#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1l5i s GLY 5 N 0.00 -0.49 0.09 0.23 0.00 -1.26 -5.17 107.32 100.72 1l5i s GLY 5 Ca 0.00 2.19 0.06 0.00 0.00 0.00 0.00 44.72 46.97 1l5i s GLY 5 CO 0.00 1.86 -0.15 -1.60 0.00 0.00 0.00 173.10 173.22 1l5i s ARG 6 N 0.54 0.90 -0.63 2.90 3.00 -1.26 -5.09 118.95 119.32 1l5i s ARG 6 Ca -0.01 -1.06 -0.27 0.00 -1.00 0.00 0.00 55.73 53.39 1l5i s ARG 6 Cb -0.05 -0.89 0.01 0.00 0.00 0.00 0.00 34.95 34.03 1l5i s ARG 6 CO -0.03 0.19 1.43 0.12 0.00 0.00 0.00 175.30 177.01 1l5i s PHE 7 N -1.53 2.21 -0.16 5.12 5.36 -1.26 -4.95 117.98 122.76 1l5i s PHE 7 Ca 0.02 0.35 -0.02 0.00 -0.96 0.00 0.00 56.93 56.32 1l5i s PHE 7 Cb -0.08 -4.43 0.05 0.00 -0.34 0.00 0.00 43.02 38.21 1l5i s PHE 7 CO 0.03 -2.04 -0.00 0.45 -1.46 0.00 0.00 175.22 172.19 1l5i s SER 8 N 4.68 2.63 -0.13 6.13 0.15 -1.26 -4.15 113.70 121.74 1l5i s SER 8 Ca 0.49 -0.62 -0.04 0.00 0.70 0.00 0.00 55.95 56.48 1l5i s SER 8 Cb -0.10 -0.69 -0.03 0.00 -1.71 0.00 0.00 66.02 63.49 1l5i s SER 8 CO 0.21 -0.24 0.01 -0.63 1.20 0.00 0.00 173.24 173.79 1l5i s ILE 9 N 1.79 4.34 -0.18 6.45 1.01 -1.13 -4.90 121.20 128.58 1l5i s ILE 9 Ca 0.01 -0.21 -0.03 0.00 0.00 0.00 0.00 60.65 60.42 1l5i s ILE 9 Cb -0.15 -2.88 0.06 0.00 0.01 0.00 0.00 42.46 39.49 1l5i s ILE 9 CO -0.07 0.53 0.03 -0.54 0.00 0.00 0.00 174.94 174.89 1l5i s LYS 10 N -0.18 0.67 0.16 2.79 1.02 -1.26 0.58 119.74 123.52 1l5i s LYS 10 Ca 0.05 -0.37 -0.24 0.00 0.02 0.00 0.00 55.97 55.43 1l5i s LYS 10 Cb -0.12 -1.99 0.06 0.00 -0.52 0.00 0.00 37.83 35.26 1l5i s LYS 10 CO 0.02 -0.60 0.73 0.00 -0.92 0.00 0.00 175.35 174.58 1l5i s ALA 11 N 1.86 -1.56 0.02 5.17 0.00 -0.99 -4.97 121.76 121.30 1l5i s ALA 11 Ca -0.00 0.35 0.01 0.00 0.00 0.00 0.00 51.96 52.33 1l5i s ALA 11 Cb -0.17 0.76 -0.26 0.00 0.00 0.00 0.00 23.12 23.46 1l5i s ALA 11 CO -0.08 -0.85 0.93 -0.22 0.00 0.00 0.00 175.76 175.54 1l5i h LYS 12 N 2.00 0.16 -6.55 0.00 3.64 -1.84 -0.18 116.57 113.79 1l5i h LYS 12 Ca -0.27 -0.28 -0.68 0.00 -1.27 0.00 0.00 60.65 58.16 1l5i h LYS 12 Cb 1.27 0.10 -0.19 0.00 -0.41 0.00 0.00 32.23 33.00 1l5i h LYS 12 CO 0.31 1.00 -0.77 -0.80 -2.27 0.00 0.00 179.45 176.92 1l5i s ASN 13 N -6.80 4.07 0.01 4.20 0.01 -1.25 -1.00 114.94 114.17 1l5i s ASN 13 Ca -0.06 -0.39 0.03 0.00 -0.71 0.00 0.00 52.86 51.72 1l5i s ASN 13 Cb 0.08 -0.72 -0.01 0.00 0.41 0.00 0.00 41.25 41.00 1l5i s ASN 13 CO 0.84 0.23 -0.09 -0.31 -1.51 0.00 0.00 177.10 176.26 1l5i s TYR 14 N -1.03 0.79 -0.18 2.20 2.02 -0.15 -0.82 117.35 120.18 1l5i s TYR 14 Ca 0.17 -0.22 0.01 0.00 -0.37 0.00 0.00 57.07 56.66 1l5i s TYR 14 Cb -0.11 -0.50 0.02 0.00 -0.40 0.00 0.00 41.96 40.98 1l5i s TYR 14 CO 0.08 -0.01 -0.20 -0.06 -1.57 0.00 0.00 175.55 173.79 1l5i s PHE 15 N -0.46 2.75 -0.17 2.71 0.08 0.24 -1.55 117.98 121.57 1l5i s PHE 15 Ca 0.01 -1.63 -0.07 0.00 0.12 0.00 0.00 56.93 55.36 1l5i s PHE 15 Cb -0.05 -1.90 -0.04 0.00 -0.57 0.00 0.00 43.02 40.46 1l5i s PHE 15 CO 0.00 -0.80 0.05 -0.51 -0.10 0.00 0.00 175.22 173.86 1l5i s LEU 16 N 1.30 3.75 -0.08 -0.37 2.01 -0.54 -1.74 118.68 123.01 1l5i s LEU 16 Ca 0.05 0.07 0.04 0.00 0.01 0.00 0.00 54.13 54.30 1l5i s LEU 16 Cb -0.13 -1.94 -0.01 0.00 0.01 0.00 0.00 46.19 44.12 1l5i s LEU 16 CO -0.13 0.19 -0.21 -0.89 1.01 0.00 0.00 176.35 176.32 1l5i s THR 17 N 0.27 2.37 -0.30 5.49 2.01 -1.00 -1.91 115.64 122.57 1l5i s THR 17 Ca 0.03 -0.94 0.01 0.00 0.31 0.00 0.00 61.69 61.10 1l5i s THR 17 Cb -0.12 -1.90 0.09 0.00 0.01 0.00 0.00 72.50 70.57 1l5i s THR 17 CO 0.01 0.56 0.05 -0.31 -0.69 0.00 0.00 174.62 174.24 1l5i s TYR 18 N -0.08 2.57 0.29 4.92 1.51 -1.02 -1.47 117.35 124.07 1l5i s TYR 18 Ca -0.05 -2.18 -0.29 0.00 -1.01 0.00 0.00 57.07 53.54 1l5i s TYR 18 Cb -0.14 -2.11 -0.09 0.00 -0.11 0.00 0.00 41.96 39.50 1l5i s TYR 18 CO 0.04 -0.88 1.08 -1.25 -1.11 0.00 0.00 175.55 173.43 1l5i s PRO 19 N 1.32 