#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1yly h VAL 29 N 0.00 1.22 -0.03 0.00 3.04 -1.99 -2.20 116.25 116.28 1yly h VAL 29 Ca 0.00 -0.51 -0.00 0.00 -1.01 0.00 0.00 66.70 65.18 1yly h VAL 29 Cb 0.00 0.17 -0.00 0.00 -2.01 0.00 0.00 31.29 29.44 1yly h VAL 29 CO 0.00 0.24 0.02 1.56 -1.01 0.00 0.00 177.57 178.37 1yly h GLN 30 N 1.05 0.05 -0.83 4.17 1.08 -1.99 -0.44 115.11 118.20 1yly h GLN 30 Ca 0.27 -0.01 0.08 0.00 -1.45 0.00 0.00 58.65 57.55 1yly h GLN 30 Cb -0.01 -0.01 -0.07 0.00 -0.05 0.00 0.00 27.48 27.34 1yly h GLN 30 CO -0.05 0.15 0.48 1.96 -0.95 0.00 0.00 178.83 180.42 1yly h GLN 31 N -0.06 0.81 -0.41 1.46 4.20 -1.98 -1.29 115.11 117.84 1yly h GLN 31 Ca 0.01 -0.05 -0.12 0.00 0.06 0.00 0.00 58.65 58.56 1yly h GLN 31 Cb 0.12 -0.18 -0.01 0.00 0.30 0.00 0.00 27.48 27.70 1yly h GLN 31 CO -0.00 0.53 -0.20 0.87 -0.67 0.00 0.00 178.83 179.36 1yly h LYS 32 N 0.83 0.86 -0.58 1.46 1.57 -0.82 -0.75 116.57 119.14 1yly h LYS 32 Ca 0.39 -0.38 -0.09 0.00 -1.87 0.00 0.00 60.65 58.70 1yly h LYS 32 Cb 0.31 -0.02 -0.02 0.00 0.08 0.00 0.00 32.23 32.57 1yly h LYS 32 CO -0.23 1.02 0.03 -0.07 -0.57 0.00 0.00 179.45 179.63 1yly h LEU 33 N 0.67 0.98 -1.00 2.94 3.38 -0.81 -0.84 115.31 120.64 1yly h LEU 33 Ca 0.09 -0.29 -0.02 0.00 0.09 0.00 0.00 57.88 57.74 1yly h LEU 33 Cb 0.77 -0.26 -0.04 0.00 0.09 0.00 0.00 40.66 41.22 1yly h LEU 33 CO 0.06 1.03 0.38 0.00 0.09 0.00 0.00 178.44 180.01 1yly h ALA 34 N 0.98 1.22 -0.33 1.53 0.00 -1.00 -0.54 119.26 121.11 1yly h ALA 34 Ca 0.17 -0.14 -0.11 0.00 0.00 0.00 0.00 54.91 54.83 1yly h ALA 34 Cb 0.51 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 1yly h ALA 34 CO 0.02 0.60 -0.22 0.00 0.00 0.00 0.00 179.25 179.66 1yly h ALA 35 N 1.33 0.48 -0.28 0.00 0.00 -0.93 -0.08 119.26 119.79 1yly h ALA 35 Ca 0.27 -0.37 0.05 0.00 0.00 0.00 0.00 54.91 54.85 1yly h ALA 35 Cb 0.09 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 17.73 1yly h ALA 35 CO -0.04 0.44 0.01 1.25 0.00 0.00 0.00 179.25 180.91 1yly h LEU 36 N 0.51 -0.10 -0.40 0.00 5.85 -0.92 -1.29 115.31 118.96 1yly h LEU 36 Ca 0.07 0.06 0.05 0.00 0.84 0.00 0.00 57.88 58.90 1yly h LEU 36 Cb 0.77 0.11 -0.05 0.00 0.37 0.00 0.00 40.66 41.86 1yly h LEU 36 CO 0.06 -0.02 0.12 -0.08 -0.34 0.00 0.00 178.44 178.19 1yly h GLU 37 N 0.09 0.27 -0.62 1.25 4.81 -0.92 -1.59 114.58 117.87 1yly h GLU 37 Ca 0.13 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.35 1yly h GLU 37 Cb 0.17 -0.06 -0.03 0.00 0.63 0.00 0.00 28.75 29.46 1yly h GLU 37 CO -0.22 0.18 0.40 -0.22 -0.73 0.00 0.00 179.01 178.42 1yly h LYS 38 N 0.28 0.82 -0.30 1.92 3.64 -0.53 -1.44 116.57 120.96 1yly h LYS 38 Ca 0.19 -0.05 -0.02 0.00 -1.27 0.00 0.00 60.65 59.50 1yly h LYS 38 Cb 0.18 -0.18 -0.02 0.00 -0.41 0.00 0.00 32.23 31.81 1yly h LYS 38 CO -0.20 0.55 0.12 1.03 -2.27 0.00 0.00 179.45 178.67 1yly h SER 39 N 0.84 0.37 1.26 4.20 0.87 -0.91 -2.82 113.55 117.36 1yly h SER 39 Ca 0.23 -0.03 -0.06 0.00 -1.23 0.00 0.00 61.79 60.70 1yly h SER 39 Cb -0.08 -0.09 -0.01 0.00 -0.44 0.00 0.00 62.40 61.78 1yly h SER 39 CO -0.05 0.35 -0.27 0.77 -0.53 0.00 0.00 176.83 177.10 1yly h SER 40 N 0.42 0.00 0.00 6.23 4.64 -0.27 -3.47 113.55 121.09 1yly h SER 40 Ca 0.10 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.42 1yly h SER 40 Cb 0.09 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.18 1yly h SER 40 CO -0.01 0.27 0.00 0.61 -0.87 0.00 0.00 176.83 176.83 1yly n GLY 41 N 0.62 1.86 0.00 -0.77 0.00 -0.98 -4.99 105.19 100.93 1yly n GLY 41 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.03 1yly n GLY 41 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1yly n GLY 42 N -2.00 4.39 2.95 -0.02 0.00 -1.25 -4.59 105.19 104.67 1yly n GLY 42 Ca 0.00 -1.93 -0.28 0.00 0.00 0.00 0.00 46.02 43.81 1yly n GLY 42 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1yly s ARG 43 N 2.43 1.83 -0.10 1.61 3.52 -0.02 -4.82 118.95 123.41 1yly s ARG 43 Ca 0.00 -0.41 0.01 0.00 -0.13 0.00 0.00 55.73 55.20 1yly s ARG 43 Cb 0.00 -1.84 -0.02 0.00 -1.56 0.00 0.00 34.95 31.53 1yly s ARG 43 CO 0.00 -0.27 -0.12 -1.17 -0.81 0.00 0.00 175.30 172.93 1yly s LEU 44 N 1.61 2.84 -0.07 -0.88 2.96 -1.26 -1.51 118.68 122.37 1yly s LEU 44 Ca 0.05 -0.22 0.03 0.00 -0.22 0.00 0.00 54.13 53.76 1yly s LEU 44 Cb -0.13 -1.62 0.01 0.00 0.50 0.00 0.00 46.19 44.94 1yly s LEU 44 CO -0.09 0.25 -0.16 -0.83 -1.32 0.00 0.00 176.35 174.19 1yly s GLY 45 N -0.15 0.97 -0.02 7.98 0.00 0.23 -4.50 107.32 111.83 1yly s GLY 45 Ca -0.00 -0.61 0.02 0.00 0.00 0.00 0.00 44.72 44.13 1yly s GLY 45 CO 0.03 -0.08 -0.08 0.14 0.00 0.00 0.00 173.10 173.11 1yly s VAL 46 N 0.48 0.67 -0.06 1.40 1.01 0.25 -0.55 120.40 123.59 1yly s VAL 46 Ca -0.14 -0.32 -0.03 0.00 0.00 0.00 0.00 61.98 61.49 1yly s VAL 46 Cb -0.16 -0.59 0.04 0.00 0.00 0.00 0.00 36.38 35.67 1yly s VAL 46 CO 0.05 0.21 0.11 0.00 0.00 0.00 0.00 175.10 175.47 1yly s ALA 47 N 0.09 -0.01 -0.10 5.51 0.00 -0.54 -1.00 121.76 125.71 1yly s ALA 47 Ca -0.01 0.42 -0.00 0.00 0.00 0.00 0.00 51.96 52.36 1yly s ALA 47 Cb -0.06 -0.67 -0.03 0.00 0.00 0.00 0.00 23.12 22.36 1yly s ALA 47 CO 0.00 -0.47 -0.07 -1.17 0.00 0.00 0.00 175.76 174.05 1yly s LEU 48 N 2.05 3.11 -0.18 0.00 2.96 0.02 -1.02 118.68 125.63 1yly s LEU 48 Ca 0.02 -0.10 0.01 0.00 -0.22 0.00 0.00 54.13 53.84 1yly s LEU 48 Cb -0.12 -1.70 0.02 0.00 0.50 0.00 0.00 46.19 44.89 1yly s LEU 48 CO -0.05 0.28 -0.19 -0.63 -1.32 0.00 0.00 176.35 174.44 1yly s ILE 49 N -0.34 2.01 -0.44 6.68 1.01 0.13 -2.43 121.20 127.82 1yly s ILE 49 Ca 0.05 -0.91 -0.18 0.00 0.00 0.00 0.00 60.65 59.61 1yly s ILE 49 Cb -0.12 -1.82 0.03 0.00 0.01 0.00 0.00 42.46 40.56 1yly s ILE 49 CO 0.02 0.53 0.50 -0.62 0.00 0.00 0.00 174.94 175.37 1yly s ASP 50 N 1.30 6.21 0.00 3.58 -1.08 -0.05 -0.82 116.67 125.81 1yly s ASP 50 Ca 0.05 -0.72 0.26 0.00 -0.52 0.00 0.00 52.55 51.61 1yly s ASP 50 Cb -0.13 -2.25 1.40 0.00 -1.46 0.00 0.00 42.92 40.48 1yly s ASP 50 CO -0.12 -0.67 1.89 0.35 0.52 0.00 0.00 175.17 177.14 1yly n THR 51 N 5.51 0.12 -0.14 1.71 -2.24 -0.65 -0.32 114.28 118.27 1yly n THR 51 Ca -0.07 0.03 -0.08 0.00 -2.27 0.00 0.00 64.05 61.66 1yly n THR 51 Cb 0.47 -0.61 0.00 0.00 -2.10 0.00 0.00 70.33 68.09 1yly n THR 51 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1yly h ALA 52 N 3.37 0.53 0.00 6.98 0.00 -1.82 -3.37 119.26 124.96 1yly h ALA 52 Ca 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.86 1yly h ALA 52 Cb 0.15 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 17.78 1yly h ALA 52 CO 0.00 0.01 0.00 -0.40 0.00 0.00 0.00 179.25 178.86 1yly n ASP 53 N -4.77 0.70 -1.57 0.00 5.68 -1.14 -5.01 116.55 110.44 1yly n ASP 53 Ca 0.01 -1.34 -0.19 0.00 -0.50 0.00 0.00 54.79 52.77 1yly n ASP 53 Cb 0.04 0.00 -0.08 0.00 -1.14 0.00 0.00 41.12 39.95 1yly n ASP 53 CO 0.00 0.00 0.00 0.59 -1.33 0.00 0.00 177.20 176.46 1yly n ASN 54 N -0.17 -4.90 -4.82 -1.12 3.02 0.56 -4.98 115.26 102.85 1yly n ASN 54 Ca 0.00 0.44 -0.31 0.00 -0.03 0.00 0.00 54.58 54.68 1yly n ASN 54 Cb 0.40 -4.37 0.06 0.00 -0.61 0.00 0.00 39.78 35.26 1yly n ASN 54 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 1yly s THR 55 N -2.58 3.91 0.04 3.41 -4.23 -1.19 -4.79 115.64 110.20 1yly s THR 55 Ca 0.00 0.62 0.01 0.00 -1.18 0.00 0.00 61.69 61.14 1yly s THR 55 Cb 0.00 -3.36 -0.02 0.00 1.34 0.00 0.00 72.50 70.46 1yly s THR 55 CO 0.00 -0.81 -0.06 -1.10 -0.54 0.00 0.00 174.62 172.11 1yly s GLN 56 N -5.06 0.46 -0.11 3.99 -0.21 -1.26 -0.87 119.66 116.61 1yly s GLN 56 Ca 0.58 -0.72 0.01 0.00 0.02 0.00 0.00 55.36 55.26 1yly s GLN 56 Cb -0.14 -0.16 0.02 0.00 1.00 0.00 0.00 33.01 33.73 1yly s GLN 56 CO 0.55 0.02 -0.14 0.08 -2.12 0.00 0.00 175.29 173.67 1yly s VAL 57 N -1.46 1.42 -0.01 1.09 1.01 -1.02 -4.98 120.40 116.45 1yly s VAL 57 Ca -0.12 -0.59 0.05 0.00 0.00 0.00 0.00 61.98 61.33 1yly s VAL 57 Cb -0.10 -1.32 -0.01 0.00 0.00 0.00 0.00 36.38 34.95 1yly s VAL 57 CO -0.00 0.43 -0.16 -0.76 0.00 0.00 0.00 175.10 174.60 1yly s LEU 59 N 1.11 2.03 -0.08 3.92 1.43 -1.26 -0.80 118.68 125.03 1yly s LEU 59 Ca -0.04 -0.29 -0.03 0.00 -1.03 0.00 0.00 54.13 52.73 1yly s LEU 59 Cb -0.14 -0.84 0.04 0.00 0.03 0.00 0.00 46.19 45.28 1yly s LEU 59 CO -0.03 0.20 0.06 -0.47 0.23 0.00 0.00 176.35 176.34 1yly s TYR 60 N -0.38 0.17 -1.59 0.29 5.04 -0.17 -4.76 117.35 115.95 1yly s TYR 60 Ca 0.06 0.05 -0.16 0.00 -2.44 0.00 0.00 57.07 54.58 1yly s TYR 60 Cb -0.06 -0.58 0.12 0.00 0.35 0.00 0.00 41.96 41.80 1yly s TYR 60 CO -0.01 -0.30 0.82 0.54 -1.34 0.00 0.00 175.55 175.27 1yly n ARG 61 N 5.28 -4.04 0.29 4.97 1.74 -1.26 -0.58 116.66 123.05 1yly n ARG 61 Ca -0.05 0.47 0.17 0.00 -0.77 0.00 0.00 57.85 57.67 1yly n ARG 61 Cb 0.50 -5.26 0.83 0.00 -1.02 0.00 0.00 32.46 27.51 1yly n ARG 61 CO 0.00 0.00 0.00 0.78 -1.52 0.00 0.00 177.63 176.89 1yly h GLY 62 N -1.63 0.00 -1.30 -0.13 0.00 -1.86 -2.49 103.07 95.67 1yly h GLY 62 Ca -0.56 