#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 -0.50 -0.02 0.23 0.00 -1.26 -5.17 107.32 100.59 1l5i s GLY 5 Ca 0.00 0.45 0.04 0.00 0.00 0.00 0.00 44.72 45.20 1l5i s GLY 5 CO 0.00 0.13 -0.13 1.09 0.00 0.00 0.00 173.10 174.20 1l5i s ARG 6 N -3.35 1.21 -0.66 2.90 1.70 -1.26 -5.09 118.95 114.40 1l5i s ARG 6 Ca -0.01 -0.44 -0.27 0.00 -0.47 0.00 0.00 55.73 54.54 1l5i s ARG 6 Cb -0.00 -1.12 0.02 0.00 -0.57 0.00 0.00 34.95 33.29 1l5i s ARG 6 CO -0.09 0.21 1.32 0.12 -1.08 0.00 0.00 175.30 175.78 1l5i s PHE 7 N -0.02 2.32 -0.20 5.89 5.36 -1.26 -4.95 117.98 125.11 1l5i s PHE 7 Ca -0.00 0.21 -0.02 0.00 -0.96 0.00 0.00 56.93 56.15 1l5i s PHE 7 Cb -0.08 -4.53 0.06 0.00 -0.34 0.00 0.00 43.02 38.13 1l5i s PHE 7 CO 0.01 -1.96 0.02 -1.54 -1.46 0.00 0.00 175.22 170.29 1l5i s SER 8 N 3.96 3.11 -0.16 6.13 1.04 -1.26 -4.19 113.70 122.32 1l5i s SER 8 Ca 0.42 -0.90 -0.08 0.00 0.48 0.00 0.00 55.95 55.87 1l5i s SER 8 Cb -0.09 -0.71 -0.04 0.00 0.10 0.00 0.00 66.02 65.28 1l5i s SER 8 CO 0.20 -0.30 0.11 -0.63 0.98 0.00 0.00 173.24 173.60 1l5i s ILE 9 N 1.77 5.20 -0.18 -1.02 1.01 -1.15 -4.90 121.20 121.92 1l5i s ILE 9 Ca -0.02 0.10 -0.03 0.00 0.00 0.00 0.00 60.65 60.71 1l5i s ILE 9 Cb -0.17 -3.32 0.06 0.00 0.01 0.00 0.00 42.46 39.03 1l5i s ILE 9 CO -0.08 0.51 0.04 -0.54 0.00 0.00 0.00 174.94 174.87 1l5i s LYS 10 N -0.16 0.60 0.15 2.79 1.02 -1.26 0.63 119.74 123.52 1l5i s LYS 10 Ca 0.09 -0.34 -0.24 0.00 0.02 0.00 0.00 55.97 55.51 1l5i s LYS 10 Cb -0.12 -1.97 0.06 0.00 -0.52 0.00 0.00 37.83 35.29 1l5i s LYS 10 CO 0.01 -0.61 0.73 0.00 -0.92 0.00 0.00 175.35 174.56 1l5i s ALA 11 N 1.89 -1.57 -0.07 5.17 0.00 -0.91 -4.95 121.76 121.32 1l5i s ALA 11 Ca -0.00 0.38 0.14 0.00 0.00 0.00 0.00 51.96 52.48 1l5i s ALA 11 Cb -0.16 0.75 -0.11 0.00 0.00 0.00 0.00 23.12 23.60 1l5i s ALA 11 CO -0.08 -0.84 1.06 1.57 0.00 0.00 0.00 175.76 177.47 1l5i h LYS 12 N 2.00 0.00 -6.60 0.00 5.09 -1.81 0.42 116.57 115.66 1l5i h LYS 12 Ca -0.27 0.00 -0.69 0.00 0.09 0.00 0.00 60.65 59.78 1l5i h LYS 12 Cb 1.27 0.00 -0.24 0.00 0.10 0.00 0.00 32.23 33.36 1l5i h LYS 12 CO 0.32 0.52 -0.83 -0.80 -2.09 0.00 0.00 179.45 176.56 1l5i s ASN 13 N -6.20 3.57 0.00 7.07 0.01 -1.25 0.07 114.94 118.21 1l5i s ASN 13 Ca -0.01 -0.46 0.03 0.00 -0.71 0.00 0.00 52.86 51.72 1l5i s ASN 13 Cb 0.08 -0.51 -0.01 0.00 0.41 0.00 0.00 41.25 41.22 1l5i s ASN 13 CO 0.80 0.27 -0.10 -0.31 -1.51 0.00 0.00 177.10 176.25 1l5i s TYR 14 N -0.84 0.84 -0.16 2.20 2.02 0.61 -1.01 117.35 121.01 1l5i s TYR 14 Ca 0.13 -0.21 0.02 0.00 -0.37 0.00 0.00 57.07 56.64 1l5i s TYR 14 Cb -0.10 -0.53 0.02 0.00 -0.40 0.00 0.00 41.96 40.94 1l5i s TYR 14 CO 0.03 -0.01 -0.21 -0.06 -1.57 0.00 0.00 175.55 173.74 1l5i s PHE 15 N -0.40 2.68 -0.18 2.71 0.08 0.10 -1.27 117.98 121.69 1l5i s PHE 15 Ca 0.02 -1.47 -0.07 0.00 0.12 0.00 0.00 56.93 55.53 1l5i s PHE 15 Cb -0.05 -1.84 -0.04 0.00 -0.57 0.00 0.00 43.02 40.52 1l5i s PHE 15 CO -0.00 -0.70 0.06 -0.51 -0.10 0.00 0.00 175.22 173.97 1l5i s LEU 16 N 1.06 3.76 -0.16 -0.37 2.01 -0.77 -1.85 118.68 122.37 1l5i s LEU 16 Ca -0.01 0.05 0.02 0.00 0.01 0.00 0.00 54.13 54.20 1l5i s LEU 16 Cb -0.14 -1.95 0.01 0.00 0.01 0.00 0.00 46.19 44.12 1l5i s LEU 16 CO -0.07 0.16 -0.21 -0.89 1.01 0.00 0.00 176.35 176.35 1l5i s THR 17 N 0.44 2.05 -0.36 5.49 2.01 -1.02 -2.06 115.64 122.19 1l5i s THR 17 Ca 0.03 -0.96 -0.01 0.00 0.31 0.00 0.00 61.69 61.06 1l5i s THR 17 Cb -0.13 -1.83 0.09 0.00 0.01 0.00 0.00 72.50 70.64 1l5i s THR 17 CO 0.01 0.54 0.11 -0.31 -0.69 0.00 0.00 174.62 174.28 1l5i s TYR 18 N 1.05 3.51 0.21 4.92 1.51 -1.01 -1.43 117.35 126.11 1l5i s TYR 18 Ca -0.01 -2.33 -0.30 0.00 -1.01 0.00 0.00 57.07 53.42 1l5i s TYR 18 Cb -0.14 -2.79 -0.08 0.00 -0.11 0.00 0.00 41.96 38.83 1l5i s TYR 18 CO -0.07 -0.91 1.10 -1.25 -1.11 0.00 0.00 175.55 173.31 1l5i s PRO 19 N 1.14 4.61 -1.68 -1.71 0.04 -1.26 -2.16 135.00 133.98 1l5i s PRO 19 Ca 0.04 1.75 -0.17 0.00 0.04 0.00 0.00 61.00 62.66 1l5i s PRO 19 Cb -0.21 -3.24 0.17 0.00 0.04 0.00 0.00 34.50 31.26 1l5i s PRO 19 CO -0.04 0.12 0.44 0.36 0.04 0.00 0.00 177.00 177.92 1l5i n LYS 20 N 1.95 -0.78 -3.44 4.56 2.85 -0.11 -4.84 118.16 118.34 1l5i n LYS 20 Ca 0.01 0.12 -0.39 0.00 -1.05 0.00 0.00 58.31 57.01 1l5i n LYS 20 Cb 0.46 -4.13 -0.09 0.00 -0.65 0.00 0.00 35.03 30.61 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 5.11 1.73 -4.74 0.00 5.75 -1.26 -4.59 116.55 118.55 1l5i n ASP 22 Ca -0.10 -2.10 -0.41 0.00 -0.01 0.00 0.00 54.79 52.17 1l5i n ASP 22 Cb 0.51 -0.29 -0.03 0.00 -1.03 0.00 0.00 41.12 40.28 1l5i n ASP 22 CO 0.00 0.00 0.00 -0.22 -0.11 0.00 0.00 177.20 176.87 1l5i s LEU 23 N -0.98 4.43 0.57 -2.12 2.96 -1.26 -5.01 118.68 117.27 1l5i s LEU 23 Ca 0.17 2.33 -0.08 0.00 -0.22 0.00 0.00 54.13 56.34 1l5i s LEU 23 Cb 0.10 -3.61 -0.02 0.00 0.50 0.00 0.00 46.19 43.16 1l5i s LEU 23 CO 0.09 -0.45 0.91 0.42 -1.32 0.00 0.00 176.35 176.01 1l5i s THR 24 N -0.05 4.43 0.31 3.68 -4.23 -1.26 -4.94 115.64 113.58 1l5i s THR 24 Ca 0.54 0.38 0.14 0.00 -1.18 0.00 0.00 61.69 61.58 1l5i s THR 24 Cb -0.35 -3.74 0.09 0.00 1.34 0.00 0.00 72.50 69.84 1l5i s THR 24 CO 0.38 -0.83 1.77 0.07 -0.54 0.00 0.00 174.62 175.47 1l5i h LYS 25 N -0.11 0.00 -0.15 3.99 2.10 -1.97 -0.88 116.57 119.56 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 1.22 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 32.54 1l5i h LYS 25 CO 0.62 0.42 0.01 0.93 -2.00 0.00 0.00 179.45 179.42 1l5i h GLU 26 N 0.00 0.26 -0.37 0.07 5.08 -1.97 1.48 114.58 119.13 1l5i h GLU 26 Ca -0.00 -0.08 -0.08 0.00 -1.00 0.00 0.00 59.36 58.20 1l5i h GLU 26 Cb 0.79 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 30.00 1l5i h GLU 26 CO 0.05 0.48 -0.06 -0.91 -1.00 0.00 0.00 179.01 177.57 1l5i h ASN 27 N 0.01 0.69 -0.10 1.42 -0.26 -1.92 0.39 115.58 115.83 1l5i h ASN 27 Ca 0.04 -0.35 -0.12 0.00 -0.56 0.00 0.00 56.30 55.32 1l5i h ASN 27 Cb 0.35 -0.19 -0.01 0.00 -1.06 0.00 0.00 38.32 37.41 1l5i h ASN 27 CO 0.01 0.88 -0.32 0.00 -1.06 0.00 0.00 177.43 176.94 1l5i h ALA 28 N 0.84 0.94 -0.36 -0.83 0.00 -1.08 0.30 119.26 119.07 1l5i h ALA 28 Ca 0.10 -0.39 -0.13 0.00 0.00 0.00 0.00 54.91 54.48 1l5i h ALA 28 Cb 0.56 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.22 1l5i h ALA 28 CO 0.03 0.61 -0.28 1.25 0.00 0.00 0.00 179.25 180.86 1l5i h LEU 29 N 0.49 0.87 -0.21 0.00 7.12 0.23 0.68 115.31 124.50 1l5i h LEU 29 Ca 0.06 -0.45 -0.06 0.00 0.13 0.00 0.00 57.88 57.56 1l5i h LEU 29 Cb 0.79 -0.24 -0.01 0.00 -0.53 0.00 0.00 40.66 40.67 1l5i h LEU 29 CO 0.06 1.13 -0.10 0.77 -0.13 0.00 0.00 178.44 180.18 1l5i h SER 30 N 0.62 0.46 -0.11 1.25 4.64 0.02 0.51 113.55 120.94 1l5i h SER 30 Ca 0.07 -0.41 -0.02 0.00 -0.47 0.00 0.00 61.79 60.95 1l5i h SER 30 Cb 0.86 -0.13 -0.00 0.00 -0.31 0.00 0.00 62.40 62.82 1l5i h SER 30 CO 0.07 0.77 -0.02 1.56 -0.87 0.00 0.00 176.83 178.33 1l5i h GLN 31 N 0.14 0.21 -0.37 4.77 4.20 -0.36 0.47 115.11 124.18 1l5i h GLN 31 Ca 0.05 -0.08 -0.02 0.00 0.06 0.00 0.00 58.65 58.66 1l5i h GLN 31 Cb 0.59 -0.01 -0.02 0.00 0.30 0.00 0.00 27.48 28.34 1l5i h GLN 31 CO 0.03 0.51 0.16 0.82 -0.67 0.00 0.00 178.83 179.69 1l5i h ILE 32 N -0.10 1.18 -0.64 2.54 1.08 0.38 0.81 117.51 122.76 1l5i h ILE 32 Ca 0.03 -0.53 -0.07 0.00 -0.39 0.00 0.00 64.86 63.90 1l5i h ILE 32 Cb 0.43 0.85 -0.03 0.00 -3.07 0.00 0.00 36.82 35.00 1l5i h ILE 32 CO 0.01 0.19 0.12 0.74 -0.69 0.00 0.00 178.15 178.53 1l5i h THR 33 