4.62 -1.17 -1.71 0.04 -1.26 -2.19 135.00 134.64 1l5i s PRO 19 Ca 0.07 1.75 -0.15 0.00 0.04 0.00 0.00 61.00 62.71 1l5i s PRO 19 Cb -0.18 -3.14 0.15 0.00 0.04 0.00 0.00 34.50 31.37 1l5i s PRO 19 CO -0.15 0.21 0.37 0.36 0.04 0.00 0.00 177.00 177.83 1l5i n LYS 20 N 1.10 -1.50 -3.25 4.56 2.85 0.02 -4.83 118.16 117.10 1l5i n LYS 20 Ca -0.01 0.09 -0.40 0.00 -1.05 0.00 0.00 58.31 56.94 1l5i n LYS 20 Cb 0.45 -4.47 -0.07 0.00 -0.65 0.00 0.00 35.03 30.29 1l5i n LYS 20 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 1l5i n ASP 22 N 5.31 1.67 -4.74 0.00 9.92 -1.26 -4.49 116.55 122.96 1l5i n ASP 22 Ca -0.05 -2.08 -0.41 0.00 -0.53 0.00 0.00 54.79 51.72 1l5i n ASP 22 Cb 0.50 -0.27 -0.03 0.00 -0.64 0.00 0.00 41.12 40.67 1l5i n ASP 22 CO 0.00 0.00 0.00 -0.22 0.13 0.00 0.00 177.20 177.11 1l5i s LEU 23 N -0.98 4.43 0.51 0.64 2.96 -1.26 -5.02 118.68 119.96 1l5i s LEU 23 Ca 0.17 2.31 -0.06 0.00 -0.22 0.00 0.00 54.13 56.33 1l5i s LEU 23 Cb 0.10 -3.61 -0.03 0.00 0.50 0.00 0.00 46.19 43.16 1l5i s LEU 23 CO 0.10 -0.46 0.83 0.42 -1.32 0.00 0.00 176.35 175.91 1l5i s THR 24 N 0.13 4.68 0.35 3.68 -4.23 -1.26 -4.93 115.64 114.05 1l5i s THR 24 Ca 0.55 0.22 0.16 0.00 -1.18 0.00 0.00 61.69 61.44 1l5i s THR 24 Cb -0.34 -3.80 0.12 0.00 1.34 0.00 0.00 72.50 69.82 1l5i s THR 24 CO 0.37 -0.81 1.85 0.07 -0.54 0.00 0.00 174.62 175.55 1l5i h LYS 25 N 0.11 0.00 -0.09 3.99 5.09 -1.97 -1.05 116.57 122.65 1l5i h LYS 25 Ca -0.46 0.00 -0.01 0.00 0.09 0.00 0.00 60.65 60.26 1l5i h LYS 25 Cb 1.21 0.00 -0.00 0.00 0.10 0.00 0.00 32.23 33.54 1l5i h LYS 25 CO 0.61 0.34 0.01 0.93 -2.09 0.00 0.00 179.45 179.25 1l5i h GLU 26 N 0.00 0.15 -0.39 0.07 5.08 -1.97 1.61 114.58 119.13 1l5i h GLU 26 Ca -0.00 -0.04 -0.05 0.00 -1.00 0.00 0.00 59.36 58.27 1l5i h GLU 26 Cb 0.65 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.87 1l5i h GLU 26 CO 0.04 0.38 0.06 -0.91 -1.00 0.00 0.00 179.01 177.58 1l5i h ASN 27 N -0.10 0.62 0.25 1.42 -0.26 -1.91 0.35 115.58 115.96 1l5i h ASN 27 Ca 0.03 -0.26 -0.11 0.00 -0.56 0.00 0.00 56.30 55.39 1l5i h ASN 27 Cb 0.30 -0.16 -0.01 0.00 -1.06 0.00 0.00 38.32 37.38 1l5i h ASN 27 CO 0.00 0.72 -0.44 0.00 -1.06 0.00 0.00 177.43 176.66 1l5i h ALA 28 N 0.92 1.07 -0.24 -0.83 0.00 -1.11 0.33 119.26 119.41 1l5i h ALA 28 Ca 0.12 -0.43 -0.09 0.00 0.00 0.00 0.00 54.91 54.51 1l5i h ALA 28 Cb 0.37 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.07 1l5i h ALA 28 CO 0.01 0.61 -0.20 1.25 0.00 0.00 0.00 179.25 180.92 1l5i h LEU 29 N 0.19 0.58 -0.25 0.00 7.12 0.28 0.59 115.31 123.82 1l5i h LEU 29 Ca 0.01 -0.46 -0.09 0.00 0.13 0.00 0.00 57.88 57.47 1l5i h LEU 29 Cb 0.86 -0.16 -0.00 0.00 -0.53 0.00 0.00 40.66 40.82 1l5i h LEU 29 CO 0.07 0.92 -0.22 0.28 -0.13 0.00 0.00 178.44 179.36 1l5i h SER 30 N 0.25 0.62 -0.11 1.25 0.02 -0.12 0.56 113.55 116.02 1l5i h SER 30 Ca 0.04 -0.46 -0.02 0.00 -0.84 0.00 0.00 61.79 60.52 1l5i h SER 30 Cb 0.74 -0.17 -0.00 0.00 0.14 0.00 0.00 62.40 63.10 1l5i h SER 30 CO 0.05 0.95 0.01 1.56 -1.14 0.00 0.00 176.83 178.26 1l5i h GLN 31 N 0.29 0.19 -0.31 3.45 4.20 -0.33 0.52 115.11 123.13 1l5i h GLN 31 Ca 0.04 -0.06 -0.04 0.00 0.06 0.00 0.00 58.65 58.65 1l5i h GLN 31 Cb 0.76 -0.02 -0.01 0.00 0.30 0.00 0.00 27.48 28.51 1l5i h GLN 31 CO 0.06 0.43 0.04 0.82 -0.67 0.00 0.00 178.83 179.50 1l5i h ILE 32 N -0.07 1.24 -0.70 2.54 1.08 0.17 0.31 117.51 122.09 1l5i h ILE 32 Ca 0.03 -0.85 -0.04 0.00 -0.39 0.00 0.00 64.86 63.62 1l5i h ILE 32 Cb 0.34 1.20 -0.03 0.00 -3.07 0.00 0.00 36.82 35.25 1l5i h ILE 32 CO 0.00 0.28 0.29 0.74 -0.69 0.00 0.00 178.15 178.78 1l5i h THR 33 N 0.34 1.24 0.00 -0.27 2.02 0.20 -0.30 112.91 116.14 1l5i h THR 33 Ca 0.09 -0.72 0.00 0.00 0.77 0.00 0.00 66.41 66.55 1l5i h THR 33 Cb 0.37 0.38 0.00 0.00 -1.74 0.00 0.00 68.15 67.16 1l5i h THR 33 CO 0.01 0.29 -0.01 0.59 0.37 0.00 0.00 175.52 176.77 1l5i n ASN 