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.77 1yly h GLY 62 CO 0.71 0.00 0.00 1.22 0.00 0.00 0.00 176.54 178.47 1yly n ASP 63 N -3.26 2.88 -4.83 0.19 8.00 -1.26 -1.02 116.55 117.24 1yly n ASP 63 Ca -0.01 -1.95 -0.34 0.00 0.71 0.00 0.00 54.79 53.20 1yly n ASP 63 Cb 0.23 -0.22 -0.06 0.00 -0.02 0.00 0.00 41.12 41.05 1yly n ASP 63 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 1yly s GLU 64 N -1.00 4.12 0.22 -1.24 2.02 -0.94 -4.92 118.70 116.95 1yly s GLU 64 Ca 0.23 0.78 -0.30 0.00 0.02 0.00 0.00 54.97 55.71 1yly s GLU 64 Cb 0.12 -2.57 -0.08 0.00 0.10 0.00 0.00 34.13 31.69 1yly s GLU 64 CO 0.16 0.23 0.99 1.03 0.02 0.00 0.00 175.26 177.69 1yly s ARG 65 N -2.63 4.76 0.05 1.61 0.52 -1.26 -4.07 118.95 117.93 1yly s ARG 65 Ca 0.51 1.56 0.04 0.00 -0.52 0.00 0.00 55.73 57.32 1yly s ARG 65 Cb -0.13 -3.28 -0.02 0.00 0.52 0.00 0.00 34.95 32.04 1yly s ARG 65 CO 0.18 0.36 -0.13 -0.06 0.02 0.00 0.00 175.30 175.68 1yly s PHE 66 N -0.85 1.09 0.02 -0.53 0.40 -0.19 -4.96 117.98 112.96 1yly s PHE 66 Ca 0.44 -0.40 -0.30 0.00 -0.60 0.00 0.00 56.93 56.06 1yly s PHE 66 Cb -0.27 -0.64 -0.07 0.00 0.51 0.00 0.00 43.02 42.55 1yly s PHE 66 CO 0.33 0.02 1.59 -2.14 0.70 0.00 0.00 175.22 175.72 1yly s PRO 67 N -1.37 4.22 0.26 0.24 0.02 -1.26 -2.27 135.00 134.84 1yly s PRO 67 Ca -0.01 2.20 0.06 0.00 0.02 0.00 0.00 61.00 63.27 1yly s PRO 67 Cb -0.09 -3.69 0.32 0.00 0.02 0.00 0.00 34.50 31.06 1yly s PRO 67 CO 0.01 -0.72 1.60 0.52 -0.33 0.00 0.00 177.00 178.08 1yly h MET 68 N 8.49 0.19 0.00 5.54 2.86 -1.60 -3.48 114.93 126.93 1yly h MET 68 Ca -0.40 -0.12 0.00 0.00 -2.06 0.00 0.00 59.70 57.11 1yly h MET 68 Cb 1.19 0.02 0.00 0.00 0.06 0.00 0.00 31.60 32.86 1yly h MET 68 CO 0.93 0.70 0.00 0.00 1.06 0.00 0.00 176.91 179.60 1yly n SER 70 N -0.70 0.00 0.30 0.00 7.64 -1.26 -1.88 113.62 117.72 1yly n SER 70 Ca 0.00 0.03 0.19 0.00 1.01 0.00 0.00 58.87 60.09 1yly n SER 70 Cb 0.00 -0.27 0.92 0.00 -1.01 0.00 0.00 64.21 63.85 1yly n SER 70 CO 0.00 0.00 0.00 0.71 -3.01 0.00 0.00 175.04 172.74 1yly h THR 71 N 0.00 0.13 0.00 0.44 1.35 -1.40 -1.16 112.91 112.26 1yly h THR 71 Ca 0.00 -0.30 0.00 0.00 -0.55 0.00 0.00 66.41 65.56 1yly h THR 71 Cb 0.14 1.26 0.00 0.00 -1.73 0.00 0.00 68.15 67.82 1yly h THR 71 CO 0.00 0.03 0.00 0.77 -0.25 0.00 0.00 175.52 176.07 1yly h SER 72 N 0.00 0.00 0.59 5.36 4.64 -1.53 -2.85 113.55 119.75 1yly h SER 72 Ca -0.00 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.30 1yly h SER 72 Cb 0.25 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.34 1yly h SER 72 CO 0.00 0.00 -0.10 0.11 -0.87 0.00 0.00 176.83 175.97 1yly h LYS 73 N 0.00 0.00 -0.36 4.77 1.57 -1.43 -2.33 116.57 118.79 1yly h LYS 73 Ca 0.00 0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.75 1yly h LYS 73 Cb 0.11 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.40 1yly h LYS 73 CO 0.00 0.10 0.12 0.28 -0.57 0.00 0.00 179.45 179.38 1yly h VAL 74 N 0.00 1.21 -0.87 0.50 2.07 -1.70 -0.78 116.25 116.67 1yly h VAL 74 Ca -0.00 -0.67 -0.02 0.00 0.82 0.00 0.00 66.70 66.83 1yly h VAL 74 Cb 0.43 0.96 -0.04 0.00 -1.52 0.00 0.00 31.29 31.12 1yly h VAL 74 CO 0.01 0.23 0.45 -0.03 0.02 0.00 0.00 177.57 178.26 1yly h MET 75 N 0.44 1.23 -0.23 1.57 1.85 -1.62 -0.83 114.93 117.33 1yly h MET 75 Ca 0.12 -0.16 -0.05 0.00 -0.61 0.00 0.00 59.70 59.00 1yly h MET 75 Cb 0.24 -0.23 -0.01 0.00 0.43 0.00 0.00 31.60 32.03 1yly h MET 75 CO -0.00 0.92 -0.05 0.00 -0.40 0.00 0.00 176.91 177.37 1yly h ALA 76 N 1.25 0.32 -0.70 0.39 0.00 -1.32 -0.43 119.26 118.76 1yly h ALA 76 Ca 0.30 -0.26 -0.03 0.00 0.00 0.00 0.00 54.91 54.93 1yly h ALA 76 Cb 0.06 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 17.74 1yly h ALA 76 CO -0.04 0.10 0.33 0.00 0.00 0.00 0.00 179.25 179.64 1yly h ALA 77 N 0.76 0.90 -0.63 0.00 0.00 -1.04 -2.08 119.26 117.17 1yly h ALA 77 Ca 0.06 -0.15 -0.05 0.00 0.00 0.00 0.00 54.91 54.78 1yly h ALA 77 Cb 0.50 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 17.98 1yly h ALA 77 CO 0.02 0.47 0.20 0.00 0.00 0.00 0.00 179.25 179.95 1yly h ALA 78 N 1.16 1.17 -0.81 0.00 0.00 -1.02 -0.38 119.26 119.38 1yly h ALA 78 Ca 0.24 -0.20 -0.03 0.00 0.00 0.00 0.00 54.91 54.92 1yly h ALA 78 Cb 0.12 -0.25 -0.04 0.00 0.00 0.00 0.00 17.79 17.63 1yly h ALA 78 CO -0.03 0.58 0.38 0.00 0.00 0.00 0.00 179.25 180.18 1yly h ALA 79 N 1.30 1.04 -0.49 0.00 0.00 -0.66 0.70 119.26 121.14 1yly h ALA 79 Ca 0.21 -0.17 -0.13 0.00 0.00 0.00 0.00 54.91 54.82 1yly h ALA 79 Cb 0.25 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 1yly h ALA 79 CO -0.01 0.62 -0.21 0.28 0.00 0.00 0.00 179.25 179.93 1yly h VAL 80 N 1.15 1.27 -0.65 0.00 2.07 -0.99 -1.32 116.25 117.77 1yly h VAL 80 Ca 0.28 -1.38 0.05 0.00 0.82 0.00 0.00 66.70 66.47 1yly h VAL 80 Cb 0.14 1.11 -0.05 0.00 -1.52 0.00 0.00 31.29 30.97 1yly h VAL 80 CO -0.03 0.48 0.38 -0.07 0.02 0.00 0.00 177.57 178.34 1yly h LEU 81 N 0.87 0.58 -0.68 2.57 3.38 -0.64 -0.62 115.31 120.75 1yly h LEU 81 Ca 0.11 0.02 -0.00 0.00 0.09 0.00 0.00 57.88 58.10 1yly h LEU 81 Cb 0.79 -0.10 -0.03 0.00 0.09 0.00 0.00 40.66 41.41 1yly h LEU 81 CO 0.07 0.39 0.43 0.50 0.09 0.00 0.00 178.44 179.91 1yly h LYS 82 N 0.71 0.92 -0.95 1.13 1.63 -0.59 -1.88 116.57 117.54 1yly h LYS 82 Ca 0.28 -0.07 0.05 0.00 -0.85 0.00 0.00 60.65 60.06 1yly h LYS 82 Cb 0.12 -0.20 -0.06 0.00 -0.60 0.00 0.00 32.23 31.50 1yly h LYS 82 CO -0.15 0.64 0.62 1.96 -3.45 0.00 0.00 179.45 179.06 1yly h GLN 83 N 0.93 1.10 0.00 1.90 4.20 -0.59 -1.78 115.11 120.87 1yly h GLN 83 Ca 0.25 -0.07 0.00 0.00 0.06 0.00 0.00 58.65 58.89 1yly h GLN 83 Cb -0.06 -0.25 0.00 0.00 0.30 0.00 0.00 27.48 27.48 1yly h GLN 83 CO -0.05 0.73 0.00 -1.13 -0.67 0.00 0.00 178.83 177.71 1yly n SER 84 N -4.47 0.25 0.25 1.46 3.41 -0.30 -1.36 113.62 112.85 1yly n SER 84 Ca 0.14 0.57 0.11 0.00 -0.26 0.00 0.00 58.87 59.43 1yly n SER 84 Cb 0.15 -0.62 0.62 0.00 -0.26 0.00 0.00 64.21 64.11 1yly n SER 84 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 1yly h GLU 85 N 0.00 0.00 0.00 4.33 5.08 -1.05 -3.34 114.58 119.60 1yly h GLU 85 Ca 0.00 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.34 1yly h GLU 85 Cb 0.26 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.51 1yly h GLU 85 CO 0.00 0.17 -1.10 0.25 -1.00 0.00 0.00 179.01 177.32 1yly n THR 86 N -3.59 0.07 -3.33 1.13 -2.24 -0.71 -4.78 114.28 100.84 1yly n THR 86 Ca -0.01 -0.06 -0.46 0.00 -2.27 0.00 0.00 64.05 61.25 1yly n THR 86 Cb 0.31 -0.32 -0.01 0.00 -2.10 0.00 0.00 70.33 68.21 1yly n THR 86 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 1yly s GLN 87 N -2.08 4.01 0.62 -0.78 -0.21 -0.47 -4.94 119.66 115.82 1yly s GLN 87 Ca -0.01 -2.97 0.36 0.00 0.02 0.00 0.00 55.36 52.77 1yly s GLN 87 Cb 0.01 -4.53 2.09 0.00 1.00 0.00 0.00 33.01 31.58 1yly s GLN 87 CO 0.07 -1.27 2.31 0.87 -2.12 0.00 0.00 175.29 175.15 1yly h LYS 88 N 7.03 0.00 -0.36 2.91 1.57 -1.86 -1.78 116.57 124.09 1yly h LYS 88 Ca 0.16 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.94 1yly h LYS 88 Cb 0.93 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.24 1yly h LYS 88 CO 0.94 0.00 0.00 1.04 -0.57 0.00 0.00 179.45 180.86 1yly n GLN 89 N -3.51 3.31 -0.17 3.15 3.00 -1.26 -4.71 117.38 117.19 1yly n GLN 89 Ca -0.03 -2.77 -0.08 0.00 -0.01 0.00 0.00 57.00 54.11 1yly n GLN 89 Cb 0.08 -1.82 0.01 0.00 0.00 0.00 0.00 30.24 28.51 1yly n GLN 89 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.06 178.31 1yly h LEU 90 N 2.42 0.63 -1.85 1.08 5.85 -1.65 -3.11 115.31 118.67 1yly h LEU 90 Ca 0.00 -0.12 -0.02 0.00 0.84 0.00 0.00 57.88 58.58 1yly h LEU 90 Cb 1.41 -0.16 -0.00 0.00 0.37 0.00 0.00 40.66 42.28 1yly h LEU 90 CO 0.23 0.57 -0.10 -0.07 -0.34 0.00 0.00 178.44 178.74 1yly h LEU 91 N 0.63 0.00 -2.83 2.25 3.38 -1.84 -1.68 115.31 115.22 1yly h LEU 91 Ca 0.17 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.14 1yly h LEU 91 Cb 0.11 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.86 1yly h LEU 91 CO -0.02 0.10 0.00 0.59 0.09 0.00 0.00 178.44 179.19 1yly n ASN 92 N -3.42 4.19 -4.67 -0.43 3.02 -1.18 -0.87 115.26 111.91 1yly n ASN 92 Ca -0.01 -2.12 -0.42 0.00 -0.03 0.00 0.00 54.58 52.00 1yly n ASN 92 Cb 0.26 -0.52 -0.03 0.00 -0.61 0.00 0.00 39.78 38.88 1yly n ASN 92 CO 0.00 0.00 0.00 -1.58 -2.62 0.00 0.00 177.26 173.06 1yly s GLN 93 N -1.23 4.15 0.28 3.52 0.74 -0.63 -4.80 119.66 121.70 1yly s GLN 93 Ca 0.50 2.52 -0.29 0.00 0.05 0.00 0.00 55.36 58.14 1yly s GLN 93 Cb 0.28 -4.03 -0.10 0.00 1.10 0.00 0.00 33.01 30.25 1yly s GLN 93 CO 0.31 -0.91 1.35 -2.14 -0.55 0.00 0.00 175.29 173.35 1yly s PRO 94 N 4.09 4.34 -0.10 1.67 0.02 -1.26 -2.40 135.00 141.36 1yly s PRO 94 Ca 0.84 2.21 0.03 0.00 0.02 0.00 0.00 61.00 64.10 1yly s PRO 94 Cb -0.41 -3.10 0.01 0.00 0.02 0.00 0.00 34.50 31.02 1yly s PRO 94 CO 0.38 -0.26 -0.17 0.08 -0.33 0.00 0.00 177.00 176.69 1yly s VAL 95 N -0.60 1.60 0.22 3.83 1.01 