N 0.45 1.25 -0.00 -0.27 2.02 0.09 -1.24 112.91 115.21 1l5i h THR 33 Ca 0.12 -0.97 0.00 0.00 0.77 0.00 0.00 66.41 66.33 1l5i h THR 33 Cb 0.15 0.63 0.00 0.00 -1.74 0.00 0.00 68.15 67.19 1l5i h THR 33 CO -0.01 0.37 -0.02 0.59 0.37 0.00 0.00 175.52 176.81 1l5i n ASN 34 N -4.23 0.02 -4.65 4.18 5.03 0.17 -4.75 115.26 111.03 1l5i n ASN 34 Ca 0.04 0.44 -0.43 0.00 0.87 0.00 0.00 54.58 55.51 1l5i n ASN 34 Cb 0.27 -0.46 -0.02 0.00 -1.02 0.00 0.00 39.78 38.55 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 -2.98 4.08 0.71 3.41 1.02 0.28 -5.00 118.68 120.20 1l5i s LEU 35 Ca 0.14 1.62 -0.11 0.00 0.02 0.00 0.00 54.13 55.80 1l5i s LEU 35 Cb 0.19 -3.54 0.02 0.00 0.02 0.00 0.00 46.19 42.88 1l5i s LEU 35 CO 0.53 -0.92 1.08 -1.58 0.02 0.00 0.00 176.35 175.48 1l5i s GLN 36 N 3.88 2.84 0.09 1.70 2.00 -1.26 -4.95 119.66 123.95 1l5i s GLN 36 Ca 0.59 0.65 -0.09 0.00 -2.00 0.00 0.00 55.36 54.51 1l5i s GLN 36 Cb -0.22 -2.00 -0.00 0.00 0.80 0.00 0.00 33.01 31.59 1l5i s GLN 36 CO 0.20 -1.09 0.20 -0.08 -0.50 0.00 0.00 175.29 174.02 1l5i s THR 37 N -3.22 0.14 0.05 -0.34 -1.32 -1.26 -5.04 115.64 104.65 1l5i s THR 37 Ca 0.58 -1.17 0.18 0.00 -1.21 0.00 0.00 61.69 60.07 1l5i s THR 37 Cb -0.12 -1.36 0.11 0.00 -1.51 0.00 0.00 72.50 69.61 1l5i s THR 37 CO 0.53 -0.62 1.63 1.55 -2.21 0.00 0.00 174.62 175.51 1l5i h PRO 38 N 2.72 0.00 0.00 7.08 0.13 -1.98 -3.42 132.00 136.53 1l5i h PRO 38 Ca -0.34 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.79 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 0.55 0.42 0.00 -2.37 -0.23 0.00 0.00 178.00 176.38 1l5i n THR 39 N -3.41 0.00 -3.64 1.56 5.66 -1.26 -5.13 114.28 108.06 1l5i n THR 39 Ca 0.01 0.00 -0.05 0.00 -3.05 0.00 0.00 64.05 60.95 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 -0.21 -0.22 1.09 2.47 -1.26 -4.99 114.94 110.82 1l5i s ASN 40 Ca 0.00 0.39 -0.19 0.00 0.42 0.00 0.00 52.86 53.48 1l5i s ASN 40 Cb 0.00 0.39 -0.03 0.00 -1.45 0.00 0.00 41.25 40.16 1l5i s ASN 40 CO 0.00 -0.08 0.55 -0.54 -3.72 0.00 0.00 177.10 173.31 1l5i s LYS 41 N 0.00 4.15 0.00 0.43 1.02 -1.26 -1.92 119.74 122.17 1l5i s LYS 41 Ca 0.06 0.44 0.00 0.00 0.02 0.00 0.00 55.97 56.49 1l5i s LYS 41 Cb -0.05 -3.60 0.00 0.00 -0.52 0.00 0.00 37.83 33.67 1l5i s LYS 41 CO -0.11 -0.25 0.00 -0.11 -0.92 0.00 0.00 175.35 173.96 1l5i n LEU 42 N 5.13 0.19 -4.87 3.17 7.94 -0.79 -4.88 117.00 122.88 1l5i n LEU 42 Ca -0.03 0.00 -0.24 0.00 -1.11 0.00 0.00 56.01 54.63 1l5i n LEU 42 Cb 0.50 0.00 -0.04 0.00 0.53 0.00 0.00 43.42 44.41 1l5i n LEU 42 CO 0.42 0.00 -0.14 0.12 -1.11 0.00 0.00 177.39 176.68 1l5i s PHE 43 N 0.00 3.28 -0.11 1.96 5.36 -1.07 -3.11 117.98 124.28 1l5i s PHE 43 Ca 0.00 -0.01 -0.04 0.00 -0.96 0.00 0.00 56.93 55.92 1l5i s PHE 43 Cb 0.00 -1.53 0.05 0.00 -0.34 0.00 0.00 43.02 41.20 1l5i s PHE 43 CO 0.00 0.50 0.14 0.42 -1.46 0.00 0.00 175.22 174.82 1l5i s ILE 44 N -1.90 -0.21 -0.15 3.12 1.01 0.13 -2.31 121.20 120.89 1l5i s ILE 44 Ca 0.33 0.19 -0.02 0.00 0.00 0.00 0.00 60.65 61.15 1l5i s ILE 44 Cb -0.09 -0.39 -0.02 0.00 0.01 0.00 0.00 42.46 41.97 1l5i s ILE 44 CO 0.26 0.01 -0.09 -0.75 0.00 0.00 0.00 174.94 174.37 1l5i s LYS 45 N 2.25 3.45 -0.17 2.79 2.47 0.91 -1.33 119.74 130.11 1l5i s LYS 45 Ca 0.04 -0.63 -0.00 0.00 -1.56 0.00 0.00 55.97 53.81 1l5i s LYS 45 Cb -0.13 -2.78 0.04 0.00 -1.46 0.00 0.00 37.83 33.50 1l5i s LYS 45 CO -0.07 0.13 -0.06 0.42 0.16 0.00 0.00 175.35 175.93 1l5i s ILE 46 N 0.59 1.17 -0.02 5.43 1.01 -1.00 -0.12 121.20 128.26 1l5i s ILE 46 Ca -0.06 -0.64 0.04 0.00 0.00 0.00 0.00 60.65 59.99 1l5i s ILE 46 Cb -0.15 -1.32 -0.01 0.00 0.01 0.00 0.00 42.46 41.00 1l5i s ILE 46 CO 0.03 0.16 -0.14 0.00 0.00 0.00 0.00 174.94 174.98 1l5i s ARG 48 