34 N -4.31 0.06 -4.65 4.18 3.02 0.18 -4.75 115.26 108.99 1l5i n ASN 34 Ca 0.06 0.49 -0.43 0.00 -0.03 0.00 0.00 54.58 54.67 1l5i n ASN 34 Cb 0.17 -0.50 -0.02 0.00 -0.61 0.00 0.00 39.78 38.82 1l5i n ASN 34 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1l5i s LEU 35 N -3.08 4.10 0.64 3.41 1.02 0.11 -5.01 118.68 119.87 1l5i s LEU 35 Ca 0.14 1.60 -0.10 0.00 0.02 0.00 0.00 54.13 55.79 1l5i s LEU 35 Cb 0.19 -3.54 -0.01 0.00 0.02 0.00 0.00 46.19 42.85 1l5i s LEU 35 CO 0.54 -0.88 1.02 -1.10 0.02 0.00 0.00 176.35 175.95 1l5i s GLN 36 N 3.78 3.19 0.08 1.70 -0.21 -1.26 -4.96 119.66 121.98 1l5i s GLN 36 Ca 0.57 0.48 -0.09 0.00 0.02 0.00 0.00 55.36 56.34 1l5i s GLN 36 Cb -0.21 -2.10 0.00 0.00 1.00 0.00 0.00 33.01 31.69 1l5i s GLN 36 CO 0.19 -0.75 0.20 -0.08 -2.12 0.00 0.00 175.29 172.72 1l5i s THR 37 N -3.20 0.13 -1.33 -0.19 -1.32 -1.26 -5.02 115.64 103.46 1l5i s THR 37 Ca 0.56 -1.10 0.22 0.00 -1.21 0.00 0.00 61.69 60.16 1l5i s THR 37 Cb -0.11 -1.24 0.34 0.00 -1.51 0.00 0.00 72.50 69.99 1l5i s THR 37 CO 0.51 -0.61 1.73 -0.81 -2.21 0.00 0.00 174.62 173.23 1l5i n PRO 38 N 0.10 0.24 0.00 7.08 -0.04 -1.26 -4.59 135.00 136.54 1l5i n PRO 38 Ca -0.16 0.08 0.00 0.00 -0.04 0.00 0.00 63.50 63.39 1l5i n PRO 38 Cb 0.62 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.58 1l5i n PRO 38 CO 0.00 0.00 0.00 -2.37 -0.04 0.00 0.00 175.50 173.09 1l5i n THR 39 N -1.34 0.00 -3.64 0.52 5.66 -1.26 -5.11 114.28 109.11 1l5i n THR 39 Ca 0.09 0.00 -0.07 0.00 -3.05 0.00 0.00 64.05 61.03 1l5i n THR 39 Cb 0.20 0.00 -0.07 0.00 -1.55 0.00 0.00 70.33 68.91 1l5i n THR 39 CO 0.00 0.00 0.00 0.21 -3.05 0.00 0.00 175.07 172.23 1l5i s ASN 40 N 0.34 -0.28 -0.32 1.09 2.47 -1.26 -4.99 114.94 112.00 1l5i s ASN 40 Ca 0.00 0.52 -0.21 0.00 0.42 0.00 0.00 52.86 53.59 1l5i s ASN 40 Cb 0.00 0.52 -0.00 0.00 -1.45 0.00 0.00 41.25 40.31 1l5i s ASN 40 CO 0.00 -0.11 0.66 -0.54 -3.72 0.00 0.00 177.10 173.39 1l5i s LYS 41 N 0.01 3.86 -0.06 0.43 1.02 -1.26 -1.56 119.74 122.18 1l5i s LYS 41 Ca 0.05 0.30 -0.02 0.00 0.02 0.00 0.00 55.97 56.32 1l5i s LYS 41 Cb -0.05 -3.75 -0.01 0.00 -0.52 0.00 0.00 37.83 33.51 1l5i s LYS 41 CO -0.09 -0.63 -0.04 1.25 -0.92 0.00 0.00 175.35 174.92 1l5i h LEU 42 N 9.27 0.00 -8.53 3.17 5.85 -1.51 -3.47 115.31 120.09 1l5i h LEU 42 Ca -0.26 0.00 -0.23 0.00 0.84 0.00 0.00 57.88 58.23 1l5i h LEU 42 Cb 1.11 0.00 -0.15 0.00 0.37 0.00 0.00 40.66 41.99 1l5i h LEU 42 CO 0.83 0.33 -0.66 0.12 -0.34 0.00 0.00 178.44 178.72 1l5i s PHE 43 N -1.45 1.02 -0.05 1.25 2.19 -1.14 -2.09 117.98 117.70 1l5i s PHE 43 Ca -0.03 -1.11 -0.00 0.00 0.33 0.00 0.00 56.93 56.12 1l5i s PHE 43 Cb 0.00 -0.58 0.03 0.00 -1.31 0.00 0.00 43.02 41.16 1l5i s PHE 43 CO 0.05 -0.35 -0.01 0.42 1.83 0.00 0.00 175.22 177.16 1l5i s ILE 44 N -3.83 0.35 -0.30 3.12 1.01 0.13 -2.60 121.20 119.07 1l5i s ILE 44 Ca 0.23 0.07 -0.00 0.00 0.00 0.00 0.00 60.65 60.94 1l5i s ILE 44 Cb 0.07 -0.47 0.06 0.00 0.01 0.00 0.00 42.46 42.13 1l5i s ILE 44 CO 0.02 0.22 -0.00 -0.75 0.00 0.00 0.00 174.94 174.43 1l5i s LYS 45 N 1.50 2.26 -0.24 2.79 2.47 0.16 -1.80 119.74 126.87 1l5i s LYS 45 Ca -0.02 -1.39 -0.01 0.00 -1.56 0.00 0.00 55.97 52.98 1l5i s LYS 45 Cb -0.13 -3.15 0.03 0.00 -1.46 0.00 0.00 37.83 33.12 1l5i s LYS 45 CO -0.03 -0.68 -0.07 0.42 0.16 0.00 0.00 175.35 175.15 1l5i s ILE 46 N 1.17 2.80 -0.01 5.43 1.01 -0.97 0.46 121.20 131.09 1l5i s ILE 46 Ca -0.04 -1.02 0.04 0.00 0.00 0.00 0.00 60.65 59.64 1l5i s ILE 46 Cb -0.20 -2.41 -0.01 0.00 0.01 0.00 0.00 42.46 39.85 1l5i s ILE 46 CO -0.03 0.22 -0.15 0.00 0.00 0.00 0.00 174.94 174.99 1l5i s ARG 48 N -0.33 3.65 -0.06 0.00 3.52 -1.26 -0.49 118.95 123.98 1l5i s ARG 48 Ca 0.05 0.06 -0.04 0.00 -0.13 0.00 0.00 55.73 55.67 1l5i s ARG 48 Cb -0.06 -3.12 0.03 0.00 -1.56 0.00 0.00 34.95 30.24 1l5i s ARG 48 CO -0.01 0.67 0.15 -2.00 -0.81 0.00 0.00 175.30 