0.78 -4.95 120.40 122.29 1yly s VAL 95 Ca 0.53 -0.73 -0.30 0.00 0.00 0.00 0.00 61.98 61.48 1yly s VAL 95 Cb -0.40 -1.43 -0.09 0.00 0.00 0.00 0.00 36.38 34.46 1yly s VAL 95 CO 0.48 0.46 1.38 -1.61 0.00 0.00 0.00 175.10 175.80 1yly s GLU 96 N 0.72 4.32 -0.30 2.72 2.02 -1.26 -1.57 118.70 125.36 1yly s GLU 96 Ca -0.12 2.18 -0.05 0.00 0.02 0.00 0.00 54.97 57.00 1yly s GLU 96 Cb -0.16 -3.15 0.02 0.00 0.10 0.00 0.00 34.13 30.94 1yly s GLU 96 CO 0.03 -0.34 0.06 0.42 0.02 0.00 0.00 175.26 175.44 1yly s ILE 97 N 0.07 3.65 0.10 -1.63 -1.09 -0.38 -4.93 121.20 116.99 1yly s ILE 97 Ca 0.58 -0.92 0.04 0.00 -2.23 0.00 0.00 60.65 58.12 1yly s ILE 97 Cb -0.39 -2.94 -0.04 0.00 -1.58 0.00 0.00 42.46 37.51 1yly s ILE 97 CO 0.41 0.02 0.08 -0.54 -1.23 0.00 0.00 174.94 173.67 1yly s LYS 98 N 1.42 2.83 0.39 2.79 1.02 -1.26 -0.75 119.74 126.18 1yly s LYS 98 Ca 0.00 -0.76 0.16 0.00 0.02 0.00 0.00 55.97 55.40 1yly s LYS 98 Cb -0.18 -2.68 1.04 0.00 -0.52 0.00 0.00 37.83 35.49 1yly s LYS 98 CO 0.01 0.54 1.79 -1.35 -0.92 0.00 0.00 175.35 175.42 1yly h PRO 99 N 3.10 0.45 0.00 -1.68 0.11 -1.97 0.18 132.00 132.19 1yly h PRO 99 Ca -0.47 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.61 1yly h PRO 99 Cb 1.17 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.18 1yly h PRO 99 CO 0.64 0.30 0.00 0.00 -0.21 0.00 0.00 178.00 178.73 1yly n ALA 100 N -2.46 1.73 0.19 -0.75 0.00 -1.26 -2.62 120.51 115.34 1yly n ALA 100 Ca 0.23 -0.01 0.08 0.00 0.00 0.00 0.00 53.44 53.75 1yly n ALA 100 Cb 0.78 -1.30 0.20 0.00 0.00 0.00 0.00 19.45 19.13 1yly n ALA 100 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 1yly h ASP 101 N 0.00 0.00 -3.91 0.00 3.32 -1.04 -3.45 116.42 111.34 1yly h ASP 101 Ca 0.00 0.00 -0.53 0.00 0.02 0.00 0.00 57.03 56.52 1yly h ASP 101 Cb 0.31 0.00 0.08 0.00 0.22 0.00 0.00 39.33 39.95 1yly h ASP 101 CO 0.00 0.23 0.68 -0.76 -1.72 0.00 0.00 179.24 177.67 1yly s LEU 102 N -6.39 4.37 0.00 1.55 1.43 -1.08 -4.81 118.68 113.75 1yly s LEU 102 Ca 0.04 2.81 0.00 0.00 -1.03 0.00 0.00 54.13 55.95 1yly s LEU 102 Cb 0.07 -3.68 0.00 0.00 0.03 0.00 0.00 46.19 42.61 1yly s LEU 102 CO 0.68 -0.69 0.00 1.33 0.23 0.00 0.00 176.35 177.91 1yly n VAL 103 N 0.61 0.00 0.09 -1.59 0.24 -1.26 -5.04 118.33 111.37 1yly n VAL 103 Ca 0.01 0.00 0.01 0.00 -2.04 0.00 0.00 64.34 62.31 1yly n VAL 103 Cb 0.41 0.00 -0.03 0.00 -1.47 0.00 0.00 33.84 32.75 1yly n VAL 103 CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 1yly h ASN 104 N 0.00 0.00 -1.83 -1.34 -1.07 -1.94 -3.44 115.58 105.96 1yly h ASN 104 Ca 0.00 0.00 -0.14 0.00 0.07 0.00 0.00 56.30 56.23 1yly h ASN 104 Cb 0.00 0.00 -0.29 0.00 -2.07 0.00 0.00 38.32 35.96 1yly h ASN 104 CO 0.00 0.57 -0.48 -0.47 0.07 0.00 0.00 177.43 177.12 1yly s TYR 105 N -2.93 -0.88 -0.43 4.14 6.04 -1.26 -5.06 117.35 116.97 1yly s TYR 105 Ca 0.01 0.80 0.08 0.00 0.04 0.00 0.00 57.07 58.00 1yly s TYR 105 Cb 0.08 0.02 0.28 0.00 -1.04 0.00 0.00 41.96 41.30 1yly s TYR 105 CO 0.78 -0.76 0.79 0.27 -1.54 0.00 0.00 175.55 175.08 1yly n ASN 106 N 5.37 -1.06 0.28 4.32 0.23 -1.26 -1.20 115.26 121.94 1yly n ASN 106 Ca -0.03 -3.13 0.13 0.00 -0.53 0.00 0.00 54.58 51.02 1yly n ASN 106 Cb 0.50 0.58 0.81 0.00 -2.08 0.00 0.00 39.78 39.59 1yly n ASN 106 CO 0.00 0.00 0.00 1.55 -0.93 0.00 0.00 177.26 177.88 1yly h PRO 107 N 3.59 0.00 0.00 -0.53 0.13 -1.92 -1.88 132.00 131.39 1yly h PRO 107 Ca -0.02 0.00 -0.41 0.00 -0.87 0.00 0.00 66.00 64.71 1yly h PRO 107 Cb 0.98 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 32.05 1yly h PRO 107 CO 0.37 0.06 -2.42 -0.89 -0.23 0.00 0.00 178.00 174.89 1yly n ILE 108 N -3.81 1.41 0.19 -3.56 2.08 -1.26 -4.54 119.36 109.86 1yly n ILE 108 Ca -0.03 -0.43 0.06 0.00 0.56 0.00 0.00 62.75 62.91 1yly n ILE 108 Cb 0.15 -1.64 0.52 0.00 -0.75 0.00 0.00 39.64 37.92 1yly n ILE 108 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 1yly h ALA 109 N -0.54 1.78 0.00 -1.39 0.00 -1.95 -1.35 119.26 115.80 1yly h ALA 109 Ca -0.61 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.20 1yly h ALA 109 Cb 1.68 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 19.43 1yly h ALA 109 CO -0.27 0.17 -0.04 1.05 0.00 0.00 0.00 179.25 180.17 1yly h GLU 110 N 0.12 0.00 0.00 0.00 4.11 -1.58 -0.17 114.58 117.06 1yly h GLU 110 Ca 0.03 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.46 1yly h GLU 110 Cb 0.16 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.41 1yly h GLU 110 CO 0.01 0.04 0.00 0.87 0.07 0.00 0.00 179.01 179.99 1yly h LYS 111 N 0.00 0.00 0.00 1.06 1.57 -1.50 -3.30 116.57 114.40 1yly h LYS 111 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1yly h LYS 111 Cb 0.21 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.52 1yly h LYS 111 CO 0.00 0.00 -0.01 0.72 -0.57 0.00 0.00 179.45 179.59 1yly n HIS 112 N -2.66 0.00 -1.76 -1.35 8.25 -0.09 -5.02 115.22 112.58 1yly n HIS 112 Ca 0.02 -0.70 -0.38 0.00 -0.26 0.00 0.00 57.72 56.41 1yly n HIS 112 Cb 0.34 -0.09 0.05 0.00 1.12 0.00 0.00 29.99 31.40 1yly n HIS 112 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 1yly s VAL 113 N -1.79 2.02 -1.57 1.59 1.01 -1.10 -1.20 120.40 119.36 1yly s VAL 113 Ca 0.14 0.02 -0.01 0.00 0.00 0.00 0.00 61.98 62.13 1yly s VAL 113 Cb 0.13 -3.01 0.00 0.00 0.00 0.00 0.00 36.38 33.50 1yly s VAL 113 CO 0.01 -0.00 0.12 0.59 0.00 0.00 0.00 175.10 175.83 1yly n ASN 114 N -1.18 -5.43 0.00 3.32 3.02 0.08 -4.92 115.26 110.14 1yly n ASN 114 Ca 0.11 -0.03 0.00 0.00 -0.03 0.00 0.00 54.58 54.63 1yly n ASN 114 Cb 0.45 -4.51 0.00 0.00 -0.61 0.00 0.00 39.78 35.11 1yly n ASN 114 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1yly n GLY 115 N -1.06 4.37 3.14 7.41 0.00 -0.34 -5.03 105.19 113.68 1yly n GLY 115 Ca -0.19 -0.91 -0.09 0.00 0.00 0.00 0.00 46.02 44.82 1yly n GLY 115 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1yly s THR 116 N -0.58 0.46 0.03 2.61 -4.23 -1.25 -1.25 115.64 111.44 1yly s THR 116 Ca 0.00 -1.89 0.02 0.00 -1.18 0.00 0.00 61.69 58.64 1yly s THR 116 Cb 0.00 -1.70 -0.02 0.00 1.34 0.00 0.00 72.50 72.12 1yly s THR 116 CO 0.00 -0.85 -0.08 -0.04 -0.54 0.00 0.00 174.62 173.12 1yly s MET 117 N -3.89 0.54 0.65 3.99 -1.94 -0.61 -4.91 119.30 113.13 1yly s MET 117 Ca 0.12 -0.63 -0.09 0.00 -1.71 0.00 0.00 55.69 53.39 1yly s MET 117 Cb 0.07 -0.38 0.01 0.00 2.01 0.00 0.00 34.83 36.53 1yly s MET 117 CO -0.05 0.08 1.00 0.95 -0.01 0.00 0.00 175.02 176.99 1yly s THR 118 N -1.04 3.56 0.44 2.05 -4.23 -1.26 -0.16 115.64 114.99 1yly s THR 118 Ca -0.06 0.24 0.12 0.00 -1.18 0.00 0.00 61.69 60.81 1yly s THR 118 Cb -0.08 -3.46 0.21 0.00 1.34 0.00 0.00 72.50 70.51 1yly s THR 118 CO 0.00 -0.54 2.02 -0.07 -0.54 0.00 0.00 174.62 175.49 1yly h LEU 119 N -0.42 0.15 -0.32 4.79 3.38 -1.14 0.11 115.31 121.86 1yly h LEU 119 Ca -0.45 -0.02 -0.03 0.00 0.09 0.00 0.00 57.88 57.47 1yly h LEU 119 Cb 1.26 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 41.95 1yly h LEU 119 CO 0.62 0.23 0.08 0.00 0.09 0.00 0.00 178.44 179.46 1yly h ALA 120 N 1.79 0.42 -0.63 1.53 0.00 -1.31 -0.24 119.26 120.81 1yly h ALA 120 Ca 0.04 -0.17 -0.04 0.00 0.00 0.00 0.00 54.91 54.74 1yly h ALA 120 Cb 0.20 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.84 1yly h ALA 120 CO 0.01 0.08 0.25 0.93 0.00 0.00 0.00 179.25 180.52 1yly h GLU 121 N 0.35 0.93 -0.51 0.00 5.08 -1.56 -0.66 114.58 118.21 1yly h GLU 121 Ca 0.10 -0.15 -0.12 0.00 -1.00 0.00 0.00 59.36 58.18 1yly h GLU 121 Cb 0.29 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 29.37 1yly h GLU 121 CO 0.00 0.77 -0.16 -0.07 -1.00 0.00 0.00 179.01 178.54 1yly h LEU 122 N 0.91 1.03 -0.33 1.33 3.38 -0.66 -0.77 115.31 120.21 1yly h LEU 122 Ca 0.21 -0.37 -0.00 0.00 0.09 0.00 0.00 57.88 57.81 1yly h LEU 122 Cb 0.19 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.64 1yly h LEU 122 CO -0.02 1.17 0.19 0.28 0.09 0.00 0.00 178.44 180.15 1yly h SER 123 N 0.88 0.40 -0.67 -0.43 0.02 -0.63 0.30 113.55 113.42 1yly h SER 123 Ca 0.12 -0.07 -0.02 0.00 -0.84 0.00 0.00 61.79 60.98 1yly h SER 123 Cb 0.74 -0.10 -0.03 0.00 0.14 0.00 0.00 62.40 63.15 1yly h SER 123 CO 0.06 0.35 0.33 0.00 -1.14 0.00 0.00 176.83 176.43 1yly h ALA 124 N 1.06 0.86 -0.43 3.77 0.00 -1.02 -0.88 119.26 122.63 1yly h ALA 124 Ca 0.12 -0.14 -0.07 0.00 0.00 0.00 0.00 54.91 54.81 1yly h ALA 124 Cb 0.03 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.54 1yly h ALA 124 CO -0.02 0.42 -0.02 0.00 0.00 0.00 0.00 179.25 179.64 1yly h ALA 125 N 1.15 0.59 -0.50 0.00 0.00 -0.95 0.16 119.26 119.71 1yly h ALA 125 Ca 0.23 -0.28 0.01 0.00 0.00 0.00 0.00 54.91 54.88 1yly h ALA 125 Cb 0.11 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.71 1yly h ALA 125 CO -0.03 0.39 0.31 0.00 0.00 0.00 0.00 179.25 179.92 1yly h ALA 126 N 0.89 0.63 0.12 0.00 0.00 -0.71 -2.10 119.26 118.09 1yly h ALA 126 Ca 0.12 -0.02 -0.16 0.00 0.00 0.00 0.00 54.91 54.85 1yly h ALA 126 Cb 0.52 -0.17 0.02 0.00 0.00 0.00 0.00 17.79 18.15 1yly h ALA 126 CO 0.03 0.03 -0.70 -0.07 0.00 0.00 0.00 179.25 178.54 1yly h LEU 127 N 0.63 0.42 0.00 0.00 3.38 -1.04 -2.26 115.31 116.44 1yly h LEU 127 Ca 0.19 -0.95 -0.00 0.00 0.09 0.00 0.00 57.88 57.21 1yly h LEU 127 Cb -0.03 -0.14 -0.00 0.00 0.09 0.00 0.00 40.66 40.58 1yly h LEU 127 CO -0.06 1.33 -1.01 0.00 0.09 0.00 0.00 178.44 178.79 1yly n GLN 128 N -4.19 0.61 0.00 1.13 6.02 0.55 -4.17 117.38 117.33 1yly n GLN 128 Ca -0.13 0.12 0.00 0.00 -0.01 0.00 0.00 57.00 56.98 1yly n GLN 128 Cb 0.77 -1.83 0.00 0.00 1.02 0.00 0.00 30.24 30.20 1yly n GLN 128 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.06 176.71 1yly n TYR 129 N -2.68 0.00 -3.76 1.08 4.02 -0.84 -1.88 117.16 113.11 1yly n TYR 129 Ca -0.00 0.00 -0.27 0.00 -0.01 0.00 0.00 57.90 57.62 1yly n TYR 129 Cb 0.55 0.00 0.05 0.00 -0.02 0.00 0.00 39.34 39.93 1yly n TYR 129 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 176.86 176.30 1yly n SER 130 N -0.56 -5.37 -4.69 7.72 2.88 -0.85 -4.92 113.62 107.83 1yly n SER 130 Ca 0.00 -0.67 -0.42 0.00 -1.33 0.00 0.00 58.87 56.45 1yly n SER 130 Cb 0.00 -4.44 -0.03 0.00 -0.75 0.00 0.00 64.21 58.99 1yly n SER 130 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 1yly s ASP 131 N -3.37 6.66 0.10 -3.46 -1.08 -0.90 -4.90 116.67 109.71 1yly s ASP 131 Ca 0.60 2.41 0.08 0.00 -0.52 0.00 0.00 52.55 55.12 1yly s ASP 131 Cb -0.28 -2.56 -0.21 0.00 -1.46 0.00 0.00 42.92 38.41 1yly s ASP 131 CO 0.78 -0.85 1.18 0.78 0.52 0.00 0.00 175.17 177.58 1yly h ASN 132 N 8.19 0.00 -0.65 -0.34 2.35 -1.51 -2.76 115.58 120.85 1yly h ASN 132 Ca -0.42 0.00 -0.06 0.00 -0.55 0.00 0.00 56.30 55.27 1yly h ASN 132 Cb 1.20 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 39.54 1yly h ASN 132 CO 0.92 0.98 0.16 0.74 -1.65 0.00 0.00 177.43 178.59 1yly h THR 133 N 0.00 1.26 -0.44 2.81 2.02 -1.88 -1.89 112.91 114.80 1yly h THR 133 Ca -0.06 -0.93 0.01 0.00 0.77 0.00 0.00 66.41 66.19 1yly h THR 133 Cb 1.80 0.61 -0.02 0.00 -1.74 0.00 0.00 68.15 68.80 1yly h THR 133 CO 0.12 0.35 0.29 0.00 0.37 0.00 0.00 175.52 176.65 1yly h ALA 134 N 1.06 0.55 -0.68 6.16 0.00 -1.87 -1.44 119.26 123.05 1yly h ALA 134 Ca 0.21 -0.03 0.05 0.00 0.00 0.00 0.00 54.91 55.13 1yly h ALA 134 Cb 0.36 -0.17 -0.05 0.00 0.00 0.00 0.00 17.79 17.92 1yly h ALA 134 CO 0.00 0.00 0.40 1.98 0.00 0.00 0.00 179.25 181.63 1yly h MET 135 N 0.59 0.73 -0.26 0.00 -1.53 -1.35 -1.58 114.93 111.53 1yly h MET 135 Ca 0.16 -0.04 -0.02 0.00 -3.44 0.00 0.00 59.70 56.36 1yly h MET 135 Cb -0.06 -0.16 -0.01 0.00 -0.55 0.00 0.00 31.60 30.81 1yly h MET 135 CO -0.04 0.48 0.06 -0.91 0.14 0.00 0.00 176.91 176.65 1yly h ASN 136 N 0.75 0.33 -0.07 1.39 2.35 -0.61 0.01 115.58 119.74 1yly h ASN 136 Ca 0.29 -0.03 -0.13 0.00 -0.55 0.00 0.00 56.30 55.87 1yly h ASN 136 Cb 0.12 -0.08 -0.01 0.00 0.05 0.00 0.00 38.32 38.39 1yly h ASN 136 CO -0.15 0.34 -0.40 0.11 -1.65 0.00 0.00 177.43 175.68 1yly h LYS 137 N 0.37 0.59 -0.41 0.81 1.79 -0.37 -1.01 116.57 118.34 1yly h LYS 137 Ca 0.09 -0.30 -0.01 0.00 -2.18 0.00 0.00 60.65 58.24 1yly h LYS 137 Cb 0.14 0.01 -0.02 0.00 -1.58 0.00 0.00 32.23 30.78 1yly h LYS 137 CO -0.00 0.89 0.20 -0.07 -1.08 0.00 0.00 179.45 179.38 1yly h LEU 138 N 0.49 0.53 -0.60 2.94 3.38 -0.41 -1.00 115.31 120.63 1yly h LEU 138 Ca 0.04 -0.13 -0.02 0.00 0.09 0.00 0.00 57.88 57.87 1yly h LEU 138 Cb 0.91 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 41.49 1yly h LEU 138 CO 0.08 0.51 0.30 0.40 0.09 0.00 0.00 178.44 179.82 1yly h ILE 139 N 0.52 1.21 -0.57 1.22 2.04 -0.89 -2.12 117.51 118.92 1yly h ILE 139 Ca 0.14 -0.57 -0.04 0.00 1.00 0.00 0.00 64.86 65.39 1yly h ILE 139 Cb 0.12 0.48 -0.02 0.00 -0.74 0.00 0.00 36.82 36.66 1yly h ILE 139 CO -0.02 0.24 0.21 0.00 0.00 0.00 0.00 178.15 178.58 1yly h ALA 140 N 1.13 0.74 -0.75 1.87 0.00 -1.03 -0.47 119.26 120.75 1yly h ALA 140 Ca 0.21 -0.18 0.12 0.00 0.00 0.00 0.00 54.91 55.07 1yly h ALA 140 Cb 0.10 -0.22 -0.05 0.00 0.00 0.00 0.00 17.79 17.62 1yly h ALA 140 CO -0.03 0.37 0.50 0.37 0.00 0.00 0.00 179.25 180.46 1yly h GLN 141 N 0.78 0.51 -0.02 0.00 5.75 -0.79 -0.92 115.11 120.43 1yly h GLN 141 Ca 0.19 -0.03 0.00 0.00 -0.15 0.00 0.00 58.65 58.66 1yly h GLN 141 Cb 0.23 -0.12 0.00 0.00 1.07 0.00 0.00 27.48 28.67 1yly h GLN 141 CO -0.01 0.34 0.00 1.28 -2.65 0.00 0.00 178.83 177.79 1yly n LEU 142 N -4.49 0.88 0.00 -2.39 4.77 -0.78 -4.91 117.00 110.08 1yly n LEU 142 Ca 0.14 -0.30 0.00 0.00 -0.03 0.00 0.00 56.01 55.81 1yly n LEU 142 Cb 0.44 -0.01 0.00 0.00 -2.33 0.00 0.00 43.42 41.52 1yly n LEU 142 CO 0.32 0.15 0.00 0.61 -1.33 0.00 0.00 177.39 177.14 1yly n GLY 143 N 1.09 0.77 0.00 -0.72 0.00 -0.35 -4.05 105.19 101.94 1yly n GLY 143 Ca 0.21 -0.14 0.00 0.00 0.00 0.00 0.00 46.02 46.08 1yly n GLY 143 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1yly n GLY 144 N -2.43 2.03 0.39 -0.02 0.00 -0.25 -4.62 105.19 100.29 1yly n GLY 144 Ca 0.00 -2.15 0.18 0.00 0.00 0.00 0.00 46.02 44.05 1yly n GLY 144 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1yly h PRO 145 N 0.00 0.50 0.00 1.61 0.11 -1.85 0.58 132.00 132.95 1yly h PRO 145 Ca 0.00 -0.03 -0.00 0.00 0.11 0.00 0.00 66.00 66.08 1yly h PRO 145 Cb 0.00 -0.11 -0.00 0.00 0.11 0.00 0.00 31.00 31.00 1yly h PRO 145 CO 0.00 0.33 -0.02 0.78 -0.21 0.00 0.00 178.00 178.88 1yly h GLY 146 N 0.52 0.00 1.97 -0.55 0.00 -1.86 -0.96 103.07 102.18 1yly h GLY 146 Ca 0.52 0.00 -0.11 0.00 0.00 0.00 0.00 47.33 47.74 1yly h GLY 146 CO -0.25 0.00 -0.51 -1.33 0.00 0.00 0.00 176.54 174.45 1yly h GLY 147 N 0.07 0.04 0.73 4.60 0.00 -1.02 0.36 103.07 107.86 1yly h GLY 147 Ca -0.00 -0.04 -0.06 0.00 0.00 0.00 0.00 47.33 47.22 1yly h GLY 147 CO 0.00 0.04 -0.17 -2.08 0.00 0.00 0.00 176.54 174.33 1yly h VAL 148 N 0.03 1.36 -0.92 4.60 2.07 -1.22 -2.41 116.25 119.76 1yly h VAL 148 Ca -0.00 -1.38 0.04 0.00 0.82 0.00 0.00 66.70 66.18 1yly h VAL 148 Cb 0.91 1.97 -0.06 0.00 -1.52 0.00 0.00 31.29 32.59 1yly h VAL 148 CO 0.07 0.40 0.60 0.74 0.02 0.00 0.00 177.57 179.40 1yly h THR 149 N -0.05 1.14 -0.87 2.57 2.02 -1.32 -1.57 112.91 114.83 1yly h THR 149 Ca 0.02 -0.39 -0.02 0.00 0.77 0.00 0.00 66.41 66.78 1yly h THR 149 Cb 0.72 -0.11 -0.04 0.00 -1.74 0.00 0.00 68.15 66.98 1yly h THR 149 CO 0.04 0.21 0.48 0.00 0.37 0.00 0.00 175.52 176.62 1yly h ALA 150 N 1.39 1.12 -0.59 6.16 0.00 -0.83 -0.97 119.26 125.53 1yly h ALA 150 Ca 0.37 -0.13 -0.02 0.00 0.00 0.00 0.00 54.91 55.13 1yly h ALA 150 Cb 0.03 -0.35 -0.03 0.00 0.00 0.00 0.00 17.79 17.45 1yly h ALA 150 CO -0.13 0.62 0.27 0.35 0.00 0.00 0.00 179.25 180.37 1yly h PHE 151 N 1.22 0.86 -0.51 0.00 3.57 -0.90 -0.93 116.94 120.24 1yly h PHE 151 Ca 0.31 -0.05 0.08 0.00 3.53 0.00 0.00 57.97 61.84 1yly h PHE 151 Cb 0.03 -0.26 -0.06 0.00 2.79 0.00 0.00 35.95 38.44 1yly h PHE 151 CO 0.01 0.66 0.16 0.00 -2.23 0.00 0.00 178.31 176.91 1yly h ALA 152 N 1.11 0.62 -0.65 2.41 0.00 -0.60 -0.97 119.26 121.18 1yly h ALA 152 Ca 0.20 0.08 -0.04 0.00 0.00 0.00 0.00 54.91 55.15 1yly h ALA 152 Cb 0.14 0.08 -0.03 0.00 0.00 0.00 0.00 17.79 17.98 1yly h ALA 152 CO -0.02 -0.25 0.23 0.00 0.00 0.00 0.00 179.25 179.21 1yly h ARG 153 N 0.32 0.97 0.00 0.00 2.47 -0.81 -0.62 114.38 116.70 1yly h ARG 153 Ca 0.25 -0.17 -0.02 0.00 -1.26 0.00 0.00 59.98 58.77 1yly h ARG 153 Cb 0.30 -0.16 -0.00 0.00 -1.65 0.00 0.00 29.97 28.46 1yly h ARG 153 CO -0.28 0.81 -0.11 0.00 0.56 0.00 0.00 179.97 180.94 1yly h ALA 154 N 1.31 1.24 -0.60 0.04 0.00 0.12 -2.01 119.26 119.35 1yly h ALA 154 Ca 0.22 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.02 1yly h ALA 154 Cb 0.23 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.00 1yly h ALA 154 CO -0.01 0.14 0.00 0.44 0.00 0.00 0.00 179.25 179.82 1yly n ILE 155 N -3.57 1.45 -0.04 0.00 -5.35 -0.71 -4.96 119.36 106.19 1yly n ILE 155 Ca -0.02 -1.15 0.00 0.00 -0.27 0.00 0.00 62.75 61.32 1yly n ILE 155 Cb 0.25 0.29 0.00 0.00 -1.74 0.00 0.00 39.64 38.43 1yly n ILE 155 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1yly n GLY 156 N 1.07 0.74 3.46 3.28 0.00 -0.76 -5.02 105.19 107.97 1yly n GLY 156 Ca 0.23 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.81 1yly n GLY 156 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1yly s ASP 157 N -2.52 6.23 0.00 1.61 -1.08 -0.29 -4.91 116.67 115.71 1yly s ASP 157 Ca 0.00 -0.81 0.20 0.00 -0.52 0.00 0.00 52.55 51.42 1yly s ASP 157 Cb 0.00 -2.27 0.56 0.00 -1.46 0.00 0.00 42.92 39.75 1yly s ASP 157 CO 0.00 -0.79 1.45 -0.62 0.52 0.00 0.00 175.17 175.73 1yly n GLU 158 N 5.99 2.09 -0.07 4.34 -0.58 -1.26 -3.29 120.64 127.86 1yly n GLU 158 Ca -0.06 -1.66 -0.13 0.00 -0.42 0.00 0.00 57.16 54.89 1yly n GLU 158 Cb 0.46 -1.43 -0.05 0.00 -0.57 0.00 0.00 31.44 29.84 1yly n GLU 158 CO 0.00 0.00 0.00 2.41 -0.48 0.00 0.00 177.13 179.06 1yly n THR 159 N 0.87 0.75 -1.55 2.62 -1.04 -1.26 -5.01 114.28 109.66 1yly n