N -0.19 3.46 -0.09 0.00 3.52 -1.26 -0.65 118.95 123.74 1l5i s ARG 48 Ca 0.03 -0.21 -0.06 0.00 -0.13 0.00 0.00 55.73 55.36 1l5i s ARG 48 Cb -0.07 -3.14 0.03 0.00 -1.56 0.00 0.00 34.95 30.21 1l5i s ARG 48 CO 0.00 0.72 0.21 -2.00 -0.81 0.00 0.00 175.30 173.42 1l5i s GLU 49 N -1.53 0.20 -0.14 5.12 2.56 -0.83 -4.92 118.70 119.17 1l5i s GLU 49 Ca 0.22 0.39 -0.11 0.00 0.00 0.00 0.00 54.97 55.47 1l5i s GLU 49 Cb -0.12 -0.02 -0.05 0.00 2.00 0.00 0.00 34.13 35.94 1l5i s GLU 49 CO 0.12 -0.10 0.21 -0.51 -0.56 0.00 0.00 175.26 174.42 1l5i s LEU 50 N 0.70 4.31 0.43 2.70 2.01 -1.26 -0.27 118.68 127.29 1l5i s LEU 50 Ca -0.05 0.47 -0.15 0.00 0.01 0.00 0.00 54.13 54.41 1l5i s LEU 50 Cb -0.06 -2.22 -0.08 0.00 0.01 0.00 0.00 46.19 43.84 1l5i s LEU 50 CO -0.04 0.25 0.86 -1.00 1.01 0.00 0.00 176.35 177.43 1l5i s HIS 51 N -0.24 3.42 -1.31 0.29 3.76 -0.13 -4.87 115.29 116.22 1l5i s HIS 51 Ca 0.14 1.29 0.20 0.00 -0.15 0.00 0.00 55.06 56.54 1l5i s HIS 51 Cb -0.13 -2.63 0.95 0.00 1.11 0.00 0.00 32.58 31.88 1l5i s HIS 51 CO 0.03 -0.16 1.61 -1.91 -0.85 0.00 0.00 174.74 173.47 1l5i n GLU 52 N -1.13 0.20 -0.01 1.40 2.13 -1.26 -1.94 120.64 120.03 1l5i n GLU 52 Ca 0.05 0.12 0.13 0.00 0.66 0.00 0.00 57.16 58.12 1l5i n GLU 52 Cb 0.54 -1.50 0.68 0.00 0.27 0.00 0.00 31.44 31.43 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 -1.34 0.57 0.00 4.31 3.02 -1.26 -4.85 115.26 115.71 1l5i n ASN 53 Ca 0.08 -1.31 0.00 0.00 -0.03 0.00 0.00 54.58 53.32 1l5i n ASN 53 Cb 0.18 -0.01 0.00 0.00 -0.61 0.00 0.00 39.78 39.33 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 1.01 0.86 3.81 7.41 0.00 -0.82 -5.03 105.19 112.44 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 -0.21 3.89 -0.03 1.61 -1.05 -1.25 -4.93 118.70 116.72 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 -3.29 -0.04 0.00 -0.44 0.00 0.00 34.13 30.37 1l5i s GLU 55 CO 0.00 0.55 1.21 -1.25 0.95 0.00 0.00 175.26 176.73 1l5i s PRO 56 N -0.49 4.36 0.18 -4.83 0.04 -1.26 -0.95 135.00 132.05 1l5i s PRO 56 Ca 0.18 1.70 0.08 0.00 0.04 0.00 0.00 61.00 63.00 1l5i s PRO 56 Cb -0.14 -3.53 -0.04 0.00 0.04 0.00 0.00 34.50 30.83 1l5i s PRO 56 CO 0.07 -0.43 -0.01 -1.58 0.04 0.00 0.00 177.00 175.09 1l5i s HIS 57 N 2.06 2.80 -0.01 0.56 2.46 0.62 -0.87 115.29 122.91 1l5i s HIS 57 Ca 0.57 -0.16 0.02 0.00 0.47 0.00 0.00 55.06 55.96 1l5i s HIS 57 Cb -0.26 -1.35 -0.00 0.00 -0.13 0.00 0.00 32.58 30.84 1l5i s HIS 57 CO 0.23 0.53 -0.07 -1.17 -2.47 0.00 0.00 174.74 171.79 1l5i s LEU 58 N -3.00 1.88 -0.01 8.88 1.98 -0.92 -1.97 118.68 125.52 1l5i s LEU 58 Ca 0.27 -0.14 0.08 0.00 -2.89 0.00 0.00 54.13 51.45 1l5i s LEU 58 Cb -0.09 -0.42 -0.02 0.00 0.66 0.00 0.00 46.19 46.32 1l5i s LEU 58 CO 0.18 0.07 -0.25 -1.00 -1.89 0.00 0.00 176.35 173.46 1l5i s HIS 59 N 0.04 2.21 -0.03 5.38 3.76 0.18 -2.39 115.29 124.43 1l5i s HIS 59 Ca -0.00 -0.42 -0.03 0.00 -0.15 0.00 0.00 55.06 54.46 1l5i s HIS 59 Cb -0.05 -1.41 0.01 0.00 1.11 0.00 0.00 32.58 32.24 1l5i s HIS 59 CO -0.00 -0.01 0.09 0.42 -0.85 0.00 0.00 174.74 174.39 1l5i s ILE 60 N -0.62 -0.00 -0.17 0.60 1.01 -0.87 -1.42 121.20 119.72 1l5i s ILE 60 Ca 0.10 0.01 -0.04 0.00 0.00 0.00 0.00 60.65 60.72 1l5i s ILE 60 Cb -0.10 -0.13 0.06 0.00 0.01 0.00 0.00 42.46 42.30 1l5i s ILE 60 CO -0.00 0.01 0.07 -0.22 0.00 0.00 0.00 174.94 174.79 1l5i s LEU 61 N 0.12 0.59 0.11 2.97 1.98 0.83 -1.84 118.68 123.44 1l5i s LEU 61 Ca -0.01 -0.64 0.09 0.00 -2.89 0.00 0.00 54.13 50.69 1l5i s LEU 61 Cb -0.01 -0.35 -0.04 0.00 0.66 0.00 0.00 46.19 46.45 1l5i s LEU 61 CO -0.00 -0.33 -0.21 -0.63 -1.89 0.00 0.00 176.35 173.28 1l5i s ILE 62 N 2.05 2.61 -0.09 6.68 1.01 -0.40 -0.07 121.20 133.00 1l5i s ILE 62 Ca 0.01 -1.54 -0.02 0.00 