173.31 1l5i s GLU 49 N -1.50 0.13 -0.13 5.12 2.12 -0.73 -4.91 118.70 118.80 1l5i s GLU 49 Ca 0.25 0.31 -0.11 0.00 0.36 0.00 0.00 54.97 55.78 1l5i s GLU 49 Cb -0.14 -0.06 -0.05 0.00 0.26 0.00 0.00 34.13 34.15 1l5i s GLU 49 CO 0.14 -0.10 0.22 -0.51 -0.54 0.00 0.00 175.26 174.46 1l5i s LEU 50 N 0.69 4.32 0.41 2.70 2.01 -1.26 -0.30 118.68 127.26 1l5i s LEU 50 Ca -0.05 0.50 -0.11 0.00 0.01 0.00 0.00 54.13 54.47 1l5i s LEU 50 Cb -0.07 -2.23 -0.07 0.00 0.01 0.00 0.00 46.19 43.84 1l5i s LEU 50 CO -0.03 0.26 0.79 -1.00 1.01 0.00 0.00 176.35 177.38 1l5i s HIS 51 N -0.32 3.47 -1.34 0.29 3.76 -0.42 -4.87 115.29 115.86 1l5i s HIS 51 Ca 0.15 1.09 0.23 0.00 -0.15 0.00 0.00 55.06 56.38 1l5i s HIS 51 Cb -0.13 -2.48 1.11 0.00 1.11 0.00 0.00 32.58 32.19 1l5i s HIS 51 CO 0.04 -0.13 1.74 -1.91 -0.85 0.00 0.00 174.74 173.63 1l5i n GLU 52 N -1.31 0.25 -0.01 1.40 2.13 -1.26 -2.25 120.64 119.59 1l5i n GLU 52 Ca 0.03 0.08 0.12 0.00 0.66 0.00 0.00 57.16 58.05 1l5i n GLU 52 Cb 0.54 -1.50 0.66 0.00 0.27 0.00 0.00 31.44 31.41 1l5i n GLU 52 CO 0.00 0.00 0.00 0.09 -0.41 0.00 0.00 177.13 176.81 1l5i n ASN 53 N -1.33 0.44 0.00 4.31 3.02 -1.26 -4.85 115.26 115.59 1l5i n ASN 53 Ca 0.10 -1.33 0.00 0.00 -0.03 0.00 0.00 54.58 53.32 1l5i n ASN 53 Cb 0.20 -0.01 0.00 0.00 -0.61 0.00 0.00 39.78 39.35 1l5i n ASN 53 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1l5i n GLY 54 N 0.96 1.09 3.84 7.41 0.00 -0.95 -5.02 105.19 112.52 1l5i n GLY 54 Ca 0.18 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.83 1l5i n GLY 54 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1l5i s GLU 55 N -0.19 3.74 0.09 1.61 -1.05 -1.25 -4.94 118.70 116.70 1l5i s GLU 55 Ca 0.00 0.12 -0.30 0.00 -0.15 0.00 0.00 54.97 54.64 1l5i s GLU 55 Cb 0.00 -3.23 -0.06 0.00 -0.44 0.00 0.00 34.13 30.40 1l5i s GLU 55 CO 0.00 0.68 1.15 -1.25 0.95 0.00 0.00 175.26 176.79 1l5i s PRO 56 N -0.87 4.48 0.20 -4.83 0.04 -1.26 -1.30 135.00 131.46 1l5i s PRO 56 Ca 0.19 1.73 0.10 0.00 0.04 0.00 0.00 61.00 63.06 1l5i s PRO 56 Cb -0.14 -3.34 -0.04 0.00 0.04 0.00 0.00 34.50 31.02 1l5i s PRO 56 CO 0.08 -0.15 -0.17 -1.58 0.04 0.00 0.00 177.00 175.22 1l5i s HIS 57 N 0.70 2.45 -0.00 0.56 2.46 0.59 -0.80 115.29 121.23 1l5i s HIS 57 Ca 0.56 -0.30 0.03 0.00 0.47 0.00 0.00 55.06 55.82 1l5i s HIS 57 Cb -0.29 -1.19 -0.01 0.00 -0.13 0.00 0.00 32.58 30.97 1l5i s HIS 57 CO 0.31 0.53 -0.09 -1.17 -2.47 0.00 0.00 174.74 171.85 1l5i s LEU 58 N -2.84 2.03 0.03 8.88 1.98 -0.93 -1.77 118.68 126.06 1l5i s LEU 58 Ca 0.24 -0.19 0.08 0.00 -2.89 0.00 0.00 54.13 51.37 1l5i s LEU 58 Cb -0.08 -0.45 -0.03 0.00 0.66 0.00 0.00 46.19 46.29 1l5i s LEU 58 CO 0.13 0.09 -0.24 -1.00 -1.89 0.00 0.00 176.35 173.44 1l5i s HIS 59 N -0.28 2.39 -0.04 5.38 3.76 0.36 -2.42 115.29 124.43 1l5i s HIS 59 Ca 0.03 -0.37 -0.03 0.00 -0.15 0.00 0.00 55.06 54.54 1l5i s HIS 59 Cb -0.04 -1.43 0.02 0.00 1.11 0.00 0.00 32.58 32.25 1l5i s HIS 59 CO -0.00 0.14 0.10 0.42 -0.85 0.00 0.00 174.74 174.55 1l5i s ILE 60 N -0.81 -0.03 -0.17 0.60 1.01 -0.80 -1.88 121.20 119.12 1l5i s ILE 60 Ca 0.12 0.10 -0.04 0.00 0.00 0.00 0.00 60.65 60.83 1l5i s ILE 60 Cb -0.10 -0.17 0.06 0.00 0.01 0.00 0.00 42.46 42.26 1l5i s ILE 60 CO 0.02 0.04 0.07 -0.22 0.00 0.00 0.00 174.94 174.86 1l5i s LEU 61 N 0.61 0.58 0.12 2.97 1.98 0.17 -1.47 118.68 123.64 1l5i s LEU 61 Ca -0.05 -0.66 0.08 0.00 -2.89 0.00 0.00 54.13 50.62 1l5i s LEU 61 Cb -0.06 -0.34 -0.04 0.00 0.66 0.00 0.00 46.19 46.40 1l5i s LEU 61 CO -0.03 -0.34 -0.14 -0.63 -1.89 0.00 0.00 176.35 173.32 1l5i s ILE 62 N 2.06 3.07 -0.11 6.68 1.01 -0.59 0.36 121.20 133.68 1l5i s ILE 62 Ca 0.01 -1.42 -0.02 0.00 0.00 0.00 0.00 60.65 59.22 1l5i s ILE 62 Cb -0.16 -2.42 0.04 0.00 0.01 0.00 0.00 42.46 39.92 1l5i s ILE 62 CO -0.09 0.09 0.02 0.00 0.00 0.00 0.00 174.94 174.97 1l5i s GLN 63 N -2.20 0.48 0.33 2.79 1.03 -1.07 -0.98 