THR 159 Ca 0.17 -0.23 -0.45 0.00 -2.04 0.00 0.00 64.05 61.51 1yly n THR 159 Cb 0.44 -1.42 -0.01 0.00 -1.82 0.00 0.00 70.33 67.52 1yly n THR 159 CO 0.00 0.00 0.00 0.33 -0.64 0.00 0.00 175.07 174.76 1yly n PHE 160 N -3.34 0.86 -3.75 -1.42 -0.00 -1.26 -4.75 117.46 103.80 1yly n PHE 160 Ca -0.26 0.74 -0.13 0.00 -0.00 0.00 0.00 57.45 57.80 1yly n PHE 160 Cb 0.71 -2.18 -0.13 0.00 -0.00 0.00 0.00 39.48 37.88 1yly n PHE 160 CO 0.00 0.00 0.00 -0.98 -0.00 0.00 0.00 176.76 175.78 1yly s ARG 161 N -1.49 0.21 -0.15 -4.13 1.70 -0.91 -4.94 118.95 109.25 1yly s ARG 161 Ca 0.60 0.45 -0.01 0.00 -0.47 0.00 0.00 55.73 56.29 1yly s ARG 161 Cb -0.72 -0.05 -0.01 0.00 -0.57 0.00 0.00 34.95 33.59 1yly s ARG 161 CO 0.59 -0.12 -0.11 -1.17 -1.08 0.00 0.00 175.30 173.41 1yly s LEU 162 N 0.88 2.79 -0.01 -1.89 2.96 -1.26 -2.99 118.68 119.16 1yly s LEU 162 Ca -0.06 -0.32 0.01 0.00 -0.22 0.00 0.00 54.13 53.54 1yly s LEU 162 Cb -0.08 -1.65 -0.02 0.00 0.50 0.00 0.00 46.19 44.95 1yly s LEU 162 CO -0.05 0.14 0.01 0.47 -1.32 0.00 0.00 176.35 175.59 1yly n ASP 163 N 3.71 4.63 -4.30 3.68 8.00 -1.26 -4.08 116.55 126.92 1yly n ASP 163 Ca -0.18 0.00 -0.16 0.00 0.71 0.00 0.00 54.79 55.16 1yly n ASP 163 Cb 0.52 0.63 -0.10 0.00 -0.02 0.00 0.00 41.12 42.16 1yly n ASP 163 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 1yly s ARG 164 N -2.05 1.27 0.78 -1.24 0.52 -1.26 -4.82 118.95 112.15 1yly s ARG 164 Ca -0.01 -1.64 -0.04 0.00 -0.52 0.00 0.00 55.73 53.53 1yly s ARG 164 Cb 0.01 -0.48 0.15 0.00 0.52 0.00 0.00 34.95 35.15 1yly s ARG 164 CO 0.06 -0.12 1.07 0.95 0.02 0.00 0.00 175.30 177.28 1yly s THR 165 N -3.52 2.06 0.30 0.02 -4.23 -1.26 -4.66 115.64 104.36 1yly s THR 165 Ca 0.28 -0.49 -0.27 0.00 -1.18 0.00 0.00 61.69 60.03 1yly s THR 165 Cb 0.06 -2.58 -0.09 0.00 1.34 0.00 0.00 72.50 71.23 1yly s THR 165 CO 0.08 0.00 0.97 -1.61 -0.54 0.00 0.00 174.62 173.52 1yly s GLU 166 N -5.31 4.63 0.00 3.99 0.41 -1.26 -1.34 118.70 119.82 1yly s GLU 166 Ca 0.69 1.45 0.24 0.00 -0.41 0.00 0.00 54.97 56.94 1yly s GLU 166 Cb -0.04 -2.96 0.60 0.00 -1.78 0.00 0.00 34.13 29.95 1yly s GLU 166 CO 0.46 0.30 1.49 -0.35 -0.49 0.00 0.00 175.26 176.67 1yly n PRO 167 N 0.84 2.05 0.15 0.39 -0.04 -1.26 -4.92 135.00 132.22 1yly n PRO 167 Ca 0.01 -1.55 0.13 0.00 -0.04 0.00 0.00 63.50 62.04 1yly n PRO 167 Cb 0.49 -1.46 0.49 0.00 -0.04 0.00 0.00 33.50 32.97 1yly n PRO 167 CO 0.00 0.00 0.00 1.79 -0.04 0.00 0.00 175.50 177.25 1yly h THR 168 N 3.45 0.00 0.00 0.52 1.35 -1.84 -2.79 112.91 113.60 1yly h THR 168 Ca 0.00 -0.37 0.00 0.00 -0.55 0.00 0.00 66.41 65.49 1yly h THR 168 Cb 0.74 1.21 0.00 0.00 -1.73 0.00 0.00 68.15 68.37 1yly h THR 168 CO 0.00 0.00 0.00 0.00 -0.25 0.00 0.00 175.52 175.27 1yly n LEU 169 N -2.43 0.00 -1.50 3.87 -0.00 -0.45 -2.47 117.00 114.03 1yly n LEU 169 Ca 0.03 0.29 0.09 0.00 -0.00 0.00 0.00 56.01 56.42 1yly n LEU 169 Cb 0.30 -0.29 0.34 0.00 -0.00 0.00 0.00 43.42 43.77 1yly n LEU 169 CO 0.24 -0.18 0.80 0.59 -0.00 0.00 0.00 177.39 178.84 1yly n ASN 170 N -1.29 4.68 0.22 1.45 3.02 -1.05 -4.52 115.26 117.77 1yly n ASN 170 Ca 0.05 -2.51 0.06 0.00 -0.03 0.00 0.00 54.58 52.15 1yly n ASN 170 Cb 0.09 -0.56 0.52 0.00 -0.61 0.00 0.00 39.78 39.21 1yly n ASN 170 CO 0.00 0.00 0.00 0.71 -2.62 0.00 0.00 177.26 175.35 1yly h THR 171 N 3.77 1.07 -6.21 3.41 1.35 -1.71 -2.14 112.91 112.44 1yly h THR 171 Ca 0.00 -0.68 -0.46 0.00 -0.55 0.00 0.00 66.41 64.72 1yly h THR 171 Cb 1.46 1.37 -0.00 0.00 -1.73 0.00 0.00 68.15 69.25 1yly h THR 171 CO 0.24 0.19 -0.76 0.00 -0.25 0.00 0.00 175.52 174.94 1yly n ALA 172 N -2.47 -1.43 -2.40 6.62 0.00 -1.26 -4.39 120.51 115.19 1yly n ALA 172 Ca -0.02 0.15 -0.42 0.00 0.00 0.00 0.00 53.44 53.15 1yly n ALA 172 Cb 0.26 -4.13 -0.03 0.00 0.00 0.00 0.00 19.45 15.55 1yly n ALA 172 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1yly s ILE 173 N -3.37 4.00 0.19 0.00 1.01 -1.26 -4.72 121.20 117.05 1yly s ILE 173 Ca 0.53 1.42 -0.33 0.00 0.00 0.00 0.00 60.65 62.27 1yly s ILE 173 Cb -0.26 -3.91 -0.14 0.00 0.01 0.00 0.00 42.46 38.16 1yly s ILE 173 CO 0.82 0.08 1.50 -2.65 0.00 0.00 0.00 174.94 174.69 1yly n PRO 174 N 4.24 2.05 0.00 2.79 -0.02 -1.26 -1.52 135.00 141.28 1yly n PRO 174 Ca 0.10 0.74 0.00 0.00 -2.02 0.00 0.00 63.50 62.31 1yly n PRO 174 Cb 0.46 -2.45 0.00 0.00 -0.02 0.00 0.00 33.50 31.49 1yly n PRO 174 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1yly n GLY 175 N 2.85 2.33 3.65 -1.23 0.00 -1.26 -5.02 105.19 106.51 1yly n GLY 175 Ca 0.15 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.74 1yly n GLY 175 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1yly s ASP 176 N -3.53 6.98 0.00 1.61 -1.08 -0.58 -4.93 116.67 115.15 1yly s ASP 176 Ca 0.00 1.21 0.26 0.00 -0.52 0.00 0.00 52.55 53.50 1yly s ASP 176 Cb 0.00 -2.54 1.16 0.00 -1.46 0.00 0.00 42.92 40.07 1yly s ASP 176 CO 0.00 -0.81 1.84 -0.81 0.52 0.00 0.00 175.17 175.91 1yly n PRO 177 N 6.68 0.10 -1.80 4.34 -0.04 -1.26 -4.86 135.00 138.16 1yly n PRO 177 Ca 0.12 0.05 -0.41 0.00 -0.04 0.00 0.00 63.50 63.22 1yly n PRO 177 Cb 0.47 -1.50 -0.01 0.00 -0.04 0.00 0.00 33.50 32.42 1yly n PRO 177 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 1yly s ARG 178 N -2.88 4.12 -1.40 0.54 0.52 -1.26 -3.13 118.95 115.46 1yly s ARG 178 Ca 0.16 2.56 -0.10 0.00 -0.52 0.00 0.00 55.73 57.83 1yly s ARG 178 Cb 0.17 -3.00 0.03 0.00 0.52 0.00 0.00 34.95 32.67 1yly s ARG 178 CO 0.45 -0.57 1.10 -0.25 0.02 0.00 0.00 175.30 176.05 1yly n ASP 179 N 1.27 -5.47 -4.47 0.23 8.00 -1.18 -4.90 116.55 110.02 1yly n ASP 179 Ca 0.04 -0.63 -0.24 0.00 0.71 0.00 0.00 54.79 54.68 1yly n ASP 179 Cb 0.38 -4.66 -0.10 0.00 -0.02 0.00 0.00 41.12 36.72 1yly n ASP 179 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 1yly s THR 180 N -3.33 2.21 0.31 -3.53 -4.23 -1.16 -1.50 115.64 104.41 1yly s THR 180 Ca 0.56 -2.28 -0.03 0.00 -1.18 0.00 0.00 61.69 58.75 1yly s THR 180 Cb -0.26 -2.40 0.01 0.00 1.34 0.00 0.00 72.50 71.20 1yly s THR 180 CO 0.76 -0.35 0.47 1.07 -0.54 0.00 0.00 174.62 176.03 1yly n THR 181 N -0.64 0.00 -4.03 3.99 5.66 -0.96 -2.15 114.28 116.15 1yly n THR 181 Ca -0.05 -1.44 -0.29 0.00 -3.05 0.00 0.00 64.05 59.21 1yly n THR 181 Cb 0.62 0.94 -0.06 0.00 -1.55 0.00 0.00 70.33 70.28 1yly n THR 181 CO 0.00 0.00 0.00 0.42 -3.05 0.00 0.00 175.07 172.44 1yly s THR 182 N -2.68 4.72 0.26 1.09 -4.23 -1.26 -1.02 115.64 112.51 1yly s THR 182 Ca 0.23 -0.76 -0.03 0.00 -1.18 0.00 0.00 61.69 59.95 1yly s THR 182 Cb -0.01 -3.32 0.24 0.00 1.34 0.00 0.00 72.50 70.75 1yly s THR 182 CO 0.17 0.06 1.85 -0.65 -0.54 0.00 0.00 174.62 175.51 1yly h PRO 183 N 2.99 0.96 -0.31 3.99 0.11 -1.68 -1.23 132.00 136.83 1yly h PRO 183 Ca -0.47 -0.06 0.01 0.00 0.11 0.00 0.00 66.00 65.59 1yly h PRO 183 Cb 1.17 -0.22 -0.02 0.00 0.11 0.00 0.00 31.00 32.05 1yly h PRO 183 CO 0.67 0.63 0.19 -0.09 -0.21 0.00 0.00 178.00 179.20 1yly h ARG 184 N 0.98 0.38 -0.57 1.05 2.43 -1.40 -0.53 114.38 116.74 1yly h ARG 184 Ca 0.42 -0.02 -0.06 0.00 -0.81 0.00 0.00 59.98 59.50 1yly h ARG 184 Cb 0.28 -0.09 -0.02 0.00 -0.42 0.00 0.00 29.97 29.72 1yly h ARG 184 CO -0.21 0.25 0.11 0.00 -1.51 0.00 0.00 179.97 178.61 1yly h ALA 185 N 1.12 0.75 -0.15 2.80 0.00 -1.72 -2.20 119.26 119.86 1yly h ALA 185 Ca 0.12 -0.24 -0.15 0.00 0.00 0.00 0.00 54.91 54.63 1yly h ALA 185 Cb -0.03 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.54 1yly h ALA 185 CO -0.04 0.49 -0.55 1.98 0.00 0.00 0.00 179.25 181.13 1yly h MET 186 N 0.83 0.45 -0.53 0.00 1.85 -0.94 -0.65 114.93 115.94 1yly h MET 186 Ca 0.17 -0.28 -0.05 0.00 -0.61 0.00 0.00 59.70 58.94 1yly h MET 186 Cb 0.39 0.03 -0.02 0.00 0.43 0.00 0.00 31.60 32.43 1yly h MET 186 CO 0.01 0.88 0.15 0.00 -0.40 0.00 0.00 176.91 177.54 1yly h ALA 187 N 1.06 0.70 -0.44 0.39 0.00 -0.99 0.12 119.26 120.11 1yly h ALA 187 Ca 0.01 -0.20 -0.02 0.00 0.00 0.00 0.00 54.91 54.69 1yly h ALA 187 Cb 1.07 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.63 1yly h ALA 187 CO 0.10 0.38 0.20 0.37 0.00 0.00 0.00 179.25 180.30 1yly h GLN 188 N 0.74 0.64 -0.43 0.00 5.75 -1.23 -0.62 115.11 119.96 1yly h GLN 188 Ca 0.17 -0.10 -0.03 0.00 -0.15 0.00 0.00 58.65 58.54 1yly h GLN 188 Cb 0.31 -0.11 -0.02 0.00 1.07 0.00 0.00 27.48 28.73 1yly h GLN 188 CO -0.00 0.55 0.14 1.15 -2.65 0.00 0.00 178.83 178.02 1yly h THR 189 N 0.57 1.22 -0.68 2.39 2.02 -0.95 -1.16 112.91 116.32 1yly h THR 189 Ca 0.15 -0.72 -0.03 0.00 0.77 0.00 0.00 66.41 66.58 1yly h THR 189 Cb 0.13 0.88 -0.03 0.00 -1.74 0.00 0.00 68.15 67.39 1yly h THR 189 CO -0.02 0.26 0.31 0.25 0.37 0.00 0.00 175.52 176.69 1yly h LEU 190 N 0.55 0.87 -0.12 2.58 5.85 -0.50 -0.11 115.31 124.43 1yly h LEU 190 Ca 0.14 -0.10 0.02 0.00 0.84 0.00 0.00 57.88 58.78 1yly h LEU 190 Cb 0.26 -0.22 -0.02 0.00 0.37 0.00 0.00 40.66 41.05 1yly h LEU 190 CO -0.00 0.75 0.02 -0.09 -0.34 0.00 0.00 178.44 178.77 1yly h ARG 191 N 0.96 