#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1l5i n GLY 5 N 0.00 2.20 3.17 5.00 0.00 -1.26 -5.14 105.19 109.16 1l5i n GLY 5 Ca 0.00 -2.25 -0.16 0.00 0.00 0.00 0.00 46.02 43.61 1l5i n GLY 5 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1l5i s ARG 6 N -4.46 0.83 -0.61 1.61 0.52 -1.26 -5.09 118.95 110.49 1l5i s ARG 6 Ca 0.51 -1.05 -0.27 0.00 -0.52 0.00 0.00 55.73 54.39 1l5i s ARG 6 Cb -0.04 -0.66 0.00 0.00 0.52 0.00 0.00 34.95 34.77 1l5i s ARG 6 CO 0.32 0.13 1.58 0.12 0.02 0.00 0.00 175.30 177.47 1l5i s PHE 7 N -1.88 2.01 -0.14 -0.53 5.36 -1.26 -4.95 117.98 116.60 1l5i s PHE 7 Ca 0.02 0.49 -0.01 0.00 -0.96 0.00 0.00 56.93 56.46 1l5i s PHE 7 Cb -0.06 -4.31 0.04 0.00 -0.34 0.00 0.00 43.02 38.35 1l5i s PHE 7 CO 0.01 -2.19 -0.01 0.45 -1.46 0.00 0.00 175.22 172.02 1l5i s SER 8 N 5.80 2.37 -0.12 6.13 0.15 -1.26 -4.12 113.70 122.65 1l5i s SER 8 Ca 0.56 -0.48 -0.02 0.00 0.70 0.00 0.00 55.95 56.71 1l5i s SER 8 Cb -0.12 -0.65 -0.03 0.00 -1.71 0.00 0.00 66.02 63.52 1l5i s SER 8 CO 0.22 -0.22 -0.04 -0.63 1.20 0.00 0.00 173.24 173.76 1l5i s ILE 9 N 1.83 3.88 -0.16 6.45 1.01 -1.13 -4.91 121.20 128.17 1l5i s ILE 9 Ca 0.02 -0.39 -0.03 0.00 0.00 0.00 0.00 60.65 60.26 1l5i s ILE 9 Cb -0.15 -2.65 0.05 0.00 0.01 0.00 0.00 42.46 39.73 1l5i s ILE 9 CO -0.07 0.55 0.03 -0.54 0.00 0.00 0.00 174.94 174.91 1l5i s LYS 10 N -0.22 0.62 0.16 2.79 1.02 -1.26 0.59 119.74 123.43 1l5i s LYS 10 Ca 0.04 -0.27 -0.24 0.00 0.02 0.00 0.00 55.97 55.52 1l5i s LYS 10 Cb -0.13 -1.82 0.06 0.00 -0.52 0.00 0.00 37.83 35.42 1l5i s LYS 10 CO 0.02 -0.56 0.72 0.00 -0.92 0.00 0.00 175.35 174.62 1l5i s ALA 11 N 1.90 -1.55 0.04 5.17 0.00 -1.01 -4.97 121.76 121.33 1l5i s ALA 11 Ca 0.01 0.35 0.04 0.00 0.00 0.00 0.00 51.96 52.36 1l5i s ALA 11 Cb -0.16 0.76 -0.24 0.00 0.00 0.00 0.00 23.12 23.48 1l5i s ALA 11 CO -0.07 -0.85 0.98 -0.22 0.00 0.00 0.00 175.76 175.59 1l5i h LYS 12 N 2.00 0.11 -6.47 0.00 3.64 -1.84 0.14 116.57 114.15 1l5i h LYS 12 Ca -0.27 -0.18 -0.68 0.00 -1.27 0.00 0.00 60.65 58.25 1l5i h LYS 12 Cb 1.27 0.07 -0.20 0.00 -0.41 0.00 0.00 32.23 32.96 1l5i h LYS 12 CO 0.32 0.94 -0.77 -0.80 -2.27 0.00 0.00 179.45 176.87 1l5i s ASN 13 N -6.69 4.11 -0.00 4.20 0.01 -1.26 -1.46 114.94 113.85 1l5i s ASN 13 Ca -0.04 -0.32 0.03 0.00 -0.71 0.00 0.00 52.86 51.81 1l5i s ASN 13 Cb 0.08 -0.79 -0.01 0.00 0.41 0.00 0.00 41.25 40.94 1l5i s ASN 13 CO 0.84 0.26 -0.08 -0.31 -1.51 0.00 0.00 177.10 176.30 1l5i s TYR 14 N -0.95 0.75 -0.16 2.20 2.02 -0.67 -1.51 117.35 119.04 1l5i s TYR 14 Ca 0.16 -0.17 0.02 0.00 -0.37 0.00 0.00 57.07 56.70 1l5i s TYR 14 Cb -0.11 -0.48 0.02 0.00 -0.40 0.00 0.00 41.96 40.99 1l5i s TYR 14 CO 0.06 -0.01 -0.20 -0.06 -1.57 0.00 0.00 175.55 173.77 1l5i s PHE 15 N -0.29 2.63 -0.10 2.71 0.08 0.75 -2.21 117.98 121.55 1l5i s PHE 15 Ca 0.02 -1.44 -0.03 0.00 0.12 0.00 0.00 56.93 55.60 1l5i s PHE 15 Cb -0.04 -1.82 -0.04 0.00 -0.57 0.00 0.00 43.02 40.56 1l5i s PHE 15 CO -0.00 -0.70 0.04 -0.51 -0.10 0.00 0.00 175.22 173.95 1l5i s LEU 16 N 1.09 3.81 -0.14 -0.37 2.01 -0.71 -1.12 118.68 123.25 1l5i s LEU 16 Ca -0.01 0.24 -0.00 0.00 0.01 0.00 0.00 54.13 54.37 1l5i s LEU 16 Cb -0.14 -1.89 0.03 0.00 0.01 0.00 0.00 46.19 44.20 1l5i s LEU 16 CO -0.08 0.39 -0.09 -0.89 1.01 0.00 0.00 176.35 176.69 1l5i s THR 17 N -0.92 1.24 -0.45 5.49 2.01 -0.98 -2.24 115.64 119.79 1l5i s THR 17 Ca 0.14 -0.48 -0.08 0.00 0.31 0.00 0.00 61.69 61.58 1l5i s THR 17 Cb -0.12 -1.25 0.11 0.00 0.01 0.00 0.00 72.50 71.26 1l5i s THR 17 CO 0.03 0.35 0.31 -0.31 -0.69 0.00 0.00 174.62 174.31 1l5i s TYR 18 N 1.61 3.43 0.18 4.92 1.51 -0.87 -1.67 117.35 126.46 1l5i s TYR 18 Ca 0.04 -1.88 -0.30 0.00 -1.01 0.00 0.00 57.07 53.92 1l5i s TYR 18 Cb -0.13 -3.34 -0.08 0.00 -0.11 0.00 0.00 41.96 38.30 1l5i s