0.00 0.00 0.00 60.65 59.11 1l5i s ILE 62 Cb -0.16 -2.16 0.03 0.00 0.01 0.00 0.00 42.46 40.18 1l5i s ILE 62 CO -0.08 0.14 0.01 0.00 0.00 0.00 0.00 174.94 175.01 1l5i s GLN 63 N -1.97 0.55 0.37 2.79 1.03 -0.98 -0.28 119.66 121.17 1l5i s GLN 63 Ca 0.16 0.05 -0.04 0.00 0.04 0.00 0.00 55.36 55.57 1l5i s GLN 63 Cb -0.10 -1.13 -0.04 0.00 0.03 0.00 0.00 33.01 31.76 1l5i s GLN 63 CO 0.08 -0.37 0.64 -0.06 -2.54 0.00 0.00 175.29 173.04 1l5i s PHE 64 N 1.98 3.51 0.42 9.60 0.40 0.11 -1.88 117.98 132.12 1l5i s PHE 64 Ca 0.04 0.65 0.08 0.00 -0.60 0.00 0.00 56.93 57.10 1l5i s PHE 64 Cb -0.13 -2.14 0.91 0.00 0.51 0.00 0.00 43.02 42.18 1l5i s PHE 64 CO -0.06 -0.00 2.06 1.49 0.70 0.00 0.00 175.22 179.41 1l5i h GLU 65 N 0.94 0.47 -5.33 0.44 4.81 -1.68 -3.44 114.58 110.80 1l5i h GLU 65 Ca -0.48 -0.03 -0.40 0.00 -0.13 0.00 0.00 59.36 58.32 1l5i h GLU 65 Cb 1.20 -0.11 -0.14 0.00 0.63 0.00 0.00 28.75 30.33 1l5i h GLU 65 CO 0.63 0.31 -0.72 0.20 -0.73 0.00 0.00 179.01 178.71 1l5i s GLY 66 N -3.73 1.32 -0.21 1.92 0.00 -1.26 -5.05 107.32 100.30 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 0.73 -1.69 2.20 0.28 0.00 0.00 0.00 173.10 174.62 1l5i n LYS 67 N -0.32 1.94 -3.24 2.90 5.02 -1.26 -4.60 118.16 118.59 1l5i n LYS 67 Ca -0.08 0.55 -0.38 0.00 -2.02 0.00 0.00 58.31 56.38 1l5i n LYS 67 Cb 0.61 -3.14 -0.06 0.00 -0.02 0.00 0.00 35.03 32.42 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 7.92 3.76 -0.31 2.13 5.04 0.15 -4.75 117.35 131.29 1l5i s TYR 68 Ca 1.01 1.28 -0.12 0.00 -2.44 0.00 0.00 57.07 56.80 1l5i s TYR 68 Cb -0.40 -2.51 -0.03 0.00 0.35 0.00 0.00 41.96 39.37 1l5i s TYR 68 CO 0.37 0.52 0.23 1.21 -1.34 0.00 0.00 175.55 176.54 1l5i s ASN 69 N -1.30 6.06 -0.72 4.32 3.04 -1.26 -2.15 114.94 122.92 1l5i s ASN 69 Ca 0.33 -0.17 0.04 0.00 0.04 0.00 0.00 52.86 53.10 1l5i s ASN 69 Cb -0.19 -2.14 0.26 0.00 -1.54 0.00 0.00 41.25 37.65 1l5i s ASN 69 CO 0.20 -0.14 0.89 0.00 -3.04 0.00 0.00 177.10 175.01 1l5i n THR 71 N 0.91 2.39 -3.57 0.00 5.66 -1.26 -2.92 114.28 115.50 1l5i n THR 71 Ca 0.29 -1.21 -0.00 0.00 -3.05 0.00 0.00 64.05 60.08 1l5i n THR 71 Cb 0.39 -0.66 -0.04 0.00 -1.55 0.00 0.00 70.33 68.48 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 -0.46 -0.95 -0.25 1.09 2.47 -1.26 -4.74 114.94 110.83 1l5i s ASN 72 Ca 0.36 1.31 -0.02 0.00 0.42 0.00 0.00 52.86 54.93 1l5i s ASN 72 Cb 0.30 2.08 0.07 0.00 -1.45 0.00 0.00 41.25 42.26 1l5i s ASN 72 CO 0.07 -0.18 2.43 0.00 -3.72 0.00 0.00 177.10 175.70 1l5i n GLN 73 N 5.28 1.84 -0.00 0.43 6.02 -1.26 -3.61 117.38 126.08 1l5i n GLN 73 Ca -0.11 -1.41 0.02 0.00 -0.01 0.00 0.00 57.00 55.48 1l5i n GLN 73 Cb 0.50 -1.70 -0.03 0.00 1.02 0.00 0.00 30.24 30.04 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 0.98 1.26 0.07 -1.09 1.74 -1.26 -4.46 116.66 113.89 1l5i n ARG 74 Ca 0.31 -0.03 -0.21 0.00 -0.77 0.00 0.00 57.85 57.15 1l5i n ARG 74 Cb 0.61 -1.01 -0.12 0.00 -1.02 0.00 0.00 32.46 30.92 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 1.03 -0.27 -1.55 3.57 -2.00 -3.14 116.94 114.57 1l5i h PHE 75 Ca 0.00 -0.61 0.00 0.00 3.53 0.00 0.00 57.97 60.89 1l5i h PHE 75 Cb 0.16 -0.10 0.00 0.00 2.79 0.00 0.00 35.95 38.80 1l5i h PHE 75 CO 0.00 1.45 0.00 1.19 -2.23 0.00 0.00 178.31 178.72 1l5i n PHE 76 N -3.83 0.52 -1.92 0.41 3.72 -1.26 -4.85 117.46 110.25 1l5i n PHE 76 Ca -0.13 -0.22 -0.41 0.00 -0.05 0.00 0.00 57.45 56.64 1l5i n PHE 76 Cb 0.94 -0.08 -0.03 0.00 -0.94 0.00 0.00 39.48 39.37 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 -0.80 5.48 -0.12 4.37 1.01 -1.19 -4.46 116.67 120.96 1l5i s ASP 77 Ca 0.20 1.04 -0.05 0.00 0.71 0.00 0.00 52.55 54.45 1l5i s ASP 77 Cb 0.12 -2.52 -0.04 0.00 1.01 0.00 0.00 42.92 41.49 