0.06 -0.86 1.25 2.43 -0.85 -1.31 114.38 116.06 1yly h ARG 191 Ca 0.23 -0.00 0.03 0.00 -0.81 0.00 0.00 59.98 59.43 1yly h ARG 191 Cb 0.11 -0.01 -0.05 0.00 -0.42 0.00 0.00 29.97 29.60 1yly h ARG 191 CO -0.03 0.04 0.56 1.96 -1.51 0.00 0.00 179.97 180.99 1yly h GLN 192 N 0.06 1.06 -0.29 0.20 1.08 -0.51 0.10 115.11 116.83 1yly h GLN 192 Ca 0.05 -0.06 -0.17 0.00 -1.45 0.00 0.00 58.65 57.01 1yly h GLN 192 Cb 0.05 -0.24 -0.00 0.00 -0.05 0.00 0.00 27.48 27.24 1yly h GLN 192 CO -0.07 0.70 -0.51 -0.07 -0.95 0.00 0.00 178.83 177.93 1yly h LEU 193 N 1.09 0.89 0.00 1.46 3.38 -0.88 -2.71 115.31 118.54 1yly h LEU 193 Ca 0.34 -0.46 -0.14 0.00 0.09 0.00 0.00 57.88 57.71 1yly h LEU 193 Cb -0.02 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 40.45 1yly h LEU 193 CO -0.11 1.24 -1.96 0.35 0.09 0.00 0.00 178.44 178.05 1yly n THR 194 N -4.01 0.51 0.00 0.22 -2.24 -0.51 -4.68 114.28 103.58 1yly n THR 194 Ca -0.04 -0.54 0.00 0.00 -2.27 0.00 0.00 64.05 61.21 1yly n THR 194 Cb 0.60 -0.20 0.00 0.00 -2.10 0.00 0.00 70.33 68.63 1yly n THR 194 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1yly n LEU 195 N -2.34 0.00 0.00 3.22 4.77 0.27 -4.92 117.00 118.00 1yly n LEU 195 Ca -0.14 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.84 1yly n LEU 195 Cb 0.72 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.81 1yly n LEU 195 CO 0.36 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 177.03 1yly n GLY 196 N 2.31 2.12 0.65 -0.72 0.00 -0.67 -4.99 105.19 103.89 1yly n GLY 196 Ca 0.00 -1.95 0.06 0.00 0.00 0.00 0.00 46.02 44.13 1yly n GLY 196 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1yly n HIS 197 N 0.00 0.00 -0.03 1.61 8.25 -1.15 -4.67 115.22 119.23 1yly n HIS 197 Ca 0.00 -1.17 0.03 0.00 -0.26 0.00 0.00 57.72 56.32 1yly n HIS 197 Cb 0.00 -0.21 0.39 0.00 1.12 0.00 0.00 29.99 31.29 1yly n HIS 197 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1yly h ALA 198 N 0.78 1.64 -2.52 -1.41 0.00 -1.84 -3.43 119.26 112.47 1yly h ALA 198 Ca -0.04 -0.05 -0.58 0.00 0.00 0.00 0.00 54.91 54.24 1yly h ALA 198 Cb 1.17 -0.18 -0.11 0.00 0.00 0.00 0.00 17.79 18.67 1yly h ALA 198 CO 0.02 0.32 -0.67 -0.51 0.00 0.00 0.00 179.25 178.41 1yly s LEU 199 N -9.49 3.16 0.87 0.00 1.43 -1.26 -5.01 118.68 108.38 1yly s LEU 199 Ca -0.09 -0.58 -0.10 0.00 -1.03 0.00 0.00 54.13 52.33 1yly s LEU 199 Cb 0.17 -1.75 0.12 0.00 0.03 0.00 0.00 46.19 44.77 1yly s LEU 199 CO 0.74 0.04 1.12 -0.83 0.23 0.00 0.00 176.35 177.65 1yly s GLY 200 N -3.34 1.67 0.17 -3.19 0.00 -1.26 -4.66 107.32 96.72 1yly s GLY 200 Ca 0.29 0.39 -0.14 0.00 0.00 0.00 0.00 44.72 45.26 1yly s GLY 200 CO 0.18 0.80 1.77 -2.09 0.00 0.00 0.00 173.10 173.77 1yly h GLU 201 N -1.62 0.38 -0.49 2.90 4.81 -1.97 0.12 114.58 118.72 1yly h GLU 201 Ca -0.45 -0.02 -0.05 0.00 -0.13 0.00 0.00 59.36 58.71 1yly h GLU 201 Cb 1.26 -0.09 -0.02 0.00 0.63 0.00 0.00 28.75 30.53 1yly h GLU 201 CO 0.46 0.25 0.11 1.15 -0.73 0.00 0.00 179.01 180.26 1yly h THR 202 N 0.39 1.21 -0.20 0.32 2.02 -1.99 -2.03 112.91 112.63 1yly h THR 202 Ca 0.20 -0.77 -0.15 0.00 0.77 0.00 0.00 66.41 66.46 1yly h THR 202 Cb 0.14 0.72 0.00 0.00 -1.74 0.00 0.00 68.15 67.27 1yly h THR 202 CO -0.17 0.28 -0.48 1.56 0.37 0.00 0.00 175.52 177.09 1yly h GLN 203 N 0.72 0.67 -0.25 6.66 7.50 -1.68 -0.59 115.11 128.14 1yly h GLN 203 Ca 0.16 -0.46 0.03 0.00 0.50 0.00 0.00 58.65 58.88 1yly h GLN 203 Cb 0.28 0.07 -0.03 0.00 0.05 0.00 0.00 27.48 27.84 1yly h GLN 203 CO -0.00 1.08 0.08 -0.09 -1.50 0.00 0.00 178.83 178.39 1yly h ARG 204 N 0.37 0.18 -0.91 1.46 2.43 -0.67 -0.97 114.38 116.27 1yly h ARG 204 Ca -0.00 -0.01 0.02 0.00 -0.81 0.00 0.00 59.98 59.18 1yly h ARG 204 Cb 1.09 -0.04 -0.05 0.00 -0.42 0.00 0.00 29.97 30.55 1yly h ARG 204 CO 0.10 0.12 0.60 0.00 -1.51 0.00 0.00 179.97 179.29 1yly h ALA 205 N 1.17 1.38 -0.60 2.80 0.00 -1.27 -0.95 119.26 121.78 1yly h ALA 205 Ca 0.11 -0.05 -0.07 0.00 0.00 0.00 0.00 54.91 54.90 1yly h ALA 205 Cb 0.09 -0.35 -0.02 0.00 0.00 0.00 0.00 17.79 17.51 1yly h ALA 205 CO -0.13 0.55 0.11 0.37 0.00 0.00 0.00 179.25 180.16 1yly h GLN 206 N 1.20 0.99 -0.47 0.00 5.75 -0.61 -0.18 115.11 121.78 1yly h GLN 206 Ca 0.35 -0.26 -0.02 0.00 -0.15 0.00 0.00 58.65 58.57 1yly h GLN 206 Cb -0.07 -0.12 -0.02 0.00 1.07 0.00 0.00 27.48 28.34 1yly h GLN 206 CO -0.09 0.93 0.23 1.25 -2.65 0.00 0.00 178.83 178.49 1yly h LEU 207 N 0.90 0.62 -0.40 -2.39 5.85 -0.70 -0.87 115.31 118.32 1yly h LEU 207 Ca 0.19 -0.13 -0.02 0.00 0.84 0.00 0.00 57.88 58.76 1yly h LEU 207 Cb 0.41 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 41.26 1yly h LEU 207 CO 0.01 0.57 0.18 0.58 -0.34 0.00 0.00 178.44 179.44 1yly h VAL 208 N 0.62 1.18 -0.52 1.05 2.07 -0.97 -0.79 116.25 118.88 1yly h VAL 208 Ca 0.16 -0.53 0.08 0.00 0.82 0.00 0.00 66.70 67.23 1yly h VAL 208 Cb 0.12 0.79 -0.06 0.00 -1.52 0.00 0.00 31.29 30.62 1yly h VAL 208 CO -0.02 0.20 0.18 0.74 0.02 0.00 0.00 177.57 178.69 1yly h THR 209 N 0.51 0.80 -0.00 2.57 2.02 -0.82 -0.30 112.91 117.69 1yly h THR 209 Ca 0.14 -0.12 -0.00 0.00 0.77 0.00 0.00 66.41 67.20 1yly h THR 209 Cb 0.14 0.42 -0.00 0.00 -1.74 0.00 0.00 68.15 66.97 1yly h THR 209 CO -0.02 0.06 0.00 -0.50 0.37 0.00 0.00 175.52 175.44 1yly h TRP 210 N 0.35 0.01 -0.97 3.16 6.55 -0.74 -2.31 115.95 121.99 1yly h TRP 210 Ca 0.26 -0.00 0.03 0.00 0.95 0.00 0.00 58.89 60.13 1yly h TRP 210 Cb 0.30 -0.00 -0.06 0.00 -0.86 0.00 0.00 29.16 28.54 1yly h TRP 210 CO -0.17 0.10 0.63 -0.07 -1.05 0.00 0.00 178.44 177.88 1yly h LEU 211 N -0.09 1.06 -1.66 -4.49 3.38 -0.83 -1.70 115.31 110.98 1yly h LEU 211 Ca 0.00 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 57.95 1yly h LEU 211 Cb 0.10 -0.24 -0.00 0.00 0.09 0.00 0.00 40.66 40.60 1yly h LEU 211 CO -0.00 0.73 -0.07 0.11 0.09 0.00 0.00 178.44 179.30 1yly h LYS 212 N 1.23 0.00 -0.46 1.13 1.57 -0.89 -2.19 116.57 116.96 1yly h LYS 212 Ca 0.38 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.16 1yly h LYS 212 Cb -0.01 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.30 1yly h LYS 212 CO -0.12 0.07 0.00 0.41 -0.57 0.00 0.00 179.45 179.24 1yly n GLY 213 N -0.21 1.17 3.66 3.86 0.00 -0.65 -4.84 105.19 108.17 1yly n GLY 213 Ca -0.00 -0.51 -0.43 0.00 0.00 0.00 0.00 46.02 45.08 1yly n GLY 213 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1yly n ASN 214 N 0.86 2.20 -0.00 1.61 5.15 -0.84 -4.89 115.26 119.34 1yly n ASN 214 Ca 0.16 1.20 0.10 0.00 -0.60 0.00 0.00 54.58 55.44 1yly n ASN 214 Cb 0.39 -1.41 -0.11 0.00 -0.53 0.00 0.00 39.78 38.13 1yly n ASN 214 CO 0.00 0.00 0.00 0.35 1.40 0.00 0.00 177.26 179.01 1yly n THR 215 N 0.28 0.01 0.42 -0.44 -2.24 -0.79 -4.62 114.28 106.90 1yly n THR 215 Ca 0.07 -0.10 0.11 0.00 -2.27 0.00 0.00 64.05 61.85 1yly n THR 215 Cb 0.35 0.75 0.18 0.00 -2.10 0.00 0.00 70.33 69.50 1yly n THR 215 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1yly n THR 216 N -1.66 0.40 0.92 4.28 -2.24 -1.26 -4.68 114.28 110.04 1yly n THR 216 Ca 0.03 -0.70 0.10 0.00 -2.27 0.00 0.00 64.05 61.20 1yly n THR 216 Cb 0.38 1.08 -0.03 0.00 -2.10 0.00 0.00 70.33 69.65 1yly n THR 216 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1yly n GLY 217 N 1.37 -0.22 0.18 3.38 0.00 -1.26 -4.63 105.19 104.01 1yly n GLY 217 Ca 0.17 -0.58 0.14 0.00 0.00 0.00 0.00 46.02 45.75 1yly n GLY 217 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1yly h ALA 218 N 3.34 1.00 -0.03 4.61 0.00 -1.93 -2.31 119.26 123.95 1yly h ALA 218 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1yly h ALA 218 Cb 0.63 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.42 1yly h ALA 218 CO 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 179.25 179.15 1yly n ALA 219 N -1.87 2.69 -2.39 0.00 0.00 -1.26 -3.47 120.51 114.21 1yly n ALA 219 Ca 0.01 -0.68 0.00 0.00 0.00 0.00 0.00 53.44 52.77 1yly n ALA 219 Cb 0.22 -0.80 0.00 0.00 0.00 0.00 0.00 19.45 18.87 1yly n ALA 219 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1yly n SER 220 N 1.05 0.00 -0.26 0.00 7.64 -0.87 -4.30 113.62 116.89 1yly n SER 220 Ca 0.13 0.00 0.05 0.00 1.01 0.00 0.00 58.87 60.06 1yly n SER 220 Cb 0.57 0.00 0.19 0.00 -1.01 0.00 0.00 64.21 63.96 1yly n SER 220 CO 0.00 0.00 0.00 0.40 -3.01 0.00 0.00 175.04 172.43 1yly h ILE 221 N 0.00 0.69 0.00 0.44 2.04 -1.78 -1.63 117.51 117.26 1yly h ILE 221 Ca 0.00 -0.17 -0.02 0.00 1.00 0.00 0.00 64.86 65.67 1yly h ILE 221 Cb 0.00 0.15 -0.00 0.00 -0.74 0.00 0.00 36.82 36.23 1yly h ILE 221 CO 0.00 0.09 -0.09 0.03 0.00 0.00 0.00 178.15 178.18 1yly h ARG 222 N 0.49 0.00 0.00 2.37 3.08 -1.86 -0.80 114.38 117.66 1yly h ARG 222 Ca 0.42 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 60.45 1yly h ARG 222 Cb 0.62 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.66 1yly h ARG 222 CO -0.38 0.09 -0.10 0.00 -1.07 0.00 0.00 179.97 178.51 1yly h ALA 223 N 1.91 1.10 -0.02 0.04 0.00 -1.32 -2.84 119.26 118.13 