TYR 18 CO -0.09 -0.96 1.12 -1.25 -1.11 0.00 0.00 175.55 173.26 1l5i s PRO 19 N 1.34 4.57 -1.48 -1.71 0.04 -1.26 -2.31 135.00 134.19 1l5i s PRO 19 Ca 0.05 1.75 -0.01 0.00 0.04 0.00 0.00 61.00 62.83 1l5i s PRO 19 Cb -0.25 -3.27 0.00 0.00 0.04 0.00 0.00 34.50 31.02 1l5i s PRO 19 CO -0.01 0.04 0.02 1.17 0.04 0.00 0.00 177.00 178.26 1l5i n LYS 20 N 2.42 -0.92 -3.98 4.56 4.81 -0.92 -4.88 118.16 119.24 1l5i n LYS 20 Ca 0.03 0.08 -0.35 0.00 -0.87 0.00 0.00 58.31 57.20 1l5i n LYS 20 Cb 0.46 -3.40 -0.13 0.00 0.02 0.00 0.00 35.03 31.98 1l5i n LYS 20 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1l5i n ASP 22 N 4.44 1.83 -4.74 0.00 5.68 -1.26 -4.53 116.55 117.97 1l5i n ASP 22 Ca -0.17 -2.12 -0.41 0.00 -0.50 0.00 0.00 54.79 51.59 1l5i n ASP 22 Cb 0.52 -0.32 -0.03 0.00 -1.14 0.00 0.00 41.12 40.14 1l5i n ASP 22 CO 0.00 0.00 0.00 -0.22 -1.33 0.00 0.00 177.20 175.65 1l5i s LEU 23 N -0.98 4.43 0.56 -2.12 2.96 -1.26 -5.02 118.68 117.26 1l5i s LEU 23 Ca 0.17 2.32 -0.07 0.00 -0.22 0.00 0.00 54.13 56.34 1l5i s LEU 23 Cb 0.11 -3.61 -0.01 0.00 0.50 0.00 0.00 46.19 43.18 1l5i s LEU 23 CO 0.09 -0.46 0.89 0.42 -1.32 0.00 0.00 176.35 175.97 1l5i s THR 24 N 0.06 4.20 0.30 3.68 -4.23 -1.26 -4.94 115.64 113.44 1l5i s THR 24 Ca 0.55 0.20 0.13 0.00 -1.18 0.00 0.00 61.69 61.39 1l5i s THR 24 Cb -0.35 -3.64 0.05 0.00 1.34 0.00 0.00 72.50 69.90 1l5i s THR 24 CO 0.37 -0.69 1.72 0.07 -0.54 0.00 0.00 174.62 175.56 1l5i h LYS 25 N -0.09 0.00 -0.14 3.99 2.10 -1.97 -1.16 116.57 119.31 1l5i h LYS 25 Ca -0.46 0.00 -0.02 0.00 -2.00 0.00 0.00 60.65 58.17 1l5i h LYS 25 Cb 1.23 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 32.56 1l5i h LYS 25 CO 0.61 0.47 0.02 0.93 -2.00 0.00 0.00 179.45 179.48 1l5i h GLU 26 N 0.00 0.24 -0.33 0.07 5.08 -1.97 1.44 114.58 119.11 1l5i h GLU 26 Ca -0.00 -0.07 -0.06 0.00 -1.00 0.00 0.00 59.36 58.23 1l5i h GLU 26 Cb 0.88 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 30.09 1l5i h GLU 26 CO 0.06 0.44 -0.02 -0.91 -1.00 0.00 0.00 179.01 177.58 1l5i h ASN 27 N 0.00 0.58 -0.04 1.42 -0.26 -1.93 0.34 115.58 115.69 1l5i h ASN 27 Ca 0.04 -0.32 -0.10 0.00 -0.56 0.00 0.00 56.30 55.36 1l5i h ASN 27 Cb 0.32 -0.16 -0.01 0.00 -1.06 0.00 0.00 38.32 37.41 1l5i h ASN 27 CO 0.00 0.76 -0.26 0.00 -1.06 0.00 0.00 177.43 176.87 1l5i h ALA 28 N 0.84 1.09 -0.34 -0.83 0.00 -1.13 0.34 119.26 119.23 1l5i h ALA 28 Ca 0.09 -0.35 -0.13 0.00 0.00 0.00 0.00 54.91 54.52 1l5i h ALA 28 Cb 0.48 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 1l5i h ALA 28 CO 0.02 0.56 -0.28 1.25 0.00 0.00 0.00 179.25 180.80 1l5i h LEU 29 N 0.42 0.83 -0.22 0.00 7.12 0.23 0.74 115.31 124.43 1l5i h LEU 29 Ca 0.06 -0.45 -0.07 0.00 0.13 0.00 0.00 57.88 57.55 1l5i h LEU 29 Cb 0.69 -0.23 -0.00 0.00 -0.53 0.00 0.00 40.66 40.58 1l5i h LEU 29 CO 0.05 1.11 -0.14 0.77 -0.13 0.00 0.00 178.44 180.10 1l5i h SER 30 N 0.57 0.51 -0.11 1.25 4.64 -0.03 0.46 113.55 120.84 1l5i h SER 30 Ca 0.06 -0.44 -0.03 0.00 -0.47 0.00 0.00 61.79 60.92 1l5i h SER 30 Cb 0.85 -0.14 -0.00 0.00 -0.31 0.00 0.00 62.40 62.80 1l5i h SER 30 CO 0.07 0.83 -0.03 1.56 -0.87 0.00 0.00 176.83 178.39 1l5i h GLN 31 N 0.18 0.21 -0.30 4.77 4.20 -0.29 0.32 115.11 124.20 1l5i h GLN 31 Ca 0.04 -0.08 -0.01 0.00 0.06 0.00 0.00 58.65 58.66 1l5i h GLN 31 Cb 0.66 -0.01 -0.01 0.00 0.30 0.00 0.00 27.48 28.42 1l5i h GLN 31 CO 0.04 0.53 0.14 0.82 -0.67 0.00 0.00 178.83 179.69 1l5i h ILE 32 N -0.12 1.17 -0.40 2.54 1.08 0.48 0.71 117.51 122.96 1l5i h ILE 32 Ca 0.03 -0.49 -0.05 0.00 -0.39 0.00 0.00 64.86 63.96 1l5i h ILE 32 Cb 0.46 0.93 -0.02 0.00 -3.07 0.00 0.00 36.82 35.11 1l5i h ILE 32 CO 0.01 0.17 0.04 0.74 -0.69 0.00 0.00 178.15 178.42 1l5i h THR 33 N 0.35 1.20 -0.00 -0.27 2.02 -0.04 -0.53 112.91 115.64 1l5i h THR 33 Ca 0.10 -0.79 0.00 0.00 0.77 0.00 0.00 66.41 66.49 1l5i h THR 33 Cb 0.15 0.86 0.00 0.00 -1.74 0.00 0.00 68.15 67.41 1l5i h THR 33 CO -0.01 0.28 -0.17 0.59 0.37 0.00 0.00 175.52 176.58 1l5i n ASN 34 N -4.28 0.25 -4.65 4.18 5.03 0.11 -4.78 115.26 111.12 1l5i n ASN 34 Ca 0.02 0.01 -0.43 0.00 0.87 0.00 0.00 54.58 55.06 1l5i n ASN 34 Cb 0.24 -0.18 -0.02 0.00 -1.02 0.00 0.00 39.78 38.80 1l5i n ASN 34 CO 0.00 0.00 0.00 -0.76 -1.83 0.00 0.00 177.26 174.67 1l5i s LEU 35 N -2.86 4.09 0.79 3.41 1.02 0.24 -5.00 118.68 120.37 1l5i s LEU 35 Ca 0.17 1.59 -0.11 0.00 0.02 0.00 0.00 54.13 55.80 1l5i s LEU 35 Cb 0.19 -3.54 0.06 0.00 0.02 0.00 0.00 46.19 42.92 1l5i s LEU 35 CO 0.56 -0.89 1.09 -1.10 0.02 0.00 0.00 176.35 176.03 1l5i s GLN 36 N 3.79 2.18 0.07 1.70 -0.21 -1.26 -4.96 119.66 120.97 1l5i s GLN 36 Ca 0.57 0.81 -0.09 0.00 0.02 0.00 0.00 55.36 56.66 1l5i s GLN 36 Cb -0.21 -1.92 0.00 0.00 1.00 0.00 0.00 33.01 31.88 1l5i s GLN 36 CO 0.19 -1.60 0.20 -0.08 -2.12 0.00 0.00 175.29 171.88 1l5i s THR 37 N -3.06 0.13 0.05 -0.19 -1.32 -1.26 -5.04 115.64 104.94 1l5i s THR 37 Ca 0.61 -1.04 0.18 0.00 -1.21 0.00 0.00 61.69 60.22 1l5i s THR 37 Cb -0.15 -1.17 0.11 0.00 -1.51 0.00 0.00 72.50 69.78 1l5i s THR 37 CO 0.55 -0.58 1.63 1.55 -2.21 0.00 0.00 174.62 175.57 1l5i h PRO 38 N 3.00 0.00 0.00 7.08 0.13 -1.98 -3.42 132.00 136.81 1l5i h PRO 38 Ca -0.33 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.80 1l5i h PRO 38 Cb 1.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 1l5i h PRO 38 CO 0.53 0.42 0.00 -2.37 -0.23 0.00 0.00 178.00 176.34 1l5i n THR 39 N -3.40 0.00 -3.64 1.56 5.66 -1.26 -5.11 114.28 108.09 1l5i n THR 39 Ca 0.01 0.00 -0.05 0.00 -3.05 0.00 0.00 64.05 60.96 1l5i n THR 39 Cb 0.59 0.00 -0.07 0.00 -1.55 0.00 0.00 70.33 69.30 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 -1.00 -0.37 -0.25 1.09 3.04 -1.26 -4.95 114.94 111.25 1l5i s ASN 40 Ca 0.00 0.65 -0.23 0.00 0.04 0.00 0.00 52.86 53.32 1l5i s ASN 40 Cb 0.00 0.89 -0.01 0.00 -1.54 0.00 0.00 41.25 40.59 1l5i s ASN 40 CO 0.00 -0.11 0.76 -0.54 -3.04 0.00 0.00 177.10 174.17 1l5i s LYS 41 N 0.68 4.15 0.00 0.43 1.02 -1.26 -1.29 119.74 123.47 1l5i s LYS 41 Ca -0.02 0.79 0.00 0.00 0.02 0.00 0.00 55.97 56.76 1l5i s LYS 41 Cb -0.04 -3.65 0.00 0.00 -0.52 0.00 0.00 37.83 33.62 1l5i s LYS 41 CO -0.11 -0.49 0.00 -0.11 -0.92 0.00 0.00 175.35 173.71 1l5i n LEU 42 N 5.92 0.30 -4.85 3.17 7.94 -0.81 -4.91 117.00 123.76 1l5i n LEU 42 Ca 0.03 0.00 -0.25 0.00 -1.11 0.00 0.00 56.01 54.68 1l5i n LEU 42 Cb 0.48 0.00 -0.04 0.00 0.53 0.00 0.00 43.42 44.39 1l5i n LEU 42 CO 0.46 0.00 -0.17 0.12 -1.11 0.00 0.00 177.39 176.69 1l5i s PHE 43 N 0.00 3.26 -0.10 1.96 5.36 -1.14 -3.54 117.98 123.78 1l5i s PHE 43 Ca 0.00 0.01 -0.03 0.00 -0.96 0.00 0.00 56.93 55.96 1l5i s PHE 43 Cb 0.00 -1.55 0.04 0.00 -0.34 0.00 0.00 43.02 41.17 1l5i s PHE 43 CO 0.00 0.51 0.04 0.42 -1.46 0.00 0.00 175.22 174.74 1l5i s ILE 44 N -1.80 0.15 -0.16 3.12 1.01 0.10 -2.34 121.20 121.27 1l5i s ILE 44 Ca 0.32 0.05 -0.02 0.00 0.00 0.00 0.00 60.65 61.00 1l5i s ILE 44 Cb -0.10 -0.50 -0.02 0.00 0.01 0.00 0.00 42.46 41.85 1l5i s ILE 44 CO 0.25 0.04 -0.08 -0.75 0.00 0.00 0.00 174.94 174.40 1l5i s LYS 45 N 2.05 3.44 -0.17 2.79 2.36 0.11 -1.25 119.74 129.08 1l5i s LYS 45 Ca 0.03 -0.63 -0.01 0.00 -2.55 0.00 0.00 55.97 52.82 1l5i s LYS 45 Cb -0.14 -2.81 0.04 0.00 -1.05 0.00 0.00 37.83 33.87 1l5i s LYS 45 CO -0.06 0.09 -0.05 0.42 1.55 0.00 0.00 175.35 177.30 1l5i s ILE 46 N 0.72 1.11 -0.02 5.43 1.01 -0.92 0.25 121.20 128.78 1l5i s ILE 46 Ca -0.04 -0.65 0.05 0.00 0.00 0.00 0.00 60.65 60.01 1l5i s ILE 46 Cb -0.15 -1.30 -0.01 0.00 0.01 0.00 0.00 42.46 41.01 1l5i s ILE 46 CO 0.02 0.11 -0.17 0.00 0.00 0.00 0.00 174.94 174.90 1l5i s ARG 48 N -0.34 3.63 -0.01 0.00 3.52 -1.26 0.11 118.95 124.59 1l5i s ARG 48 Ca 0.05 0.03 -0.00 0.00 -0.13 0.00 0.00 55.73 55.68 1l5i s ARG 48 Cb -0.07 -3.14 0.02 0.00 -1.56 0.00 0.00 34.95 30.20 1l5i s ARG 48 CO -0.00 0.69 0.02 -2.00 -0.81 0.00 0.00 175.30 173.20 1l5i s GLU 49 N -1.42 -0.02 -0.16 5.12 2.12 -0.47 -4.90 118.70 118.97 1l5i s GLU 49 Ca 0.24 0.12 -0.11 0.00 0.36 0.00 0.00 54.97 55.58 1l5i s GLU 49 Cb -0.14 -0.15 -0.05 0.00 0.26 0.00 0.00 34.13 34.06 1l5i s GLU 49 CO 0.12 -0.10 0.20 -0.51 -0.54 0.00 0.00 175.26 174.43 1l5i s LEU 50 N 0.65 4.28 0.45 2.70 2.01 -1.26 0.07 118.68 127.57 1l5i s LEU 50 Ca -0.05 0.42 -0.15 0.00 0.01 0.00 0.00 54.13 54.35 1l5i s LEU 50 Cb -0.08 -2.20 -0.08 0.00 0.01 0.00 0.00 46.19 43.84 1l5i s LEU 50 CO -0.02 0.22 0.88 -1.00 1.01 0.00 0.00 176.35 177.44 1l5i s HIS 51 N -0.02 3.44 -1.32 0.29 3.76 -0.08 -4.89 115.29 116.46 1l5i s HIS 51 Ca 0.13 1.31 0.20 0.00 -0.15 0.00 0.00 55.06 56.55 1l5i s HIS 51 Cb -0.12 -2.65 0.96 0.00 1.11 0.00 0.00 32.58 31.87 1l5i s HIS 51 CO 0.02 -0.21 1.62 0.39 -0.85 0.00 0.00 174.74 175.71 1l5i n GLU 52 N -1.29 0.21 0.00 1.40 1.02 -1.26 -1.82 120.64 118.90 1l5i n GLU 52 Ca 0.05 0.12 0.14 0.00 -0.02 0.00 0.00 57.16 57.45 1l5i n GLU 52 Cb 0.54 -1.50 0.65 0.00 -0.02 0.00 0.00 31.44 31.11 1l5i n GLU 52 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 1l5i n ASN 53 N -1.34 0.80 0.00 1.62 4.13 -1.26 -4.87 115.26 114.34 1l5i n ASN 53 Ca 0.08 -1.09 0.00 0.00 1.68 0.00 0.00 54.58 55.25 1l5i n ASN 53 Cb 0.17 -0.01 0.00 0.00 -1.54 0.00 0.00 39.78 38.41 1l5i n ASN 53 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1l5i n GLY 54 N 1.17 0.76 3.77 7.41 0.00 -0.76 -5.04 105.19 112.50 1l5i n GLY 54 Ca 0.19 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.84 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 -0.35 4.06 -0.08 1.61 -1.05 -1.25 -4.92 118.70 116.71 1l5i s GLU 55 Ca 0.00 0.11 -0.30 0.00 -0.15 0.00 0.00 54.97 54.63 1l5i s GLU 55 Cb 0.00 -3.35 -0.03 0.00 -0.44 0.00 0.00 34.13 30.31 1l5i s GLU 55 CO 0.00 0.41 1.23 -1.25 0.95 0.00 0.00 175.26 176.61 1l5i s PRO 56 N -0.07 4.31 0.19 -4.83 0.04 -1.26 -0.91 135.00 132.47 1l5i s PRO 56 Ca 0.17 1.69 0.08 0.00 0.04 0.00 0.00 61.00 62.99 1l5i s PRO 56 Cb -0.13 -3.62 -0.04 0.00 0.04 0.00 0.00 34.50 30.75 1l5i s PRO 56 CO 0.05 -0.53 -0.04 -1.58 0.04 0.00 0.00 177.00 174.95 1l5i s HIS 57 N 2.58 2.75 -0.02 0.56 2.46 0.11 -0.56 115.29 123.17 1l5i s HIS 57 Ca 0.56 -0.18 0.03 0.00 0.47 0.00 0.00 55.06 55.94 1l5i s HIS 57 Cb -0.24 -1.32 -0.00 0.00 -0.13 0.00 0.00 32.58 30.88 1l5i s HIS 57 CO 0.20 0.53 -0.10 -1.17 -2.47 0.00 0.00 174.74 171.73 1l5i s LEU 58 N -2.97 1.91 0.04 8.88 1.98 -0.98 -1.37 118.68 126.16 1l5i s LEU 58 Ca 0.27 -0.20 0.07 0.00 -2.89 0.00 0.00 54.13 51.38 1l5i s LEU 58 Cb -0.09 -0.57 -0.03 0.00 0.66 0.00 0.00 46.19 46.16 1l5i s LEU 58 CO 0.17 0.10 -0.18 -1.00 -1.89 0.00 0.00 176.35 173.56 1l5i s HIS 59 N -0.03 2.57 -0.04 5.38 3.76 0.12 -2.04 115.29 125.00 1l5i s HIS 59 Ca 0.00 -0.25 -0.03 0.00 -0.15 0.00 0.00 55.06 54.64 1l5i s HIS 59 Cb -0.06 -1.47 0.02 0.00 1.11 0.00 0.00 32.58 32.17 1l5i s HIS 59 CO 0.00 0.25 0.10 0.42 -0.85 0.00 0.00 174.74 174.66 1l5i s ILE 60 N -0.92 -0.02 -0.17 0.60 1.01 -0.95 -1.62 121.20 119.13 1l5i s ILE 60 Ca 0.15 0.08 -0.04 0.00 0.00 0.00 0.00 60.65 60.83 1l5i s ILE 60 Cb -0.10 -0.16 0.06 0.00 0.01 0.00 0.00 42.46 42.27 1l5i s ILE 60 CO 0.05 0.03 0.08 -0.22 0.00 0.00 0.00 174.94 174.88 1l5i s LEU 61 N 0.50 0.51 0.15 2.97 1.98 0.14 -1.73 118.68 123.20 1l5i s LEU 61 Ca -0.04 -0.63 0.10 0.00 -2.89 0.00 0.00 54.13 50.68 1l5i s LEU 61 Cb -0.05 -0.31 -0.04 0.00 0.66 0.00 0.00 46.19 46.44 1l5i s LEU 61 CO -0.02 -0.34 -0.22 -0.63 -1.89 0.00 0.00 176.35 173.25 1l5i s ILE 62 N 2.08 2.54 -0.13 