1l5i s ASP 77 CO 0.11 -2.08 0.05 -0.76 0.21 0.00 0.00 175.17 172.70 1l5i s LEU 78 N 8.35 3.83 0.29 1.23 1.02 -0.96 -4.97 118.68 127.47 1l5i s LEU 78 Ca 0.80 0.19 0.07 0.00 0.02 0.00 0.00 54.13 55.22 1l5i s LEU 78 Cb -0.20 -1.92 -0.06 0.00 0.02 0.00 0.00 46.19 44.04 1l5i s LEU 78 CO 0.29 0.32 -0.07 0.68 0.02 0.00 0.00 176.35 177.59 1l5i s VAL 79 N -0.51 1.80 -0.27 -1.59 -7.23 -1.26 0.38 120.40 111.71 1l5i s VAL 79 Ca 0.10 -2.15 -0.25 0.00 -1.81 0.00 0.00 61.98 57.87 1l5i s VAL 79 Cb -0.12 -2.49 -0.00 0.00 0.56 0.00 0.00 36.38 34.33 1l5i s VAL 79 CO 0.02 -0.28 0.84 -0.55 -0.31 0.00 0.00 175.10 174.82 1l5i s SER 80 N -3.48 6.80 0.00 4.85 0.15 0.41 -4.90 113.70 117.53 1l5i s SER 80 Ca 0.30 0.93 0.23 0.00 0.70 0.00 0.00 55.95 58.11 1l5i s SER 80 Cb 0.03 -2.44 1.17 0.00 -1.71 0.00 0.00 66.02 63.08 1l5i s SER 80 CO 0.13 -0.58 1.75 -0.81 1.20 0.00 0.00 173.24 174.93 1l5i n PRO 81 N 6.15 0.36 -0.01 5.44 -0.04 -1.26 -2.62 135.00 143.02 1l5i n PRO 81 Ca 0.06 0.06 0.03 0.00 -0.04 0.00 0.00 63.50 63.62 1l5i n PRO 81 Cb 0.48 -1.50 -0.07 0.00 -0.04 0.00 0.00 33.50 32.37 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 -1.26 0.06 -4.21 0.52 -2.24 -1.26 -5.01 114.28 100.88 1l5i n THR 82 Ca 0.11 -0.21 -0.17 0.00 -2.27 0.00 0.00 64.05 61.52 1l5i n THR 82 Cb 0.17 0.18 -0.13 0.00 -2.10 0.00 0.00 70.33 68.45 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 -2.55 0.64 -0.82 -0.78 3.00 -1.08 -5.03 118.95 112.34 1l5i s ARG 83 Ca -0.03 -0.55 -0.07 0.00 -1.00 0.00 0.00 55.73 54.08 1l5i s ARG 83 Cb 0.05 -0.57 -0.13 0.00 0.00 0.00 0.00 34.95 34.30 1l5i s ARG 83 CO 0.35 0.14 2.81 0.45 0.00 0.00 0.00 175.30 179.05 1l5i n SER 84 N 2.17 6.12 -4.10 -2.12 2.88 -1.26 -3.74 113.62 113.57 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 62.56 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 2.14 1.41 0.01 -1.46 0.00 -1.26 -5.02 121.76 117.58 1l5i s ALA 85 Ca 0.57 -0.61 0.01 0.00 0.00 0.00 0.00 51.96 51.93 1l5i s ALA 85 Cb 0.19 -0.50 -0.04 0.00 0.00 0.00 0.00 23.12 22.78 1l5i s ALA 85 CO -0.03 0.23 0.05 -1.01 0.00 0.00 0.00 175.76 175.00 1l5i s HIS 86 N 0.17 3.20 -0.04 0.00 3.76 -1.26 -0.44 115.29 120.67 1l5i s HIS 86 Ca -0.06 0.15 0.04 0.00 -0.15 0.00 0.00 55.06 55.04 1l5i s HIS 86 Cb -0.12 -1.70 -0.00 0.00 1.11 0.00 0.00 32.58 31.87 1l5i s HIS 86 CO 0.02 0.52 -0.17 -0.06 -0.85 0.00 0.00 174.74 174.20 1l5i s PHE 87 N -1.17 1.67 -0.42 1.40 0.08 0.16 -4.98 117.98 114.72 1l5i s PHE 87 Ca 0.22 -0.49 -0.06 0.00 0.12 0.00 0.00 56.93 56.72 1l5i s PHE 87 Cb -0.12 -1.13 0.10 0.00 -0.57 0.00 0.00 43.02 41.30 1l5i s PHE 87 CO 0.13 -0.17 0.24 -1.58 -0.10 0.00 0.00 175.22 173.74 1l5i s HIS 88 N 0.09 3.47 0.68 0.36 5.65 -1.26 -2.25 115.29 122.03 1l5i s HIS 88 Ca -0.05 -2.05 -0.11 0.00 0.25 0.00 0.00 55.06 53.10 1l5i s HIS 88 Cb -0.12 -3.18 0.00 0.00 -1.18 0.00 0.00 32.58 28.11 1l5i s HIS 88 CO 0.02 -0.94 1.06 -1.25 -0.65 0.00 0.00 174.74 172.98 1l5i s PRO 89 N 1.27 3.00 -0.18 2.88 0.04 -1.26 -4.94 135.00 135.81 1l5i s PRO 89 Ca 0.06 0.98 -0.22 0.00 0.04 0.00 0.00 61.00 61.85 1l5i s PRO 89 Cb -0.24 -2.00 -0.02 0.00 0.04 0.00 0.00 34.50 32.28 1l5i s PRO 89 CO -0.02 -1.05 0.70 1.21 0.04 0.00 0.00 177.00 177.89 1l5i s ASN 90 N -3.69 6.79 -0.16 6.66 2.47 -0.52 -4.84 114.94 121.66 1l5i s ASN 90 Ca 0.59 0.97 -0.19 0.00 0.42 0.00 0.00 52.86 54.65 1l5i s ASN 90 Cb -0.14 -2.39 -0.04 0.00 -1.45 0.00 0.00 41.25 37.24 1l5i s ASN 90 CO 0.53 -0.31 0.53 -0.63 -3.72 0.00 0.00 177.10 173.50 1l5i s ILE 91 N 1.93 5.12 -0.03 -5.21 1.01 -1.26 -2.43 121.20 120.34 1l5i s ILE 91 Ca 0.32 1.01 0.01 0.00 0.00 0.00 0.00 60.65 62.00 1l5i s ILE 91 Cb -0.16 -3.86 0.01 0.00 0.01 0.00 0.00 42.46 38.47 1l5i