1yly h ALA 223 Ca -0.00 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.82 1yly h ALA 223 Cb 0.43 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.20 1yly h ALA 223 CO 0.01 0.12 -0.12 0.41 0.00 0.00 0.00 179.25 179.67 1yly n GLY 224 N -0.31 0.11 3.64 0.00 0.00 -0.31 -4.91 105.19 103.41 1yly n GLY 224 Ca -0.01 -0.52 -0.24 0.00 0.00 0.00 0.00 46.02 45.25 1yly n GLY 224 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1yly s LEU 225 N -2.18 3.19 0.05 0.99 1.43 -1.07 -3.33 118.68 117.77 1yly s LEU 225 Ca 0.30 -0.58 -0.35 0.00 -1.03 0.00 0.00 54.13 52.47 1yly s LEU 225 Cb 0.20 -1.77 -0.14 0.00 0.03 0.00 0.00 46.19 44.51 1yly s LEU 225 CO 0.40 0.04 1.61 -2.65 0.23 0.00 0.00 176.35 175.97 1yly n PRO 226 N -0.59 1.86 0.22 1.29 -0.02 -1.26 -4.83 135.00 131.66 1yly n PRO 226 Ca -0.08 0.67 0.13 0.00 -2.02 0.00 0.00 63.50 62.21 1yly n PRO 226 Cb 0.58 -2.42 0.75 0.00 -0.02 0.00 0.00 33.50 32.38 1yly n PRO 226 CO 0.00 0.00 0.00 1.15 1.98 0.00 0.00 175.50 178.63 1yly h THR 227 N 4.11 0.74 0.00 3.45 2.02 -1.94 -1.30 112.91 119.98 1yly h THR 227 Ca -0.46 0.00 0.00 0.00 0.77 0.00 0.00 66.41 66.72 1yly h THR 227 Cb 1.28 0.92 0.00 0.00 -1.74 0.00 0.00 68.15 68.61 1yly h THR 227 CO 0.88 0.00 0.00 -1.54 0.37 0.00 0.00 175.52 175.23 1yly n SER 228 N -4.20 0.00 -4.73 4.18 3.41 -1.26 -4.78 113.62 106.24 1yly n SER 228 Ca -0.00 -0.30 -0.41 0.00 -0.26 0.00 0.00 58.87 57.90 1yly n SER 228 Cb 0.22 -0.20 -0.05 0.00 -0.26 0.00 0.00 64.21 63.92 1yly n SER 228 CO 0.00 0.00 0.00 0.26 -0.16 0.00 0.00 175.04 175.14 1yly s TRP 229 N -2.40 3.83 0.17 7.33 0.51 -0.49 -4.92 118.94 122.97 1yly s TRP 229 Ca 0.29 1.81 -0.30 0.00 -2.12 0.00 0.00 56.10 55.78 1yly s TRP 229 Cb 0.17 -3.05 -0.08 0.00 -0.81 0.00 0.00 33.47 29.70 1yly s TRP 229 CO 0.36 0.22 1.21 0.99 -0.51 0.00 0.00 176.95 179.22 1yly s THR 230 N -0.21 3.58 0.12 2.01 2.01 -1.20 -4.91 115.64 117.03 1yly s THR 230 Ca 0.46 1.30 -0.17 0.00 0.31 0.00 0.00 61.69 63.59 1yly s THR 230 Cb -0.24 -3.83 0.04 0.00 0.01 0.00 0.00 72.50 68.48 1yly s THR 230 CO 0.30 0.19 0.43 0.00 -0.69 0.00 0.00 174.62 174.85 1yly s ALA 231 N 0.09 -1.02 0.10 7.40 0.00 -1.26 -0.27 121.76 126.79 1yly s ALA 231 Ca 0.54 0.06 0.06 0.00 0.00 0.00 0.00 51.96 52.62 1yly s ALA 231 Cb -0.33 0.67 -0.03 0.00 0.00 0.00 0.00 23.12 23.43 1yly s ALA 231 CO 0.36 -0.64 -0.15 0.20 0.00 0.00 0.00 175.76 175.53 1yly s GLY 232 N -2.70 1.01 0.20 0.00 0.00 -0.24 -4.50 107.32 101.08 1yly s GLY 232 Ca 0.02 -1.16 -0.20 0.00 0.00 0.00 0.00 44.72 43.38 1yly s GLY 232 CO -0.11 -1.19 0.58 0.51 0.00 0.00 0.00 173.10 172.89 1yly s ASP 233 N -2.06 -0.36 -0.09 1.64 -4.77 -1.08 -1.29 116.67 108.67 1yly s ASP 233 Ca 0.04 -0.35 -0.01 0.00 -3.30 0.00 0.00 52.55 48.93 1yly s ASP 233 Cb -0.08 0.61 0.03 0.00 -1.09 0.00 0.00 42.92 42.39 1yly s ASP 233 CO 0.03 -1.08 -0.03 -0.75 0.70 0.00 0.00 175.17 174.04 1yly s LYS 234 N -3.84 0.99 0.63 2.11 2.47 -0.12 -4.71 119.74 117.27 1yly s LYS 234 Ca 0.07 -0.05 -0.08 0.00 -1.56 0.00 0.00 55.97 54.35 1yly s LYS 234 Cb -0.02 -1.22 0.01 0.00 -1.46 0.00 0.00 37.83 35.14 1yly s LYS 234 CO -0.04 -0.28 0.97 0.95 0.16 0.00 0.00 175.35 177.11 1yly s THR 235 N 1.82 3.62 0.02 3.43 -4.23 -1.26 -1.74 115.64 117.29 1yly s THR 235 Ca 0.04 0.18 -0.06 0.00 -1.18 0.00 0.00 61.69 60.68 1yly s THR 235 Cb -0.12 -3.47 -0.01 0.00 1.34 0.00 0.00 72.50 70.24 1yly s THR 235 CO -0.06 -0.53 0.10 -0.83 -0.54 0.00 0.00 174.62 172.75 1yly s GLY 236 N -4.32 0.13 -0.01 3.99 0.00 -0.19 -3.34 107.32 103.58 1yly s GLY 236 Ca 0.55 -0.39 -0.05 0.00 0.00 0.00 0.00 44.72 44.83 1yly s GLY 236 CO 0.48 -0.52 0.11 -1.35 0.00 0.00 0.00 173.10 171.81 1yly s SER 237 N -1.76 0.01 0.00 1.64 1.04 -1.26 -0.90 113.70 112.48 1yly s SER 237 Ca -0.10 -0.12 0.00 0.00 0.48 0.00 0.00 55.95 56.21 1yly s SER 237 Cb -0.05 0.20 0.00 0.00 0.10 0.00 0.00 66.02 66.28 1yly s SER 237 CO -0.02 -0.26 0.00 0.61 0.98 0.00 0.00 173.24 174.55 1yly n GLY 238 N 1.95 1.67 3.52 7.32 0.00 -0.71 -4.51 105.19 114.43 1yly n GLY 238 Ca -0.20 -0.91 -0.29 0.00 0.00 0.00 0.00 46.02 44.62 1yly n GLY 238 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1yly s ASP 240 N -0.52 1.09 -1.55 1.61 1.01 -0.81 -2.63 116.67 114.87 1yly s ASP 240 Ca 0.00 1.26 -0.01 0.00 0.71 0.00 0.00 52.55 54.50 1yly s ASP 240 Cb 0.00 -1.94 0.01 0.00 1.01 0.00 0.00 42.92 42.00 1yly s ASP 240 CO 0.00 -4.09 0.15 -1.22 0.21 0.00 0.00 175.17 170.22 1yly n TYR 241 N -4.82 -1.34 -2.35 4.23 4.01 0.23 -2.04 117.16 115.08 1yly n TYR 241 Ca 0.05 0.13 -0.18 0.00 -0.16 0.00 0.00 57.90 57.74 1yly n TYR 241 Cb 0.56 -3.75 -0.01 0.00 -0.31 0.00 0.00 39.34 35.83 1yly n TYR 241 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1yly n GLY 242 N -1.08 -0.34 3.71 2.72 0.00 -1.18 -0.85 105.19 108.16 1yly n GLY 242 Ca -0.18 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.41 1yly n GLY 242 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1yly s THR 243 N -2.86 3.34 -0.15 2.61 2.01 -0.87 -4.53 115.64 115.20 1yly s THR 243 Ca 0.00 0.90 -0.04 0.00 0.31 0.00 0.00 61.69 62.86 1yly s THR 243 Cb 0.00 -3.58 0.05 0.00 0.01 0.00 0.00 72.50 68.99 1yly s THR 243 CO 0.00 0.04 0.08 -0.89 -0.69 0.00 0.00 174.62 173.16 1yly s THR 244 N 1.60 -0.02 0.15 -0.82 2.01 -0.02 -1.73 115.64 116.82 1yly s THR 244 Ca 0.66 -0.10 0.05 0.00 0.31 0.00 0.00 61.69 62.61 1yly s THR 244 Cb -0.36 -0.55 -0.04 0.00 0.01 0.00 0.00 72.50 71.56 1yly s THR 244 CO 0.30 -0.18 -0.11 0.20 -0.69 0.00 0.00 174.62 174.13 1yly s ASN 245 N 2.11 1.92 -0.25 3.53 0.01 -0.08 -1.92 114.94 120.27 1yly s ASN 245 Ca 0.02 -0.97 -0.24 0.00 -0.71 0.00 0.00 52.86 50.96 1yly s ASN 245 Cb -0.15 -0.04 0.07 0.00 0.41 0.00 0.00 41.25 41.54 1yly s ASN 245 CO -0.08 -0.27 0.68 -0.62 -1.51 0.00 0.00 177.10 175.30 1yly s ASP 246 N -3.04 -0.71 -0.05 -1.22 2.15 -0.29 -1.02 116.67 112.49 1yly s ASP 246 Ca 0.16 1.36 0.03 0.00 0.43 0.00 0.00 52.55 54.52 1yly s ASP 246 Cb 0.01 1.37 0.01 0.00 -0.30 0.00 0.00 42.92 44.01 1yly s ASP 246 CO 0.02 -0.25 -0.11 0.27 -0.17 0.00 0.00 175.17 174.93 1yly s ILE 247 N 0.32 1.01 0.01 4.11 -4.36 -0.71 -0.96 121.20 120.62 1yly s ILE 247 Ca -0.00 -0.45 -0.02 0.00 -0.26 0.00 0.00 60.65 59.92 1yly s ILE 247 Cb -0.05 -0.91 -0.01 0.00 1.25 0.00 0.00 42.46 42.74 1yly s ILE 247 CO 0.01 0.32 0.03 0.00 0.24 0.00 0.00 174.94 175.53 1yly s ALA 248 N 0.43 -0.03 -0.10 2.27 0.00 0.29 -0.95 121.76 123.66 1yly s ALA 248 Ca -0.09 -0.38 0.02 0.00 0.00 0.00 0.00 51.96 51.52 1yly s ALA 248 Cb -0.13 0.11 -0.01 0.00 0.00 0.00 0.00 23.12 23.09 1yly s ALA 248 CO 0.02 -0.16 -0.18 0.54 0.00 0.00 0.00 175.76 175.98 1yly s VAL 249 N -1.26 2.59 -0.04 0.00 0.11 -0.41 -1.00 120.40 120.39 1yly s VAL 249 Ca -0.14 -0.84 0.03 0.00 -2.93 0.00 0.00 61.98 58.10 1yly s VAL 249 Cb -0.08 -2.03 0.00 0.00 -1.53 0.00 0.00 36.38 32.74 1yly s VAL 249 CO -0.00 0.55 -0.13 -0.63 -3.33 0.00 0.00 175.10 171.56 1yly s ILE 250 N 0.18 1.09 -0.63 7.04 1.01 0.19 -1.08 121.20 129.00 1yly s ILE 250 Ca -0.11 -0.51 -0.03 0.00 0.00 0.00 0.00 60.65 60.00 1yly s ILE 250 Cb -0.16 -0.97 0.16 0.00 0.01 0.00 0.00 42.46 41.51 1yly s ILE 250 CO 0.06 0.33 0.45 0.26 0.00 0.00 0.00 174.94 176.04 1yly s TRP 251 N 0.25 3.42 0.61 3.97 0.51 0.63 -0.32 118.94 128.01 1yly s TRP 251 Ca -0.06 -2.70 -0.17 0.00 -2.12 0.00 0.00 56.10 51.05 1yly s TRP 251 Cb -0.11 -3.21 -0.02 0.00 -0.81 0.00 0.00 33.47 29.31 1yly s TRP 251 CO 0.02 -0.84 1.11 -2.14 -0.51 0.00 0.00 176.95 174.58 1yly s PRO 252 N -0.06 3.05 -0.02 4.98 0.02 -1.26 -3.28 135.00 138.43 1yly s PRO 252 Ca 0.17 1.44 -0.35 0.00 0.02 0.00 0.00 61.00 62.28 1yly s PRO 252 Cb -0.20 -1.98 -0.13 0.00 0.02 0.00 0.00 34.50 32.21 1yly s PRO 252 CO -0.04 -1.06 1.71 0.94 -0.33 0.00 0.00 177.00 178.22 1yly n GLN 254 N -2.00 1.93 -1.01 5.54 -0.06 -1.26 -2.38 117.38 118.14 1yly n GLN 254 Ca 0.11 0.70 -0.00 0.00 -2.00 0.00 0.00 57.00 55.80 1yly n GLN 254 Cb 0.52 -2.48 -0.00 0.00 -4.06 0.00 0.00 30.24 24.21 1yly n GLN 254 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 1yly n GLY 255 N 3.87 0.37 3.17 1.69 0.00 -1.26 -4.99 105.19 108.04 1yly n GLY 255 Ca 0.21 -0.04 -0.10 0.00 0.00 0.00 0.00 46.02 46.09 1yly n GLY 255 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1yly s ARG 256 N -0.77 0.95 0.69 1.61 1.70 -1.00 -5.14 118.95 116.99 1yly s ARG 256 Ca 0.00 -1.40 -0.17 0.00 -0.47 0.00 0.00 55.73 53.70 1yly s ARG 256 Cb 0.00 0.26 0.01 0.00 -0.57 0.00 0.00 34.95 34.65 1yly s ARG 256 CO 0.00 -0.28 1.16 0.00 -1.08 0.00 0.00 175.30 175.10 1yly n ALA 257 N -0.11 0.48 -1.31 7.88 0.00 -1.26 -4.31 120.51 121.88 1yly n ALA 257 Ca -0.06 -0.11 -0.32 0.00 0.00 0.00 0.00 53.44 52.95 1yly n ALA 257 Cb 0.64 -2.24 0.08 0.00 0.00 0.00 0.00 19.45 17.93 1yly n ALA 257 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1yly s PRO 258 N -3.45 2.36 0.04 0.00 0.04 -1.26 -4.56 135.00 128.16 1yly s PRO 