119.66 120.04 1l5i s GLN 63 Ca 0.20 -0.00 -0.04 0.00 0.04 0.00 0.00 55.36 55.55 1l5i s GLN 63 Cb -0.11 -1.27 -0.05 0.00 0.03 0.00 0.00 33.01 31.62 1l5i s GLN 63 CO 0.12 -0.42 0.60 -0.06 -2.54 0.00 0.00 175.29 172.99 1l5i s PHE 64 N 1.99 3.49 0.38 9.60 0.40 -0.17 -1.30 117.98 132.37 1l5i s PHE 64 Ca 0.03 0.65 0.07 0.00 -0.60 0.00 0.00 56.93 57.08 1l5i s PHE 64 Cb -0.14 -2.12 0.77 0.00 0.51 0.00 0.00 43.02 42.05 1l5i s PHE 64 CO -0.06 0.09 1.97 1.49 0.70 0.00 0.00 175.22 179.41 1l5i h GLU 65 N 1.32 0.45 -5.57 0.44 4.81 -1.60 -3.44 114.58 110.98 1l5i h GLU 65 Ca -0.48 -0.06 -0.45 0.00 -0.13 0.00 0.00 59.36 58.24 1l5i h GLU 65 Cb 1.20 -0.08 -0.15 0.00 0.63 0.00 0.00 28.75 30.35 1l5i h GLU 65 CO 0.65 0.41 -0.74 0.20 -0.73 0.00 0.00 179.01 178.80 1l5i s GLY 66 N -3.84 1.41 0.01 1.92 0.00 -1.26 -5.05 107.32 100.52 1l5i s GLY 66 Ca -0.07 -1.64 -0.31 0.00 0.00 0.00 0.00 44.72 42.70 1l5i s GLY 66 CO 0.74 -1.73 1.96 0.28 0.00 0.00 0.00 173.10 174.34 1l5i n LYS 67 N -0.32 2.73 -3.95 2.90 5.02 -1.26 -4.71 118.16 118.57 1l5i n LYS 67 Ca -0.08 1.00 -0.35 0.00 -2.02 0.00 0.00 58.31 56.85 1l5i n LYS 67 Cb 0.60 -2.94 -0.06 0.00 -0.02 0.00 0.00 35.03 32.62 1l5i n LYS 67 CO 0.00 0.00 0.00 -0.47 -0.52 0.00 0.00 177.40 176.41 1l5i s TYR 68 N 4.35 3.52 -0.31 2.13 5.04 -0.08 -4.88 117.35 127.12 1l5i s TYR 68 Ca 0.90 0.42 -0.11 0.00 -2.44 0.00 0.00 57.07 55.83 1l5i s TYR 68 Cb -0.49 -1.88 -0.03 0.00 0.35 0.00 0.00 41.96 39.92 1l5i s TYR 68 CO 0.44 0.67 0.20 1.21 -1.34 0.00 0.00 175.55 176.74 1l5i s ASN 69 N -1.36 5.94 -0.76 4.32 3.04 -1.26 -2.34 114.94 122.53 1l5i s ASN 69 Ca 0.19 -0.26 0.03 0.00 0.04 0.00 0.00 52.86 52.87 1l5i s ASN 69 Cb -0.12 -2.11 0.27 0.00 -1.54 0.00 0.00 41.25 37.75 1l5i s ASN 69 CO 0.09 -0.15 0.94 0.00 -3.04 0.00 0.00 177.10 174.95 1l5i n THR 71 N 0.96 2.41 -3.61 0.00 5.66 -1.26 -2.83 114.28 115.62 1l5i n THR 71 Ca 0.29 -1.24 -0.01 0.00 -3.05 0.00 0.00 64.05 60.04 1l5i n THR 71 Cb 0.39 -0.64 -0.04 0.00 -1.55 0.00 0.00 70.33 68.49 1l5i n THR 71 CO 0.00 0.00 0.00 0.21 -3.05 0.00 0.00 175.07 172.23 1l5i s ASN 72 N -0.51 -1.10 -0.23 1.09 2.47 -1.26 -4.71 114.94 110.69 1l5i s ASN 72 Ca 0.37 1.48 -0.01 0.00 0.42 0.00 0.00 52.86 55.12 1l5i s ASN 72 Cb 0.31 2.24 0.11 0.00 -1.45 0.00 0.00 41.25 42.46 1l5i s ASN 72 CO 0.07 -0.21 2.23 0.00 -3.72 0.00 0.00 177.10 175.48 1l5i n GLN 73 N 5.40 1.70 -0.00 0.43 6.02 -1.26 -3.53 117.38 126.14 1l5i n GLN 73 Ca -0.11 -1.24 0.01 0.00 -0.01 0.00 0.00 57.00 55.65 1l5i n GLN 73 Cb 0.49 -1.56 -0.02 0.00 1.02 0.00 0.00 30.24 30.17 1l5i n GLN 73 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 1l5i n ARG 74 N 0.86 0.72 0.07 -1.09 1.74 -1.26 -4.48 116.66 113.22 1l5i n ARG 74 Ca 0.26 -0.02 -0.21 0.00 -0.77 0.00 0.00 57.85 57.11 1l5i n ARG 74 Cb 0.58 -1.02 -0.11 0.00 -1.02 0.00 0.00 32.46 30.89 1l5i n ARG 74 CO 0.00 0.00 0.00 0.35 -1.52 0.00 0.00 177.63 176.46 1l5i h PHE 75 N 0.00 0.99 -0.28 -1.55 3.57 -2.02 -3.14 116.94 114.52 1l5i h PHE 75 Ca 0.00 -0.58 0.00 0.00 3.53 0.00 0.00 57.97 60.92 1l5i h PHE 75 Cb 0.12 -0.10 0.00 0.00 2.79 0.00 0.00 35.95 38.76 1l5i h PHE 75 CO 0.00 1.42 0.00 1.19 -2.23 0.00 0.00 178.31 178.69 1l5i n PHE 76 N -3.81 0.50 -1.99 0.41 3.72 -1.26 -4.86 117.46 110.17 1l5i n PHE 76 Ca -0.12 -0.22 -0.43 0.00 -0.05 0.00 0.00 57.45 56.63 1l5i n PHE 76 Cb 0.93 -0.06 -0.03 0.00 -0.94 0.00 0.00 39.48 39.38 1l5i n PHE 76 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 176.76 176.20 1l5i s ASP 77 N -0.83 5.93 -0.12 4.37 1.01 -1.19 -4.48 116.67 121.36 1l5i s ASP 77 Ca 0.20 1.38 -0.04 0.00 0.71 0.00 0.00 52.55 54.80 1l5i s ASP 77 Cb 0.12 -2.53 -0.03 0.00 1.01 0.00 0.00 42.92 41.49 1l5i s ASP 77 CO 0.12 -1.67 0.03 -0.76 0.21 0.00 0.00 175.17 173.10 1l5i s LEU 78 N 6.75 3.68 0.27 1.23 1.43 -0.82 -4.97 118.68 126.25 1l5i s LEU 78 Ca 0.80 0.13 0.08 0.00 -1.03 0.00 0.00 54.13 54.11 1l5i s LEU 78 Cb -0.23 -1.88 -0.06 0.00 0.03 0.00 0.00 46.19 44.05 1l5i s LEU 78 CO 0.34 0.31 -0.09 0.68 0.23 0.00 0.00 176.35 177.81 1l5i s VAL 79 N -0.43 1.81 -0.28 -1.59 -7.23 -1.26 0.36 120.40 111.77 1l5i s VAL 79 Ca 0.09 -2.18 -0.23 0.00 -1.81 0.00 0.00 61.98 57.84 1l5i s VAL 79 Cb -0.12 -2.38 -0.00 0.00 0.56 0.00 0.00 36.38 34.43 1l5i s VAL 79 CO 0.02 -0.35 0.79 -0.55 -0.31 0.00 0.00 175.10 174.69 1l5i s SER 80 N -3.45 6.71 0.00 4.85 0.15 -0.25 -4.90 113.70 116.81 1l5i s SER 80 Ca 0.29 0.78 0.23 0.00 0.70 0.00 0.00 55.95 57.95 1l5i s SER 80 Cb 0.02 -2.41 1.32 0.00 -1.71 0.00 0.00 66.02 63.24 1l5i s SER 80 CO 0.12 -0.56 1.78 -0.81 1.20 0.00 0.00 173.24 174.96 1l5i n PRO 81 N 6.10 0.58 -0.00 5.44 -0.04 -1.26 -2.51 135.00 143.30 1l5i n PRO 81 Ca 0.04 0.03 0.03 0.00 -0.04 0.00 0.00 63.50 63.56 1l5i n PRO 81 Cb 0.48 -1.50 -0.05 0.00 -0.04 0.00 0.00 33.50 32.39 1l5i n PRO 81 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 1l5i n THR 82 N -1.11 0.03 -4.24 0.52 -2.24 -1.26 -5.01 114.28 100.96 1l5i n THR 82 Ca 0.15 -0.17 -0.17 0.00 -2.27 0.00 0.00 64.05 61.59 1l5i n THR 82 Cb 0.12 0.27 -0.13 0.00 -2.10 0.00 0.00 70.33 68.49 1l5i n THR 82 CO 0.00 0.00 0.00 -0.60 -0.57 0.00 0.00 175.07 173.90 1l5i s ARG 83 N -2.47 0.67 -0.96 -0.78 3.52 -1.05 -5.03 118.95 112.85 1l5i s ARG 83 Ca -0.03 -0.52 -0.07 0.00 -0.13 0.00 0.00 55.73 54.98 1l5i s ARG 83 Cb 0.04 -0.60 -0.12 0.00 -1.56 0.00 0.00 34.95 32.71 1l5i s ARG 83 CO 0.29 0.15 2.82 0.45 -0.81 0.00 0.00 175.30 178.21 1l5i n SER 84 N 2.27 6.55 -3.99 -2.12 2.88 -1.26 -3.85 113.62 114.10 1l5i n SER 84 Ca -0.17 -2.44 -0.23 0.00 -1.33 0.00 0.00 58.87 54.71 1l5i n SER 84 Cb 0.56 -1.34 -0.16 0.00 -0.75 0.00 0.00 64.21 62.52 1l5i n SER 84 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1l5i s ALA 85 N 2.20 1.05 -0.00 -1.46 0.00 -1.26 -5.04 121.76 117.24 1l5i s ALA 85 Ca 0.59 -0.32 -0.01 0.00 0.00 0.00 0.00 51.96 52.22 1l5i s ALA 85 Cb 0.19 -0.47 -0.04 0.00 0.00 0.00 0.00 23.12 22.80 1l5i s ALA 85 CO -0.04 0.10 0.13 -1.01 0.00 0.00 0.00 175.76 174.95 1l5i s HIS 86 N 0.59 3.41 -0.06 0.00 3.76 -1.26 -1.09 115.29 120.64 1l5i s HIS 86 Ca -0.11 0.27 0.03 0.00 -0.15 0.00 0.00 55.06 55.10 1l5i s HIS 86 Cb -0.14 -1.78 0.00 0.00 1.11 0.00 0.00 32.58 31.78 1l5i s HIS 86 CO 0.02 0.60 -0.16 -0.06 -0.85 0.00 0.00 174.74 174.29 1l5i s PHE 87 N -1.27 1.70 -0.44 1.40 0.08 0.16 -4.98 117.98 114.63 1l5i s PHE 87 Ca 0.26 -0.59 -0.07 0.00 0.12 0.00 0.00 56.93 56.65 1l5i s PHE 87 Cb -0.12 -1.18 0.11 0.00 -0.57 0.00 0.00 43.02 41.25 1l5i s PHE 87 CO 0.17 -0.25 0.28 -1.58 -0.10 0.00 0.00 175.22 173.74 1l5i s HIS 88 N 0.37 3.44 0.69 0.36 5.65 -1.26 -1.95 115.29 122.59 1l5i s HIS 88 Ca -0.11 -1.93 -0.11 0.00 0.25 0.00 0.00 55.06 53.16 1l5i s HIS 88 Cb -0.14 -3.26 0.01 0.00 -1.18 0.00 0.00 32.58 28.00 1l5i s HIS 88 CO 0.04 -0.95 1.06 -1.25 -0.65 0.00 0.00 174.74 172.99 1l5i s PRO 89 N 1.32 2.94 -0.22 2.88 0.04 -1.26 -4.98 135.00 135.71 1l5i s PRO 89 Ca 0.05 0.96 -0.22 0.00 0.04 0.00 0.00 61.00 61.83 1l5i s PRO 89 Cb -0.24 -1.99 -0.02 0.00 0.04 0.00 0.00 34.50 32.29 1l5i s PRO 89 CO -0.01 -1.10 0.71 -0.80 0.04 0.00 0.00 177.00 175.84 1l5i s ASN 90 N -3.77 6.73 -0.07 6.66 0.01 -0.54 -4.84 114.94 119.12 1l5i s ASN 90 Ca 0.58 0.90 -0.22 0.00 -0.71 0.00 0.00 52.86 53.41 1l5i s ASN 90 Cb -0.14 -2.38 -0.04 0.00 0.41 0.00 0.00 41.25 39.10 1l5i s ASN 90 CO 0.55 -0.39 0.65 -0.63 -1.51 0.00 0.00 177.10 175.77 1l5i s ILE 91 N 2.38 5.06 -0.03 0.60 1.01 -1.26 -2.37 121.20 126.59 1l5i s ILE 91 Ca 0.31 1.33 0.01 0.00 0.00 0.00 0.00 60.65 62.30 1l5i s ILE 91 Cb -0.16 -3.99 0.01 0.00 0.01 0.00 0.00 42.46 38.34 1l5i s ILE 91 CO 0.09 0.28 -0.04 -1.10 0.00 0.00 0.00 174.94 174.17 1l5i s GLN 92 N 0.68 0.63 -0.37 2.79 -0.21 -0.71 -4.97 119.66 117.51 1l5i s GLN 92 Ca 0.35 -0.11 -0.21 0.00 0.02 0.00 0.00 55.36 55.41 1l5i s GLN 92 Cb -0.17 -0.66 0.01 0.00 1.00 0.00 0.00 33.01 33.18 1l5i s GLN 92 CO 0.17 -0.02 0.66 0.20 -2.12 0.00 0.00 175.29 174.17 1l5i s GLY 93 N 0.59 1.73 -0.38 3.09 0.00 -1.26 -0.60 107.32 110.49 1l5i s GLY 93 Ca -0.07 -0.86 -0.24 0.00 0.00 0.00 0.00 44.72 43.54 1l5i s GLY 93 CO -0.00 1.53 0.84 0.00 0.00 0.00 0.00 173.10 175.47 1l5i s ALA 94 N 2.77 3.39 1.00 3.20 0.00 -0.00 -4.99 121.76 127.12 1l5i s ALA 94 Ca 0.25 -0.64 0.00 0.00 0.00 0.00 0.00 51.96 51.57 1l5i s ALA 94 Cb -0.14 -3.45 0.00 0.00 0.00 0.00 0.00 23.12 19.52 1l5i s ALA 94 CO 0.16 -1.62 0.00 0.36 0.00 0.00 0.00 175.76 174.65 1l5i n LYS 95 N 6.63 2.07 -3.31 0.00 2.85 -1.26 -3.81 118.16 121.33 1l5i n LYS 95 Ca 0.04 0.00 -0.37 0.00 -1.05 0.00 0.00 58.31 56.94 1l5i n LYS 95 Cb 0.48 0.00 -0.06 0.00 -0.65 0.00 0.00 35.03 34.80 1l5i n LYS 95 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 177.40 177.80 1l5i s SER 96 N -1.86 6.94 0.00 -5.58 0.15 -1.26 -4.80 113.70 107.29 1l5i s SER 96 Ca 0.00 1.17 0.00 0.00 0.70 0.00 0.00 55.95 57.82 1l5i s SER 96 Cb 0.00 -2.33 0.00 0.00 -1.71 0.00 0.00 66.02 61.98 1l5i s SER 96 CO 0.00 0.17 0.00 -1.20 1.20 0.00 0.00 173.24 173.41 1l5i n SER 97 N 1.17 0.00 -0.01 5.45 7.64 -1.26 -4.97 113.62 121.65 1l5i n SER 97 Ca -0.07 0.00 0.15 0.00 1.01 0.00 0.00 58.87 59.95 1l5i n SER 97 Cb 0.51 0.00 0.71 0.00 -1.01 0.00 0.00 64.21 64.42 1l5i n SER 97 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 1l5i n SER 98 N 0.00 0.03 -0.17 6.43 7.64 -1.26 -3.68 113.62 122.62 1l5i n SER 98 Ca 0.00 -0.00 0.28 0.00 1.01 0.00 0.00 58.87 60.16 1l5i n SER 98 Cb 0.00 -0.32 0.59 0.00 -1.01 0.00 0.00 64.21 63.47 1l5i n SER 98 CO 0.00 0.00 0.00 -0.78 -3.01 0.00 0.00 175.04 171.25 1l5i h ASP 99 N 0.03 0.00 -0.35 6.43 3.58 -2.00 1.97 116.42 126.08 1l5i h ASP 99 Ca 0.00 0.00 -0.08 0.00 0.42 0.00 0.00 57.03 57.37 1l5i h ASP 99 Cb 0.35 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 41.39 1l5i h ASP 99 CO 0.00 0.00 -0.10 -0.37 -2.88 0.00 0.00 179.24 175.89 1l5i h VAL 100 N 0.00 1.28 -0.67 2.25 -1.51 -2.00 -1.80 116.25 113.81 1l5i h VAL 100 Ca 0.44 -1.18 -0.03 0.00 -1.23 0.00 0.00 66.70 64.70 1l5i h VAL 100 Cb 2.37 1.33 -0.03 0.00 -2.13 0.00 0.00 31.29 32.83 1l5i h VAL 100 CO -0.00 0.39 0.32 0.50 -1.23 0.00 0.00 177.57 177.54 1l5i h LYS 101 N 0.47 0.96 -0.49 5.19 1.63 0.28 0.23 116.57 124.84 1l5i h LYS 101 Ca 0.09 -0.14 0.04 0.00 -0.85 0.00 0.00 60.65 59.78 1l5i h LYS 101 Cb 0.62 -0.17 -0.04 0.00 -0.60 0.00 0.00 32.23 32.03 1l5i h LYS 101 CO 0.04 0.77 0.26 1.03 -3.45 0.00 0.00 179.45 178.09 1l5i h SER 102 N 0.93 0.38 -0.05 4.20 0.87 -1.20 0.28 113.55 118.96 1l5i h SER 102 Ca 0.23 0.02 -0.13 0.00 -1.23 0.00 0.00 61.79 60.69 1l5i h SER 102 Cb 0.12 -0.05 -0.01 0.00 -0.44 0.00 0.00 62.40 62.02 1l5i h SER 102 CO -0.03 0.27 -0.37 0.22 -0.53 0.00 0.00 176.83 176.39 1l5i h TYR 103 N 0.51 0.65 -0.53 2.24 3.20 -0.87 -2.19 116.97 119.98 1l5i h TYR 103 Ca 0.21 -0.18 -0.09 0.00 3.14 0.00 0.00 58.73 61.82 1l5i h TYR 103 Cb 0.10 -0.14 -0.02 0.00 1.54 0.00 0.00 36.73 38.20 1l5i h TYR 103 CO -0.09 0.85 -0.01 0.82 -1.64 0.00 0.00 178.16 178.08 1l5i h ILE 104 N 0.46 1.26 -0.02 1.81 2.04 0.26 -2.05 117.51 121.26 1l5i h ILE 104 Ca 0.05 -1.09 -0.08 0.00 1.00 0.00 0.00 64.86 64.73 1l5i h ILE 104 Cb 0.86 0.86 -0.01 0.00 -0.74 0.00 0.00 36.82 37.79 1l5i h ILE 104 CO 0.07 0.39 -0.36 0.44 0.00 0.00 0.00 178.15 178.69 1l5i h ASP 105 N 0.83 0.05 -0.24 1.72 5.19 -0.24 -3.33 116.42 120.40 1l5i h ASP 105 Ca 0.15 -0.02 -0.62 0.00 -0.62 0.00 0.00 57.03 55.93 1l5i h ASP 105 Cb 0.51 -0.01 -0.02 0.00 0.18 0.00 0.00 39.33 39.99 1l5i h ASP 105 CO 0.03 0.41 2.32 0.29 -3.12 0.00 0.00 179.24 179.17 1l5i n LYS 106 N -4.10 2.24 -2.08 3.56 5.02 -0.77 -4.92 118.16 117.11 1l5i n LYS 106 Ca -0.02 -2.45 -0.28 0.00 -2.02 0.00 