s ILE 91 CO 0.11 0.23 -0.04 -1.10 0.00 0.00 0.00 174.94 174.14 1l5i s GLN 92 N 1.24 0.62 -0.36 2.79 -1.52 -0.77 -4.97 119.66 116.69 1l5i s GLN 92 Ca 0.26 -0.10 -0.17 0.00 -1.95 0.00 0.00 55.36 53.40 1l5i s GLN 92 Cb -0.15 -0.65 -0.00 0.00 -0.22 0.00 0.00 33.01 31.99 1l5i s GLN 92 CO 0.10 -0.02 0.44 0.20 -0.25 0.00 0.00 175.29 175.76 1l5i s GLY 93 N 0.60 1.86 -0.38 3.09 0.00 -1.26 0.02 107.32 111.25 1l5i s GLY 93 Ca -0.07 -1.18 -0.24 0.00 0.00 0.00 0.00 44.72 43.23 1l5i s GLY 93 CO -0.00 1.15 0.84 0.00 0.00 0.00 0.00 173.10 175.08 1l5i s ALA 94 N 2.21 3.39 0.91 3.20 0.00 -0.18 -4.99 121.76 126.30 1l5i s ALA 94 Ca 0.15 -0.64 0.00 0.00 0.00 0.00 0.00 51.96 51.47 1l5i s ALA 94 Cb -0.16 -3.45 0.00 0.00 0.00 0.00 0.00 23.12 19.51 1l5i s ALA 94 CO 0.13 -1.61 0.00 0.36 0.00 0.00 0.00 175.76 174.63 1l5i n LYS 95 N 6.62 2.15 -3.31 0.00 2.85 -1.26 -3.84 118.16 121.37 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 -1.54 -0.05 0.00 0.00 177.40 175.81 1l5i s SER 96 N -1.95 6.94 0.00 -5.58 1.04 -1.26 -4.82 113.70 108.08 1l5i s SER 96 Ca 0.00 1.17 0.00 0.00 0.48 0.00 0.00 55.95 57.60 1l5i s SER 96 Cb 0.00 -2.32 0.00 0.00 0.10 0.00 0.00 66.02 63.80 1l5i s SER 96 CO 0.00 0.19 0.00 -1.20 0.98 0.00 0.00 173.24 173.21 1l5i n SER 97 N 1.25 0.00 -0.01 7.02 7.64 -1.26 -4.96 113.62 123.30 1l5i n SER 97 Ca -0.08 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 -1.54 -3.01 0.00 0.00 175.04 170.49 1l5i n SER 98 N 0.00 0.04 -0.16 6.43 3.41 -1.26 -3.68 113.62 118.41 1l5i n SER 98 Ca 0.00 -0.03 0.28 0.00 -0.26 0.00 0.00 58.87 58.86 1l5i n SER 98 Cb 0.00 -0.31 0.60 0.00 -0.26 0.00 0.00 64.21 64.24 1l5i n SER 98 CO 0.00 0.00 0.00 -0.78 -0.16 0.00 0.00 175.04 174.10 1l5i h ASP 99 N 0.04 0.00 -0.42 4.04 3.58 -1.99 2.03 116.42 123.69 1l5i h ASP 99 Ca 0.00 0.00 -0.10 0.00 0.42 0.00 0.00 57.03 57.35 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 1.27 -0.91 2.25 -1.51 -1.99 -2.47 116.25 112.90 1l5i h VAL 100 Ca 0.43 -1.23 -0.01 0.00 -1.23 0.00 0.00 66.70 64.67 1l5i h VAL 100 Cb 2.31 1.19 -0.04 0.00 -2.13 0.00 0.00 31.29 32.61 1l5i h VAL 100 CO -0.00 0.41 0.53 0.50 -1.23 0.00 0.00 177.57 177.79 1l5i h LYS 101 N 0.65 1.24 -0.22 5.19 3.11 0.30 0.14 116.57 126.97 1l5i h LYS 101 Ca 0.11 -0.12 0.03 0.00 -2.81 0.00 0.00 60.65 57.85 1l5i h LYS 101 Cb 0.65 -0.26 -0.03 0.00 -1.00 0.00 0.00 32.23 31.60 1l5i h LYS 101 CO 0.04 0.87 0.05 0.77 -2.81 0.00 0.00 179.45 178.38 1l5i h SER 102 N 1.25 0.04 -0.06 4.20 0.02 -1.17 0.33 113.55 118.17 1l5i h SER 102 Ca 0.32 0.03 -0.09 0.00 -0.84 0.00 0.00 61.79 61.21 1l5i h SER 102 Cb -0.04 0.03 -0.01 0.00 0.14 0.00 0.00 62.40 62.52 1l5i h SER 102 CO -0.06 0.05 -0.24 0.22 -1.14 0.00 0.00 176.83 175.66 1l5i h TYR 103 N 0.15 0.54 -0.57 3.45 5.03 -0.97 -1.91 116.97 122.68 1l5i h TYR 103 Ca 0.10 -0.11 -0.10 0.00 2.58 0.00 0.00 58.73 61.20 1l5i h TYR 103 Cb 0.09 -0.13 -0.02 0.00 1.55 0.00 0.00 36.73 38.21 1l5i h TYR 103 CO -0.14 0.69 -0.03 0.82 -1.32 0.00 0.00 178.16 178.18 1l5i h ILE 104 N 0.43 1.26 0.00 1.81 2.04 0.03 -1.98 117.51 121.10 1l5i h ILE 104 Ca 0.06 -1.18 -0.05 0.00 1.00 0.00 0.00 64.86 64.70 1l5i h ILE 104 Cb 0.66 0.86 -0.01 0.00 -0.74 0.00 0.00 36.82 37.59 1l5i h ILE 104 CO 0.05 0.42 -0.23 -0.78 0.00 0.00 0.00 178.15 177.61 1l5i h ASP 105 N 0.93 0.00 0.00 1.72 3.58 -0.04 -3.33 116.42 119.29 1l5i h ASP 105 Ca 0.16 0.00 -0.65 0.00 0.42 0.00 0.00 57.03 56.96 1l5i h ASP 105 Cb 0.58 0.00 0.01 0.00 1.72 0.00 0.00 39.33 41.65 1l5i h ASP 105 CO 0.04 0.23 2.75 0.29 -2.88 0.00 0.00 179.24 179.67 1l5i n LYS 106 N -3.60 2.20 -2.09 0.28 5.02 -0.74 -4.90 118.16 114.34 1l5i n LYS 106 Ca -0.01 -2.11 -0.28 0.00 -2.02 0.00 0.00 58.31 53.89 1l5i