50 70.30 2dly s THR 98 CO 0.80 0.00 2.16 -1.54 -2.21 0.00 0.00 174.62 173.83 2dly n SER 99 N 0.97 6.76 -3.79 8.08 3.41 -1.26 -4.27 113.62 123.53 2dly n SER 99 Ca -0.19 -3.26 -0.33 0.00 -0.26 0.00 0.00 58.87 54.84 2dly n SER 99 Cb 0.57 -1.08 -0.13 0.00 -0.26 0.00 0.00 64.21 63.31 2dly n SER 99 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 2dly n ASP 100 N 0.16 0.06 0.00 4.04 -0.08 -1.26 0.23 116.55 119.71 2dly n ASP 100 Ca 0.41 0.08 0.00 0.00 -1.51 0.00 0.00 54.79 53.77 2dly n ASP 100 Cb 0.58 -0.73 0.00 0.00 2.34 0.00 0.00 41.12 43.30 2dly n ASP 100 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2dly n GLY 101 N 5.37 1.77 3.58 0.27 0.00 -1.26 -4.98 105.19 109.94 2dly n GLY 101 Ca 0.56 -0.21 -0.41 0.00 0.00 0.00 0.00 46.02 45.96 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 2.32 -0.26 0.99 4.77 0.14 -4.86 117.00 120.10 2dly n LEU 102 Ca 0.00 0.97 0.08 0.00 -0.03 0.00 0.00 56.01 57.03 2dly n LEU 102 Cb 0.00 -1.32 0.33 0.00 -2.33 0.00 0.00 43.42 40.10 2dly n LEU 102 CO 0.00 -1.81 1.23 0.00 -1.33 0.00 0.00 177.39 175.48 2dly s VAL 104 N -5.76 0.18 -0.03 0.00 0.11 -1.26 -5.08 120.40 108.56 2dly s VAL 104 Ca -0.10 -1.58 -0.18 0.00 -2.93 0.00 0.00 61.98 57.19 2dly s VAL 104 Cb 0.21 -1.51 -0.05 0.00 -1.53 0.00 0.00 36.38 33.49 2dly s VAL 104 CO 0.79 -0.80 0.51 -0.75 -3.33 0.00 0.00 175.10 171.52 2dly s LYS 105 N -3.91 4.22 -0.21 1.54 2.20 -1.26 -4.66 119.74 117.66 2dly s LYS 105 Ca 0.08 0.58 -0.29 0.00 -0.36 0.00 0.00 55.97 55.98 2dly s LYS 105 Cb 0.07 -3.33 -0.04 0.00 -1.51 0.00 0.00 37.83 33.01 2dly s LYS 105 CO -0.09 0.41 1.95 -0.51 -0.36 0.00 0.00 175.35 176.75 2dly s LEU 106 N -0.24 3.69 -0.06 5.43 1.43 -1.26 -4.72 118.68 122.94 2dly s LEU 106 Ca 0.28 1.80 -0.03 0.00 -1.03 0.00 0.00 54.13 55.14 2dly s LEU 106 Cb -0.17 -3.52 -0.01 0.00 0.03 0.00 0.00 46.19 42.52 2dly s LEU 106 CO 0.14 -1.62 -0.07 -0.33 0.23 0.00 0.00 176.35 174.70 2dly h GLU 107 N 12.98 0.00 -4.02 1.70 4.39 -1.89 -3.38 114.58 124.36 2dly h GLU 107 Ca -0.39 0.00 -0.16 0.00 0.34 0.00 0.00 59.36 59.16 2dly h GLU 107 Cb 1.20 0.00 -0.19 0.00 -0.10 0.00 0.00 28.75 29.66 2dly h GLU 107 CO 0.98 0.00 -0.68 0.15 -1.16 0.00 0.00 179.01 178.30 2dly s LYS 108 N -1.53 0.40 -0.05 2.33 1.02 -1.26 -5.04 119.74 115.59 2dly s LYS 108 Ca -0.06 -0.75 -0.30 0.00 0.02 0.00 0.00 55.97 54.89 2dly s LYS 108 Cb 0.01 0.14 -0.05 0.00 -0.52 0.00 0.00 37.83 37.41 2dly s LYS 108 CO 0.08 -0.07 1.49 -1.25 -0.92 0.00 0.00 175.35 174.69 2dly s PRO 109 N -2.07 4.22 0.39 -1.68 0.04 -1.26 -2.46 135.00 132.18 2dly s PRO 109 Ca -0.10 2.01 -0.13 0.00 0.04 0.00 0.00 61.00 62.82 2dly s PRO 109 Cb -0.05 -3.79 -0.11 0.00 0.04 0.00 0.00 34.50 30.58 2dly s PRO 109 CO -0.03 -0.73 -0.11 