6.68 1.01 -0.94 0.08 121.20 132.52 1l5i s ILE 62 Ca 0.01 -1.78 -0.02 0.00 0.00 0.00 0.00 60.65 58.86 1l5i s ILE 62 Cb -0.16 -2.18 0.04 0.00 0.01 0.00 0.00 42.46 40.17 1l5i s ILE 62 CO -0.09 -0.00 0.03 0.00 0.00 0.00 0.00 174.94 174.88 1l5i s GLN 63 N -2.37 0.51 0.35 2.79 -2.07 -0.99 -1.66 119.66 116.21 1l5i s GLN 63 Ca 0.18 -0.10 -0.04 0.00 -1.82 0.00 0.00 55.36 53.58 1l5i s GLN 63 Cb -0.09 -1.49 -0.05 0.00 -1.09 0.00 0.00 33.01 30.30 1l5i s GLN 63 CO 0.09 -0.48 0.62 -0.06 -1.32 0.00 0.00 175.29 174.14 1l5i s PHE 64 N 1.97 3.50 0.40 9.60 0.40 -0.54 -1.93 117.98 131.37 1l5i s PHE 64 Ca 0.02 0.66 0.07 0.00 -0.60 0.00 0.00 56.93 57.08 1l5i s PHE 64 Cb -0.15 -2.13 0.82 0.00 0.51 0.00 0.00 43.02 42.07 1l5i s PHE 64 CO -0.07 0.04 2.00 1.49 0.70 0.00 0.00 175.22 179.39 1l5i h GLU 65 N 1.16 0.47 -5.93 0.44 4.22 -1.51 -3.43 114.58 109.99 1l5i h GLU 65 Ca -0.48 -0.05 -0.53 0.00 0.08 0.00 0.00 59.36 58.38 1l5i h GLU 65 Cb 1.20 -0.09 -0.16 0.00 0.50 0.00 0.00 28.75 30.19 1l5i h GLU 65 CO 0.64 0.38 -0.77 0.20 -2.18 0.00 0.00 179.01 177.28 1l5i s GLY 66 N -3.79 1.51 -0.08 1.92 0.00 -1.26 -5.02 107.32 100.60 1l5i s GLY 66 Ca -0.08 -1.62 -0.29 0.00 0.00 0.00 0.00 44.72 42.73 1l5i s GLY 66 CO 0.74 -1.68 2.09 0.28 0.00 0.00 0.00 173.10 174.52 1l5i n LYS 67 N -0.05 2.45 -3.40 2.90 5.02 -1.26 -4.70 118.16 119.11 1l5i n LYS 67 Ca -0.10 0.82 -0.38 0.00 -2.02 0.00 0.00 58.31 56.63 1l5i n LYS 67 Cb 0.58 -3.10 -0.06 0.00 -0.02 0.00 0.00 35.03 32.43 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 6.17 3.75 -0.30 2.13 5.04 0.48 -4.80 117.35 129.82 1l5i s TYR 68 Ca 0.94 1.11 -0.13 0.00 -2.44 0.00 0.00 57.07 56.55 1l5i s TYR 68 Cb -0.40 -2.37 -0.03 0.00 0.35 0.00 0.00 41.96 39.50 1l5i s TYR 68 CO 0.39 0.61 0.27 1.21 -1.34 0.00 0.00 175.55 176.70 1l5i s ASN 69 N -1.13 6.11 -0.74 4.32 3.04 -1.26 -2.40 114.94 122.88 1l5i s ASN 69 Ca 0.27 -0.07 0.04 0.00 0.04 0.00 0.00 52.86 53.14 1l5i s ASN 69 Cb -0.18 -2.16 0.26 0.00 -1.54 0.00 0.00 41.25 37.64 1l5i s ASN 69 CO 0.16 -0.17 0.90 0.00 -3.04 0.00 0.00 177.10 174.95 1l5i n THR 71 N 0.97 2.69 -3.64 0.00 5.66 -1.26 -2.82 114.28 115.87 1l5i n THR 71 Ca 0.29 -1.52 -0.05 0.00 -3.05 0.00 0.00 64.05 59.71 1l5i n THR 71 Cb 0.39 -0.72 -0.07 0.00 -1.55 0.00 0.00 70.33 68.39 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 -0.68 -0.90 -0.24 1.09 3.84 -1.26 -4.72 114.94 112.08 1l5i s ASN 72 Ca 0.42 1.41 0.01 0.00 0.21 0.00 0.00 52.86 54.91 1l5i s ASN 72 Cb 0.35 1.47 0.26 0.00 -0.55 0.00 0.00 41.25 42.78 1l5i s ASN 72 CO 0.07 -0.22 1.65 0.00 -2.79 0.00 0.00 177.10 175.81 1l5i n GLN 73 N 4.37 1.63 -0.00 0.43 6.02 -1.26 -3.48 117.38 125.09 1l5i n GLN 73 Ca -0.19 -1.37 0.02 0.00 -0.01 0.00 0.00 57.00 55.45 1l5i n GLN 73 Cb 0.58 -1.54 -0.02 0.00 1.02 0.00 0.00 30.24 30.27 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 0.04 4.36 0.12 -1.09 1.74 -1.26 -4.39 116.66 116.17 1l5i n ARG 74 Ca 0.27 -0.01 -0.01 0.00 -0.77 0.00 0.00 57.85 57.33 1l5i n ARG 74 Cb 0.84 -0.78 0.05 0.00 -1.02 0.00 0.00 32.46 31.55 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 0.00 -0.53 -1.55 3.04 -2.01 -3.12 116.94 112.76 1l5i h PHE 75 Ca 0.00 0.00 0.00 0.00 3.98 0.00 0.00 57.97 61.95 1l5i h PHE 75 Cb 0.11 0.00 0.00 0.00 2.56 0.00 0.00 35.95 38.62 1l5i h PHE 75 CO 0.00 0.68 0.00 1.19 -2.02 0.00 0.00 178.31 178.16 1l5i n PHE 76 N -3.41 1.08 -1.89 0.41 3.72 -1.26 -4.93 117.46 111.17 1l5i n PHE 76 Ca 0.00 -0.60 -0.40 0.00 -0.05 0.00 0.00 57.45 56.40 1l5i n PHE 76 Cb 0.75 -0.16 -0.03 0.00 -0.94 0.00 0.00 39.48 39.10 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 -1.09 5.40 -0.11 4.37 1.01 -1.18 -4.46 116.67 120.61 1l5i s ASP 77 Ca 0.43 1.06 -0.03 0.00 0.71 0.00 0.00 52.55 54.71 1l5i s ASP 77 Cb 0.27 -2.52 -0.03 0.00 1.01 