n LYS 106 Cb 0.37 -3.00 0.17 0.00 -0.02 0.00 0.00 35.03 32.54 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 3.99 3.44 0.00 4.39 1.47 -1.25 -4.99 116.67 123.72 1l5i s ASP 107 Ca 0.53 0.12 0.00 0.00 1.18 0.00 0.00 52.55 54.38 1l5i s ASP 107 Cb 0.14 -0.25 0.00 0.00 -0.34 0.00 0.00 42.92 42.47 1l5i s ASP 107 CO 0.01 -2.51 0.00 0.61 0.68 0.00 0.00 175.17 173.97 1l5i n GLY 108 N -3.53 1.79 2.86 2.12 0.00 -1.26 -4.93 105.19 102.24 1l5i n GLY 108 Ca 0.15 -0.18 -0.21 0.00 0.00 0.00 0.00 46.02 45.78 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 -5.90 -4.64 1.61 8.00 -1.26 -4.87 116.55 109.49 1l5i n ASP 109 Ca 0.00 -0.23 -0.25 0.00 0.71 0.00 0.00 54.79 55.02 1l5i n ASP 109 Cb 0.00 -4.76 -0.09 0.00 -0.02 0.00 0.00 41.12 36.26 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 -3.13 2.53 0.02 2.53 -7.23 -1.26 -4.63 120.40 109.24 1l5i s VAL 110 Ca 0.24 -1.96 0.01 0.00 -1.81 0.00 0.00 61.98 58.46 1l5i s VAL 110 Cb -0.11 -2.82 -0.04 0.00 0.56 0.00 0.00 36.38 33.97 1l5i s VAL 110 CO 0.30 -0.17 0.07 -0.22 -0.31 0.00 0.00 175.10 174.77 1l5i s LEU 111 N -3.73 3.82 -0.08 1.32 0.20 0.00 -5.02 118.68 115.20 1l5i s LEU 111 Ca 0.35 0.08 0.02 0.00 0.69 0.00 0.00 54.13 55.27 1l5i s LEU 111 Cb 0.01 -2.30 0.02 0.00 -0.43 0.00 0.00 46.19 43.48 1l5i s LEU 111 CO 0.19 0.25 -0.12 -0.70 -0.29 0.00 0.00 176.35 175.68 1l5i s GLU 112 N -1.90 1.73 0.03 1.98 2.12 -1.26 -2.37 118.70 119.03 1l5i s GLU 112 Ca 0.24 -0.40 -0.01 0.00 0.36 0.00 0.00 54.97 55.16 1l5i s GLU 112 Cb -0.12 -1.49 -0.03 0.00 0.26 0.00 0.00 34.13 32.75 1l5i s GLU 112 CO 0.16 -0.03 -0.02 -0.46 -0.54 0.00 0.00 175.26 174.36 1l5i s TRP 113 N 0.88 0.34 0.24 5.30 -0.00 -0.44 -5.04 118.94 120.22 1l5i s TRP 113 Ca -0.10 -0.70 0.00 0.00 -0.00 0.00 0.00 56.10 55.29 1l5i s TRP 113 Cb -0.15 -0.25 0.00 0.00 -0.00 0.00 0.00 33.47 33.07 1l5i s TRP 113 CO 0.01 -0.26 0.00 0.41 -0.00 0.00 0.00 176.95 177.11 1l5i n GLY 114 N 1.09 -1.88 3.03 5.86 0.00 -1.26 0.21 105.19 112.24 1l5i n GLY 114 Ca -0.21 -1.28 -0.31 0.00 0.00 0.00 0.00 46.02 44.22 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 -2.08 1.69 0.41 2.61 2.01 -1.18 -4.64 115.64 114.46 1l5i s THR 115 Ca 0.00 -0.78 -0.22 0.00 0.31 0.00 0.00 61.69 60.99 1l5i s THR 115 Cb 0.00 -1.61 -0.11 0.00 0.01 0.00 0.00 72.50 70.79 1l5i s THR 115 CO 0.00 0.41 0.95 0.12 -0.69 0.00 0.00 174.62 175.41 1l5i s PHE 116 N 1.42 3.39 -1.17 4.92 2.19 -1.26 -3.93 117.98 123.54 1l5i s PHE 116 Ca 0.03 1.65 -0.08 0.00 0.33 0.00 0.00 56.93 58.86 1l5i s PHE 116 Cb -0.14 -2.88 0.24 0.00 -1.31 0.00 0.00 43.02 38.93 1l5i s PHE 116 CO -0.11 -0.06 1.50 1.04 1.83 0.00 0.00 175.22 179.42 1l5i n GLN 117 N -0.36 3.83 -2.58 10.12 1.13 -1.26 -4.98 117.38 123.28 1l5i n GLN 117 Ca 0.06 -4.12 -0.43 0.00 -1.94 0.00 0.00 57.00 50.57 1l5i n GLN 117 Cb 0.53 -2.74 -0.02 0.00 0.11 0.00 0.00 30.24 28.12 1l5i n GLN 117 CO 0.00 0.00 0.00 0.42 -1.44 0.00 0.00 177.06 176.04 1l5i s ILE 118 N -0.75 4.29 0.36 5.09 1.01 -1.26 -5.00 121.20 124.94 1l5i s ILE 118 Ca 0.36 1.40 -0.27 0.00 0.00 0.00 0.00 60.65 62.14 1l5i s ILE 118 Cb 0.01 -4.47 -0.09 0.00 0.01 0.00 0.00 42.46 37.93 1l5i s ILE 118 CO 0.02 -0.75 1.13 -1.81 0.00 0.00 0.00 174.94 173.53 1l5i s ASP 119 N 2.30 6.83 0.00 3.58 1.01 -1.26 -4.93 116.67 124.20 1l5i s ASP 119 Ca 0.49 2.28 0.00 0.00 0.71 0.00 0.00 52.55 56.03 1l5i s ASP 119 Cb -0.10 -2.61 0.00 0.00 1.01 0.00 0.00 42.92 41.21 1l5i s ASP 119 CO 0.25 -0.45 0.00 0.61 0.21 0.00 0.00 175.17 175.79 1l5i n GLY 120 N 0.76 4.28 0.00 0.21 0.00 -1.26 -5.20 105.19 103.98 1l5i n GLY 120 Ca 0.02 -1.07 0.00 0.00 0.00 0.00 0.00 46.02 44.97 1l5i n GLY 120 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36