0.00 0.04 0.00 0.00 177.00 176.17 2dly n LEU 111 N 1.88 0.00 -3.67 0.00 4.77 -1.26 -4.64 117.00 114.07 2dly n LEU 111 Ca 0.06 -0.86 -0.27 0.00 -0.03 0.00 0.00 56.01 54.91 2dly n LEU 111 Cb 0.35 -0.67 -0.17 0.00 -2.33 0.00 0.00 43.42 40.60 2dly n LEU 111 CO 0.40 -1.50 -0.35 -0.54 -1.33 0.00 0.00 177.39 174.07 2dly s LYS 112 N -4.77 0.34 0.19 3.23 1.02 -1.26 -5.00 119.74 113.50 2dly s LYS 112 Ca 0.48 -0.24 -0.18 0.00 0.02 0.00 0.00 55.97 56.05 2dly s LYS 112 Cb -0.03 -1.96 -0.12 0.00 -0.52 0.00 0.00 37.83 35.20 2dly s LYS 112 CO 0.36 -0.65 0.26 -0.89 -0.92 0.00 0.00 175.35 173.51 2dly n ILE 113 N 5.17 1.09 -3.75 2.17 2.08 -1.26 -4.89 119.36 119.98 2dly n ILE 113 Ca -0.08 -0.36 -0.35 0.00 0.56 0.00 0.00 62.75 62.52 2dly n ILE 113 Cb 0.48 0.00 -0.10 0.00 -0.75 0.00 0.00 39.64 39.27 2dly n ILE 113 CO 0.00 0.00 0.00 -1.58 0.56 0.00 0.00 176.55 175.53 2dly s GLN 114 N -0.71 2.58 -0.07 0.38 0.74 -1.26 -5.07 119.66 116.24 2dly s GLN 114 Ca 0.44 -2.67 -0.26 0.00 0.05 0.00 0.00 55.36 52.92 2dly s GLN 114 Cb -0.59 -3.69 -0.03 0.00 1.10 0.00 0.00 33.01 29.80 2dly s GLN 114 CO 0.41 -1.18 0.83 0.08 -0.55 0.00 0.00 175.29 174.88 2dly s VAL 115 N -0.31 4.94 -0.08 1.34 1.01 -1.26 -4.96 120.40 121.07 2dly s VAL 115 Ca 0.19 1.70 -0.23 0.00 0.00 0.00 0.00 61.98 63.64 2dly s VAL 115 Cb -0.19 -4.16 -0.29 0.00 0.00 0.00 0.00 36.38 31.74 2dly s VAL 115 CO -0.04 0.16 0.81 -1.28 0.00 0.00 0.00 175.10 174.75 2dly h SER 116 N 6.93 0.35 -4.01 3.32 0.87 -2.05 -3.51 113.55 115.46 2dly h SER 116 Ca -0.38 -0.94 0.00 0.00 -1.23 0.00 0.00 61.79 59.24 2dly h SER 116 Cb 1.18 -0.11 0.00 0.00 -0.44 0.00 0.00 62.40 63.03 2dly h SER 116 CO 0.78 1.34 0.00 0.61 -0.53 0.00 0.00 176.83 179.03 2dly n GLY 117 N 1.66 -2.71 3.76 5.77 0.00 -1.26 -4.94 105.19 107.47 2dly n GLY 117 Ca -0.15 -1.29 -0.41 0.00 0.00 0.00 0.00 46.02 44.18 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 -4.30 4.45 0.07 1.61 0.04 -1.26 -5.05 135.00 130.57 2dly s PRO 118 Ca 0.00 2.05 0.08 0.00 0.04 0.00 0.00 61.00 63.17 2dly s PRO 118 Cb 0.00 -3.14 -0.03 0.00 0.04 0.00 0.00 34.50 31.37 2dly s PRO 118 CO 0.00 -0.09 -0.21 -1.54 0.04 0.00 0.00 177.00 175.20 2dly s SER 119 N -0.37 2.53 -0.63 6.66 1.04 -1.26 -5.04 113.70 116.63 2dly s SER 119 Ca 0.50 -0.60 -0.00 0.00 0.48 0.00 0.00 55.95 56.32 2dly s SER 119 Cb -0.37 -0.18 0.43 0.00 0.10 0.00 0.00 66.02 66.01 2dly s SER 119 CO 0.45 0.12 1.86 -0.24 0.98 0.00 0.00 173.24 176.41 2dly n SER 120 N 1.47 7.10 0.00 7.02 2.88 -1.26 -5.33 113.62 125.50 2dly n SER 120 Ca -0.18 -3.79 0.00 0.00 -1.33 0.00 0.00 58.87 53.57 2dly n SER 120 Cb 0.53 -0.87 0.00 0.00 -0.75 0.00 0.00 64.21 63.12 2dly n SER 120 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42