0.00 0.00 42.92 41.64 1l5i s ASP 77 CO 0.22 -2.14 0.02 -0.76 0.21 0.00 0.00 175.17 172.71 1l5i s LEU 78 N 8.62 3.63 0.32 1.23 1.43 -0.88 -4.97 118.68 128.07 1l5i s LEU 78 Ca 0.82 0.12 0.08 0.00 -1.03 0.00 0.00 54.13 54.12 1l5i s LEU 78 Cb -0.20 -1.86 -0.06 0.00 0.03 0.00 0.00 46.19 44.10 1l5i s LEU 78 CO 0.29 0.32 -0.08 0.68 0.23 0.00 0.00 176.35 177.78 1l5i s VAL 79 N -0.52 2.02 -0.26 -1.59 -7.23 -1.26 0.46 120.40 112.03 1l5i s VAL 79 Ca 0.09 -2.18 -0.25 0.00 -1.81 0.00 0.00 61.98 57.84 1l5i s VAL 79 Cb -0.12 -2.56 -0.00 0.00 0.56 0.00 0.00 36.38 34.26 1l5i s VAL 79 CO 0.02 -0.24 0.83 -0.55 -0.31 0.00 0.00 175.10 174.85 1l5i s SER 80 N -3.54 6.80 0.00 4.85 0.15 0.20 -4.90 113.70 117.26 1l5i s SER 80 Ca 0.31 0.96 0.23 0.00 0.70 0.00 0.00 55.95 58.15 1l5i s SER 80 Cb 0.03 -2.43 1.27 0.00 -1.71 0.00 0.00 66.02 63.17 1l5i s SER 80 CO 0.15 -0.55 1.76 -0.81 1.20 0.00 0.00 173.24 174.99 1l5i n PRO 81 N 6.09 0.51 -0.01 5.44 -0.04 -1.26 -2.57 135.00 143.16 1l5i n PRO 81 Ca 0.05 0.04 0.03 0.00 -0.04 0.00 0.00 63.50 63.58 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 -1.16 0.03 -4.21 0.52 -2.24 -1.26 -5.02 114.28 100.95 1l5i n THR 82 Ca 0.14 -0.16 -0.17 0.00 -2.27 0.00 0.00 64.05 61.60 1l5i n THR 82 Cb 0.14 0.26 -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 -2.43 0.66 -0.68 -0.78 3.52 -1.06 -5.03 118.95 113.14 1l5i s ARG 83 Ca -0.02 -0.58 -0.07 0.00 -0.13 0.00 0.00 55.73 54.92 1l5i s ARG 83 Cb 0.04 -0.58 -0.15 0.00 -1.56 0.00 0.00 34.95 32.70 1l5i s ARG 83 CO 0.27 0.14 2.93 0.45 -0.81 0.00 0.00 175.30 178.28 1l5i n SER 84 N 2.09 5.95 -4.12 -2.12 2.88 -1.26 -3.77 113.62 113.27 1l5i n SER 84 Ca -0.18 -2.41 -0.25 0.00 -1.33 0.00 0.00 58.87 54.70 1l5i n SER 84 Cb 0.56 -1.30 -0.16 0.00 -0.75 0.00 0.00 64.21 62.55 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 1.93 1.44 0.02 -1.46 0.00 -1.26 -5.03 121.76 117.41 1l5i s ALA 85 Ca 0.58 -0.65 0.01 0.00 0.00 0.00 0.00 51.96 51.90 1l5i s ALA 85 Cb 0.21 -0.48 -0.04 0.00 0.00 0.00 0.00 23.12 22.82 1l5i s ALA 85 CO -0.03 0.26 0.06 -1.01 0.00 0.00 0.00 175.76 175.05 1l5i s HIS 86 N 0.03 3.20 -0.05 0.00 3.76 -1.26 -0.63 115.29 120.35 1l5i s HIS 86 Ca -0.03 0.13 0.04 0.00 -0.15 0.00 0.00 55.06 55.05 1l5i s HIS 86 Cb -0.11 -1.68 -0.00 0.00 1.11 0.00 0.00 32.58 31.90 1l5i s HIS 86 CO 0.02 0.52 -0.16 -0.06 -0.85 0.00 0.00 174.74 174.20 1l5i s PHE 87 N -1.23 1.68 -0.42 1.40 0.08 0.17 -4.97 117.98 114.69 1l5i s PHE 87 Ca 0.24 -0.52 -0.03 0.00 0.12 0.00 0.00 56.93 56.74 1l5i s PHE 87 Cb -0.12 -1.15 0.11 0.00 -0.57 0.00 0.00 43.02 41.29 1l5i s PHE 87 CO 0.16 -0.19 0.22 -1.58 -0.10 0.00 0.00 175.22 173.72 1l5i s HIS 88 N 0.16 3.57 0.75 0.36 5.65 -1.26 -2.06 115.29 122.46 1l5i s HIS 88 Ca -0.06 -2.41 -0.11 0.00 0.25 0.00 0.00 55.06 52.72 1l5i s HIS 88 Cb -0.12 -3.24 0.04 0.00 -1.18 0.00 0.00 32.58 28.08 1l5i s HIS 88 CO 0.03 -0.97 1.08 -1.25 -0.65 0.00 0.00 174.74 172.98 1l5i s PRO 89 N 1.09 2.51 -0.22 2.88 0.04 -1.26 -4.93 135.00 135.11 1l5i s PRO 89 Ca 0.09 0.81 -0.18 0.00 0.04 0.00 0.00 61.00 61.75 1l5i s PRO 89 Cb -0.23 -1.95 -0.03 0.00 0.04 0.00 0.00 34.50 32.33 1l5i s PRO 89 CO -0.04 -1.36 0.52 1.21 0.04 0.00 0.00 177.00 177.36 1l5i s ASN 90 N -3.84 6.53 0.00 6.66 3.84 -0.67 -4.86 114.94 122.61 1l5i s ASN 90 Ca 0.59 0.64 -0.24 0.00 0.21 0.00 0.00 52.86 54.06 1l5i s ASN 90 Cb -0.14 -2.29 -0.05 0.00 -0.55 0.00 0.00 41.25 38.22 1l5i s ASN 90 CO 0.55 -0.21 0.74 -0.63 -2.79 0.00 0.00 177.10 174.76 1l5i s ILE 91 N 1.81 4.86 -0.03 -5.21 1.01 -1.26 -2.31 121.20 120.07 1l5i s ILE 91 Ca 0.23 1.56 0.01 0.00 0.00 0.00 0.00 60.65 62.46 1l5i s ILE 91 Cb -0.15 -4.09 0.01 0.00 0.01 0.00 0.00 42.46 38.24 1l5i s ILE 91 CO 0.09 0.32 -0.04 -1.10 0.00 0.00 0.00 174.94 174.21 1l5i s GLN 92 