258 Ca 0.78 1.30 0.03 0.00 0.04 0.00 0.00 61.00 63.16 1yly s PRO 258 Cb -0.36 -1.90 -0.04 0.00 0.04 0.00 0.00 34.50 32.24 1yly s PRO 258 CO 0.45 -1.58 -0.01 -0.51 0.04 0.00 0.00 177.00 175.39 1yly s LEU 259 N -5.55 3.43 -0.12 -3.56 1.43 0.56 -1.63 118.68 113.24 1yly s LEU 259 Ca 0.64 -0.11 0.01 0.00 -1.03 0.00 0.00 54.13 53.65 1yly s LEU 259 Cb -0.19 -2.06 -0.01 0.00 0.03 0.00 0.00 46.19 43.96 1yly s LEU 259 CO 0.50 0.23 -0.16 -0.69 0.23 0.00 0.00 176.35 176.47 1yly s VAL 260 N -1.17 2.84 -0.03 -1.59 1.01 -0.00 -0.64 120.40 120.82 1yly s VAL 260 Ca 0.22 -0.75 0.00 0.00 0.00 0.00 0.00 61.98 61.45 1yly s VAL 260 Cb -0.12 -2.16 0.03 0.00 0.00 0.00 0.00 36.38 34.13 1yly s VAL 260 CO 0.13 0.54 0.01 -0.22 0.00 0.00 0.00 175.10 175.56 1yly s LEU 261 N 0.26 1.14 -0.09 3.92 2.96 -0.17 -0.69 118.68 126.00 1yly s LEU 261 Ca -0.11 -0.00 0.02 0.00 -0.22 0.00 0.00 54.13 53.82 1yly s LEU 261 Cb -0.16 -0.17 0.01 0.00 0.50 0.00 0.00 46.19 46.38 1yly s LEU 261 CO 0.06 -0.11 -0.14 0.68 -1.32 0.00 0.00 176.35 175.52 1yly s VAL 262 N 1.04 1.34 -0.19 1.68 -7.23 -0.19 -0.55 120.40 116.30 1yly s VAL 262 Ca -0.10 -0.57 0.01 0.00 -1.81 0.00 0.00 61.98 59.51 1yly s VAL 262 Cb -0.13 -1.22 0.04 0.00 0.56 0.00 0.00 36.38 35.62 1yly s VAL 262 CO -0.02 0.41 -0.12 0.42 -0.31 0.00 0.00 175.10 175.47 1yly s THR 263 N 0.82 1.67 -0.06 5.32 -4.23 -0.13 -1.47 115.64 117.57 1yly s THR 263 Ca -0.11 -0.93 0.04 0.00 -1.18 0.00 0.00 61.69 59.51 1yly s THR 263 Cb -0.15 -1.69 -0.02 0.00 1.34 0.00 0.00 72.50 71.97 1yly s THR 263 CO 0.02 0.26 -0.17 -0.31 -0.54 0.00 0.00 174.62 173.87 1yly s TYR 264 N 1.40 2.63 -0.09 3.99 2.02 0.29 -1.14 117.35 126.44 1yly s TYR 264 Ca 0.00 -0.33 -0.06 0.00 -0.37 0.00 0.00 57.07 56.32 1yly s TYR 264 Cb -0.15 -1.63 0.04 0.00 -0.40 0.00 0.00 41.96 39.81 1yly s TYR 264 CO -0.09 0.05 0.22 0.12 -1.57 0.00 0.00 175.55 174.28 1yly s PHE 265 N -0.50 -0.28 0.06 2.71 5.36 -0.81 -0.61 117.98 123.92 1yly s PHE 265 Ca 0.06 0.68 -0.09 0.00 -0.96 0.00 0.00 56.93 56.63 1yly s PHE 265 Cb -0.12 0.04 0.00 0.00 -0.34 0.00 0.00 43.02 42.61 1yly s PHE 265 CO 0.01 -0.19 0.19 -0.08 -1.46 0.00 0.00 175.22 173.69 1yly s THR 266 N 0.88 0.13 0.25 0.12 -1.32 -0.57 -0.84 115.64 114.29 1yly s THR 266 Ca -0.06 -1.05 0.06 0.00 -1.21 0.00 0.00 61.69 59.42 1yly s THR 266 Cb -0.08 -1.13 -0.05 0.00 -1.51 0.00 0.00 72.50 69.73 1yly s THR 266 CO -0.05 -0.58 -0.06 -1.10 -2.21 0.00 0.00 174.62 170.61 1yly s GLN 267 N -3.21 1.45 0.39 7.08 -0.21 -0.03 -0.84 119.66 124.28 1yly s GLN 267 Ca -0.00 -1.72 0.21 0.00 0.02 0.00 0.00 55.36 53.87 1yly s GLN 267 Cb 0.02 -1.01 0.55 0.00 1.00 0.00 0.00 33.01 33.57 1yly s GLN 267 CO -0.07 0.03 1.67 -1.35 -2.12 0.00 0.00 175.29 173.44 1yly h PRO 268 N 2.38 0.00 -5.45 2.91 0.11 -1.82 -3.45 132.00 126.69 1yly h PRO 268 Ca -0.39 0.00 -0.59 0.00 0.11 0.00 0.00 66.00 65.12 1yly h PRO 268 Cb 1.23 0.00 -0.11 0.00 0.11 0.00 0.00 31.00 32.23 1yly h PRO 268 CO 0.66 0.29 -0.31 -0.65 -0.21 0.00 0.00 178.00 177.78 1yly s GLN 269 N -3.35 4.23 0.43 1.05 1.11 -1.26 -4.98 119.66 116.88 1yly s GLN 269 Ca 0.03 0.10 0.16 0.00 0.01 0.00 0.00 55.36 55.65 1yly s GLN 269 Cb 0.09 -3.46 1.05 0.00 -1.01 0.00 0.00 33.01 29.68 1yly s GLN 269 CO 0.68 0.15 1.92 0.37 0.01 0.00 0.00 175.29 178.42 1yly h GLN 270 N 6.92 0.40 -0.52 2.91 4.15 -1.91 -1.72 115.11 125.35 1yly h GLN 270 Ca -0.40 -0.02 -0.03 0.00 0.77 0.00 0.00 58.65 58.97 1yly h GLN 270 Cb 1.16 -0.09 -0.02 0.00 0.21 0.00 0.00 27.48 28.75 1yly h GLN 270 CO 0.74 0.27 0.03 0.09 -1.93 0.00 0.00 178.83 178.02 1yly n ASN 271 N -4.48 5.19 -4.73 -0.69 5.03 -1.26 -0.60 115.26 113.72 1yly n ASN 271 Ca 0.15 -3.00 -0.37 0.00 0.87 0.00 0.00 54.58 52.22 1yly n ASN 271 Cb 0.54 -0.66 0.06 0.00 -1.02 0.00 0.00 39.78 38.70 1yly n ASN 271 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1yly n ALA 272 N 0.25 1.30 -1.69 5.41 0.00 -0.64 -4.86 120.51 120.27 1yly n ALA 272 Ca 0.28 0.04 -0.34 0.00 0.00 0.00 0.00 53.44 53.42 1yly n ALA 272 Cb 1.15 -2.34 0.01 0.00 0.00 0.00 0.00 19.45 18.27 1yly n ALA 272 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 1yly s GLU 273 N -3.22 3.28 0.39 0.00 0.41 -1.26 -3.13 118.70 115.17 1yly s GLU 273 Ca 0.79 1.44 -0.27 0.00 -0.41 0.00 0.00 54.97 56.52 1yly s GLU 273 Cb -0.39 -2.01 -0.09 0.00 -1.78 0.00 0.00 34.13 29.86 1yly s GLU 273 CO 0.43 -0.88 1.33 0.45 -0.49 0.00 0.00 175.26 176.10 1yly s SER 274 N -2.20 6.39 -0.48 -0.19 0.15 -1.26 -4.67 113.70 111.45 1yly s SER 274 Ca 0.69 2.71 0.08 0.00 0.70 0.00 0.00 55.95 60.13 1yly s SER 274 Cb -0.20 -2.64 0.33 0.00 -1.71 0.00 0.00 66.02 61.79 1yly s SER 274 CO 0.31 -0.80 0.80 0.54 1.20 0.00 0.00 173.24 175.29 1yly n ARG 275 N 0.29 1.96 0.26 5.44 5.12 -1.26 -4.89 116.66 123.58 1yly n ARG 275 Ca 0.03 -4.05 0.10 0.00 -1.93 0.00 0.00 57.85 51.99 1yly n ARG 275 Cb 0.43 -1.91 0.69 0.00 -1.16 0.00 0.00 32.46 30.50 1yly n ARG 275 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1yly h ARG 276 N 3.19 0.00 -0.12 5.56 3.08 -1.94 -1.63 114.38 122.52 1yly h ARG 276 Ca 0.12 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.17 1yly h ARG 276 Cb 0.75 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.80 1yly h ARG 276 CO 0.65 0.06 0.08 0.38 -1.07 0.00 0.00 179.97 180.07 1yly h ASP 277 N 0.00 0.14 -0.27 7.04 2.03 -1.90 -1.75 116.42 121.71 1yly h ASP 277 Ca -0.00 -0.00 -0.11 0.00 -0.73 0.00 0.00 57.03 56.19 1yly h ASP 277 Cb 0.11 -0.03 -0.02 0.00 -0.83 0.00 0.00 39.33 38.56 1yly h ASP 277 CO 0.01 0.10 -0.20 0.58 -1.03 0.00 0.00 179.24 178.70 1yly h VAL 278 N 0.16 1.27 -0.42 4.15 2.07 -1.66 -0.61 116.25 121.22 1yly h VAL 278 Ca 0.04 -1.28 -0.08 0.00 0.82 0.00 0.00 66.70 66.20 1yly h VAL 278 Cb -0.02 1.19 -0.01 0.00 -1.52 0.00 0.00 31.29 30.93 1yly h VAL 278 CO -0.01 0.43 -0.05 -0.07 0.02 0.00 0.00 177.57 177.89 1yly h LEU 279 N 0.64 0.77 -0.70 2.57 3.38 -1.43 -0.71 115.31 119.83 1yly h LEU 279 Ca 0.10 -0.33 0.05 0.00 0.09 0.00 0.00 57.88 57.78 1yly h LEU 279 Cb 0.69 -0.21 -0.05 0.00 0.09 0.00 0.00 40.66 41.18 1yly h LEU 279 CO 0.05 0.92 0.42 0.00 0.09 0.00 0.00 178.44 179.91 1yly h ALA 280 N 0.87 0.94 -0.60 1.53 0.00 -1.20 -0.67 119.26 120.14 1yly h ALA 280 Ca 0.11 0.00 -0.08 0.00 0.00 0.00 0.00 54.91 54.94 1yly h ALA 280 Cb 0.55 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.15 1yly h ALA 280 CO 0.03 0.13 0.04 0.77 0.00 0.00 0.00 179.25 180.22 1yly h SER 281 N 0.78 0.97 -0.57 0.00 0.02 -0.85 -0.15 113.55 113.76 1yly h SER 281 Ca 0.30 -0.25 -0.03 0.00 -0.84 0.00 0.00 61.79 60.98 1yly h SER 281 Cb 0.13 -0.26 -0.03 0.00 0.14 0.00 0.00 62.40 62.39 1yly h SER 281 CO -0.16 1.00 0.24 0.00 -1.14 0.00 0.00 176.83 176.77 1yly h ALA 282 N 1.10 0.74 -0.46 3.77 0.00 -0.71 -1.57 119.26 122.13 1yly h ALA 282 Ca 0.18 -0.16 -0.09 0.00 0.00 0.00 0.00 54.91 54.84 1yly h ALA 282 Cb 0.48 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.03 1yly h ALA 282 CO 0.02 0.34 -0.07 0.00 0.00 0.00 0.00 179.25 179.54 1yly h ALA 283 N 1.08 1.01 -0.65 0.00 0.00 -0.81 -1.46 119.26 118.43 1yly h ALA 283 Ca 0.19 -0.30 -0.02 0.00 0.00 0.00 0.00 54.91 54.78 1yly h ALA 283 Cb 0.18 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.76 1yly h ALA 283 CO -0.02 0.60 0.35 -0.09 0.00 0.00 0.00 179.25 180.09 1yly h ARG 284 N 0.74 0.91 -0.37 0.00 2.43 -0.69 0.40 114.38 117.79 1yly h ARG 284 Ca 0.13 -0.11 -0.02 0.00 -0.81 0.00 0.00 59.98 59.17 1yly h ARG 284 Cb 0.55 -0.18 -0.02 0.00 -0.42 0.00 0.00 29.97 29.91 1yly h ARG 284 CO 0.03 0.70 0.15 0.82 -1.51 0.00 0.00 179.97 180.16 1yly h ILE 285 N 0.89 1.19 -0.49 1.20 2.04 -1.03 -2.04 117.51 119.26 1yly h ILE 285 Ca 0.23 -0.58 0.01 0.00 1.00 0.00 0.00 64.86 65.52 1yly h ILE 285 Cb 0.06 0.87 -0.03 0.00 -0.74 0.00 0.00 36.82 36.98 1yly h ILE 285 CO -0.03 0.21 0.31 0.40 0.00 0.00 0.00 178.15 179.03 1yly h ILE 286 N 0.46 1.09 0.00 -0.67 1.08 -0.94 -2.37 117.51 116.16 1yly h ILE 286 Ca 0.13 -0.21 -0.04 0.00 -0.39 0.00 0.00 64.86 64.34 1yly h ILE 286 Cb 0.18 0.41 -0.01 0.00 -3.07 0.00 0.00 36.82 34.33 1yly h ILE 286 CO -0.01 0.11 -0.18 0.00 -0.69 0.00 0.00 178.15 177.38 1yly h ALA 287 N 1.20 1.36 -0.46 1.87 0.00 -0.68 -1.70 119.26 120.85 1yly h ALA 287 Ca 0.19 -0.16 -0.05 0.00 0.00 0.00 0.00 54.91 54.88 1yly h ALA 287 Cb -0.03 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 1yly h ALA 287 CO -0.06 0.23 0.06 0.93 0.00 0.00 0.00 179.25 180.40 1yly h GLU 288 N 0.00 0.71 -0.04 0.00 4.39 -0.84 -2.68 114.58 116.13 1yly h GLU 288 Ca -0.00 -0.16 0.00 0.00 0.34 0.00 0.00 59.36 59.54 1yly h GLU 288 Cb 0.42 -0.10 0.00 0.00 -0.10 0.00 0.00 28.75 28.96 1yly h GLU 288 CO 0.02 0.68 0.00 0.41 -1.16 0.00 0.00 179.01 178.97 1yly n GLY 289 N -0.83 -0.27 0.00 -3.84 0.00 -0.66 -5.12 105.19 94.47 1yly n GLY 289 Ca 0.03 -0.35 0.13 0.00 0.00 0.00 0.00 46.02 45.83 1yly n GLY 289 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36