0.00 58.31 53.54 1l5i n LYS 106 Cb 0.41 -3.28 0.06 0.00 -0.02 0.00 0.00 35.03 32.19 1l5i n LYS 106 CO 0.00 0.00 0.00 0.16 -0.52 0.00 0.00 177.40 177.04 1l5i s ASP 107 N 4.57 5.09 0.00 4.39 -4.77 -1.25 -4.97 116.67 119.73 1l5i s ASP 107 Ca 0.56 0.78 0.00 0.00 -3.30 0.00 0.00 52.55 50.59 1l5i s ASP 107 Cb 0.10 -1.51 0.00 0.00 -1.09 0.00 0.00 42.92 40.42 1l5i s ASP 107 CO 0.05 -1.48 0.00 0.61 0.70 0.00 0.00 175.17 175.05 1l5i n GLY 108 N -2.97 0.47 2.53 2.12 0.00 -1.26 -4.95 105.19 101.13 1l5i n GLY 108 Ca 0.07 0.34 -0.17 0.00 0.00 0.00 0.00 46.02 46.26 1l5i n GLY 108 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1l5i n ASP 109 N 0.00 -4.98 -4.46 1.61 9.92 -1.26 -4.87 116.55 112.51 1l5i n ASP 109 Ca 0.00 -0.12 -0.23 0.00 -0.53 0.00 0.00 54.79 53.90 1l5i n ASP 109 Cb 0.00 -3.95 -0.10 0.00 -0.64 0.00 0.00 41.12 36.43 1l5i n ASP 109 CO 0.00 0.00 0.00 0.68 0.13 0.00 0.00 177.20 178.01 1l5i s VAL 110 N -2.93 2.16 0.00 2.53 -7.23 -1.26 -4.48 120.40 109.20 1l5i s VAL 110 Ca 0.12 -2.27 0.00 0.00 -1.81 0.00 0.00 61.98 58.02 1l5i s VAL 110 Cb -0.05 -2.38 -0.04 0.00 0.56 0.00 0.00 36.38 34.47 1l5i s VAL 110 CO 0.15 -0.36 0.07 -0.22 -0.31 0.00 0.00 175.10 174.43 1l5i s LEU 111 N -3.50 3.82 -0.08 1.32 0.20 0.10 -5.02 118.68 115.53 1l5i s LEU 111 Ca 0.29 0.11 0.01 0.00 0.69 0.00 0.00 54.13 55.23 1l5i s LEU 111 Cb -0.01 -2.24 0.02 0.00 -0.43 0.00 0.00 46.19 43.53 1l5i s LEU 111 CO 0.14 0.27 -0.08 -1.61 -0.29 0.00 0.00 176.35 174.78 1l5i s GLU 112 N -1.74 1.36 0.09 1.98 2.02 -1.26 -2.30 118.70 118.85 1l5i s GLU 112 Ca 0.23 -0.25 0.05 0.00 0.02 0.00 0.00 54.97 55.02 1l5i s GLU 112 Cb -0.12 -1.31 -0.03 0.00 0.10 0.00 0.00 34.13 32.77 1l5i s GLU 112 CO 0.14 -0.13 -0.14 -0.46 0.02 0.00 0.00 175.26 174.69 1l5i s TRP 113 N 1.20 1.28 0.18 1.61 -0.00 -0.75 -5.00 118.94 117.46 1l5i s TRP 113 Ca -0.05 -0.49 0.00 0.00 -0.00 0.00 0.00 56.10 55.56 1l5i s TRP 113 Cb -0.14 -0.71 0.00 0.00 -0.00 0.00 0.00 33.47 32.62 1l5i s TRP 113 CO -0.02 0.08 0.00 0.41 -0.00 0.00 0.00 176.95 177.42 1l5i n GLY 114 N 1.06 -1.86 3.03 5.86 0.00 -1.26 0.17 105.19 112.19 1l5i n GLY 114 Ca -0.20 -1.24 -0.31 0.00 0.00 0.00 0.00 46.02 44.27 1l5i n GLY 114 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1l5i s THR 115 N -1.43 1.71 0.39 2.61 2.01 -0.89 -4.72 115.64 115.33 1l5i s THR 115 Ca 0.00 -0.88 -0.23 0.00 0.31 0.00 0.00 61.69 60.89 1l5i s THR 115 Cb 0.00 -1.68 -0.10 0.00 0.01 0.00 0.00 72.50 70.73 1l5i s THR 115 CO 0.00 0.34 0.95 0.12 -0.69 0.00 0.00 174.62 175.34 1l5i s PHE 116 N 1.40 3.44 -0.11 4.92 2.19 -1.26 -4.20 117.98 124.36 1l5i s PHE 116 Ca 0.02 1.68 -0.05 0.00 0.33 0.00 0.00 56.93 58.91 1l5i s PHE 116 Cb -0.15 -2.89 0.05 0.00 -1.31 0.00 0.00 43.02 38.72 1l5i s PHE 116 CO -0.10 -0.03 0.23 1.14 1.83 0.00 0.00 175.22 178.29 1l5i s GLN 117 N -2.73 0.15 0.16 10.12 -2.07 -1.26 -5.06 119.66 118.98 1l5i s GLN 117 Ca 0.58 0.60 -0.30 0.00 -1.82 0.00 0.00 55.36 54.42 1l5i s GLN 117 Cb -0.13 -0.11 -0.07 0.00 -1.09 0.00 0.00 33.01 31.60 1l5i s GLN 117 CO 0.18 -0.22 0.94 0.42 -1.32 0.00 0.00 175.29 175.28 1l5i s ILE 118 N 1.79 4.34 -0.24 3.63 1.09 -1.26 -5.04 121.20 125.51 1l5i s ILE 118 Ca -0.04 2.05 -0.13 0.00 -1.10 0.00 0.00 60.65 61.42 1l5i s ILE 118 Cb -0.11 -4.31 0.07 0.00 -1.06 0.00 0.00 42.46 37.05 1l5i s ILE 118 CO -0.08 0.40 0.58 -1.81 -0.10 0.00 0.00 174.94 173.93 1l5i s ASP 119 N -0.51 -0.79 -0.30 3.58 1.01 -1.26 -5.15 116.67 113.25 1l5i s ASP 119 Ca 0.44 1.29 -0.16 0.00 0.71 0.00 0.00 52.55 54.83 1l5i s ASP 119 Cb -0.24 1.21 0.19 0.00 1.01 0.00 0.00 42.92 45.09 1l5i s ASP 119 CO 0.30 -0.22 1.19 -0.83 0.21 0.00 0.00 175.17 175.82 1l5i s GLY 120 N 1.64 0.46 0.00 0.21 0.00 -1.26 -5.06 107.32 103.31 1l5i s GLY 120 Ca -0.09 3.66 0.00 0.00 0.00 0.00 0.00 44.72 48.28 1l5i s GLY 120 CO -0.17 2.75 0.00 -2.13 0.00 0.00 0.00 173.10 173.55