N 0.27 0.64 -0.36 2.79 -0.21 -0.28 -4.98 119.66 117.53 1l5i s GLN 92 Ca 0.38 -0.11 -0.20 0.00 0.02 0.00 0.00 55.36 55.45 1l5i s GLN 92 Cb -0.19 -0.66 0.00 0.00 1.00 0.00 0.00 33.01 33.16 1l5i s GLN 92 CO 0.21 -0.02 0.60 0.20 -2.12 0.00 0.00 175.29 174.16 1l5i s GLY 93 N 0.59 1.77 -0.39 3.09 0.00 -1.26 -0.18 107.32 110.94 1l5i s GLY 93 Ca -0.07 -0.91 -0.24 0.00 0.00 0.00 0.00 44.72 43.49 1l5i s GLY 93 CO -0.00 1.43 0.84 0.00 0.00 0.00 0.00 173.10 175.37 1l5i s ALA 94 N 2.62 3.38 1.00 3.20 0.00 -0.57 -4.98 121.76 126.42 1l5i s ALA 94 Ca 0.23 -0.65 0.00 0.00 0.00 0.00 0.00 51.96 51.54 1l5i s ALA 94 Cb -0.15 -3.46 0.00 0.00 0.00 0.00 0.00 23.12 19.51 1l5i s ALA 94 CO 0.15 -1.64 0.00 1.17 0.00 0.00 0.00 175.76 175.44 1l5i n LYS 95 N 6.65 1.42 -3.31 0.00 4.81 -1.26 -4.01 118.16 122.45 1l5i n LYS 95 Ca 0.04 0.00 -0.37 0.00 -0.87 0.00 0.00 58.31 57.12 1l5i n LYS 95 Cb 0.48 0.00 -0.06 0.00 0.02 0.00 0.00 35.03 35.47 1l5i n LYS 95 CO 0.00 0.00 0.00 0.45 1.17 0.00 0.00 177.40 179.02 1l5i s SER 96 N -1.98 6.93 0.00 3.14 0.15 -1.26 -4.82 113.70 115.86 1l5i s SER 96 Ca 0.00 1.16 0.00 0.00 0.70 0.00 0.00 55.95 57.81 1l5i s SER 96 Cb 0.00 -2.32 0.00 0.00 -1.71 0.00 0.00 66.02 61.99 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 1.16 0.00 0.00 5.45 7.64 -1.26 -4.97 113.62 121.64 1l5i n SER 97 Ca -0.07 0.00 0.14 0.00 1.01 0.00 0.00 58.87 59.95 1l5i n SER 97 Cb 0.51 0.00 0.69 0.00 -1.01 0.00 0.00 64.21 64.41 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 0.00 -0.15 6.43 7.64 -1.26 -3.61 113.62 122.66 1l5i n SER 98 Ca 0.00 0.07 0.28 0.00 1.01 0.00 0.00 58.87 60.22 1l5i n SER 98 Cb 0.00 -0.35 0.59 0.00 -1.01 0.00 0.00 64.21 63.44 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 0.00 0.00 -0.32 6.43 3.58 -1.99 1.87 116.42 125.99 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 0.34 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 41.38 1l5i h ASP 99 CO 0.00 0.00 -0.12 -0.37 -2.88 0.00 0.00 179.24 175.87 1l5i h VAL 100 N 0.00 1.29 -0.57 2.25 -1.51 -1.99 -1.48 116.25 114.23 1l5i h VAL 100 Ca 0.43 -1.20 -0.02 0.00 -1.23 0.00 0.00 66.70 64.68 1l5i h VAL 100 Cb 2.32 1.40 -0.03 0.00 -2.13 0.00 0.00 31.29 32.85 1l5i h VAL 100 CO -0.00 0.39 0.29 0.50 -1.23 0.00 0.00 177.57 177.51 1l5i h LYS 101 N 0.41 0.81 -0.25 5.19 3.11 0.26 0.30 116.57 126.41 1l5i h LYS 101 Ca 0.08 -0.11 0.03 0.00 -2.81 0.00 0.00 60.65 57.83 1l5i h LYS 101 Cb 0.63 -0.15 -0.03 0.00 -1.00 0.00 0.00 32.23 31.68 1l5i h LYS 101 CO 0.04 0.65 0.07 1.03 -2.81 0.00 0.00 179.45 178.43 1l5i h SER 102 N 0.77 0.06 -0.25 4.20 0.87 -1.23 0.22 113.55 118.19 1l5i h SER 102 Ca 0.20 0.03 -0.08 0.00 -1.23 0.00 0.00 61.79 60.70 1l5i h SER 102 Cb 0.09 0.03 -0.02 0.00 -0.44 0.00 0.00 62.40 62.06 1l5i h SER 102 CO -0.03 0.07 -0.12 0.22 -0.53 0.00 0.00 176.83 176.44 1l5i h TYR 103 N 0.18 0.72 -0.51 2.24 3.20 -0.91 -1.67 116.97 120.21 1l5i h TYR 103 Ca 0.11 -0.12 -0.07 0.00 3.14 0.00 0.00 58.73 61.79 1l5i h TYR 103 Cb 0.09 -0.19 -0.02 0.00 1.54 0.00 0.00 36.73 38.15 1l5i h TYR 103 CO -0.14 0.75 0.02 0.82 -1.64 0.00 0.00 178.16 177.97 1l5i h ILE 104 N 0.60 1.24 -0.02 1.81 2.04 0.36 -1.93 117.51 121.61 1l5i h ILE 104 Ca 0.10 -1.00 -0.10 0.00 1.00 0.00 0.00 64.86 64.86 1l5i h ILE 104 Cb 0.55 0.83 -0.01 0.00 -0.74 0.00 0.00 36.82 37.45 1l5i h ILE 104 CO 0.03 0.36 -0.47 -0.78 0.00 0.00 0.00 178.15 177.30 1l5i h ASP 105 N 0.79 0.06 -0.17 1.72 3.58 -0.17 -3.34 116.42 118.89 1l5i h ASP 105 Ca 0.16 -0.03 -0.64 0.00 0.42 0.00 0.00 57.03 56.94 1l5i h ASP 105 Cb 0.44 -0.02 -0.01 0.00 1.72 0.00 0.00 39.33 41.47 1l5i h ASP 105 CO 0.02 0.52 2.43 0.29 -2.88 0.00 0.00 179.24 179.62 1l5i n LYS 106 N -3.98 2.21 -2.07 0.28 5.02 -0.67 -4.91 118.16 114.03 1l5i n LYS 106 Ca -0.02 -2.37 -0.27 0.00 -2.02 0.00 0.00 58.31 53.62 1l5i n LYS 106 Cb 0.49 -3.23 0.10 0.00 -0.02 0.00 0.00 35.03 32.38 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 4.45 4.33 0.00 4.39 -4.77 -1.26 -4.97 116.67 118.84 1l5i s ASP 107 Ca 0.55 0.46 0.00 0.00 -3.30 0.00 0.00 52.55 50.26 1l5i s ASP 107 Cb 0.11 -0.92 0.00 0.00 -1.09 0.00 0.00 42.92 41.02 1l5i s ASP 107 CO 0.04 -1.95 0.00 0.61 0.70 0.00 0.00 175.17 174.57 1l5i n GLY 108 N -3.22 0.46 2.71 2.12 0.00 -1.26 -4.95 105.19 101.04 1l5i n GLY 108 Ca 0.10 0.38 -0.20 0.00 0.00 0.00 0.00 46.02 46.29 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 -5.78 -4.58 1.61 8.00 -1.26 -4.90 116.55 109.65 1l5i n ASP 109 Ca 0.00 -0.17 -0.26 0.00 0.71 0.00 0.00 54.79 55.07 1l5i n ASP 109 Cb 0.00 -4.68 -0.10 0.00 -0.02 0.00 0.00 41.12 36.31 1l5i n ASP 109 CO 0.00 0.00 0.00 0.68 -0.39 0.00 0.00 177.20 177.49 1l5i s VAL 110 N -3.08 2.23 0.03 2.53 -7.23 -1.26 -4.63 120.40 109.00 1l5i s VAL 110 Ca 0.17 -2.11 0.01 0.00 -1.81 0.00 0.00 61.98 58.24 1l5i s VAL 110 Cb -0.07 -2.76 -0.04 0.00 0.56 0.00 0.00 36.38 34.06 1l5i s VAL 110 CO 0.21 -0.15 0.08 -0.22 -0.31 0.00 0.00 175.10 174.71 1l5i s LEU 111 N -3.66 3.85 -0.04 1.32 0.20 0.07 -5.02 118.68 115.41 1l5i s LEU 111 Ca 0.34 0.08 0.01 0.00 0.69 0.00 0.00 54.13 55.25 1l5i s LEU 111 Cb 0.04 -2.37 0.02 0.00 -0.43 0.00 0.00 46.19 43.45 1l5i s LEU 111 CO 0.17 0.23 -0.06 -1.61 -0.29 0.00 0.00 176.35 174.80 1l5i s GLU 112 N -2.02 0.91 0.04 1.98 2.02 -1.26 -2.16 118.70 118.20 1l5i s GLU 112 Ca 0.26 -0.16 0.00 0.00 0.02 0.00 0.00 54.97 55.09 1l5i s GLU 112 Cb -0.12 -0.87 -0.03 0.00 0.10 0.00 0.00 34.13 33.21 1l5i s GLU 112 CO 0.17 -0.04 -0.04 -0.46 0.02 0.00 0.00 175.26 174.91 1l5i s TRP 113 N 0.77 0.45 0.24 1.61 -0.00 -0.38 -5.02 118.94 116.60 1l5i s TRP 113 Ca -0.11 -0.66 0.00 0.00 -0.00 0.00 0.00 56.10 55.33 1l5i s TRP 113 Cb -0.14 -0.30 0.00 0.00 -0.00 0.00 0.00 33.47 33.03 1l5i s TRP 113 CO 0.01 -0.20 0.00 0.41 -0.00 0.00 0.00 176.95 177.16 1l5i n GLY 114 N 1.15 -1.72 3.05 5.86 0.00 -1.26 0.02 105.19 112.29 1l5i n GLY 114 Ca -0.21 -1.27 -0.31 0.00 0.00 0.00 0.00 46.02 44.24 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 -1.88 1.69 0.36 2.61 2.01 -1.23 -4.68 115.64 114.53 1l5i s THR 115 Ca 0.00 -0.72 -0.24 0.00 0.31 0.00 0.00 61.69 61.04 1l5i s THR 115 Cb 0.00 -1.56 -0.10 0.00 0.01 0.00 0.00 72.50 70.85 1l5i s THR 115 CO 0.00 0.48 0.95 0.12 -0.69 0.00 0.00 174.62 175.48 1l5i s PHE 116 N 1.33 3.54 -0.14 4.92 2.19 -1.26 -3.97 117.98 124.58 1l5i s PHE 116 Ca 0.03 1.72 -0.06 0.00 0.33 0.00 0.00 56.93 58.94 1l5i s PHE 116 Cb -0.13 -2.91 0.06 0.00 -1.31 0.00 0.00 43.02 38.73 1l5i s PHE 116 CO -0.09 0.05 0.32 1.14 1.83 0.00 0.00 175.22 178.46 1l5i s GLN 117 N -2.46 0.24 0.14 10.12 -2.07 -1.26 -5.04 119.66 119.33 1l5i s GLN 117 Ca 0.55 0.76 -0.30 0.00 -1.82 0.00 0.00 55.36 54.55 1l5i s GLN 117 Cb -0.16 0.02 -0.07 0.00 -1.09 0.00 0.00 33.01 31.72 1l5i s GLN 117 CO 0.20 -0.23 0.97 0.42 -1.32 0.00 0.00 175.29 175.34 1l5i s ILE 118 N 2.00 4.35 0.85 3.63 1.09 -1.26 -5.04 121.20 126.83 1l5i s ILE 118 Ca -0.04 2.03 -0.12 0.00 -1.10 0.00 0.00 60.65 61.43 1l5i s ILE 118 Cb -0.11 -4.30 0.10 0.00 -1.06 0.00 0.00 42.46 37.09 1l5i s ILE 118 CO -0.10 0.35 1.11 1.51 -0.10 0.00 0.00 174.94 177.71 1l5i s ASP 119 N -0.26 4.05 0.00 3.58 1.47 -1.26 -5.05 116.67 119.21 1l5i s ASP 119 Ca 0.46 1.18 0.00 0.00 1.18 0.00 0.00 52.55 55.37 1l5i s ASP 119 Cb -0.24 -1.85 0.00 0.00 -0.34 0.00 0.00 42.92 40.48 1l5i s ASP 119 CO 0.31 -2.23 0.00 0.61 0.68 0.00 0.00 175.17 174.53 1l5i n GLY 120 N -2.09 -0.05 3.65 2.12 0.00 -1.26 -5.19 105.19 102.37 1l5i n GLY 120 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.09 1l5i n GLY 120 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86