#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 -0.10 3.59 5.00 0.00 -1.26 -5.13 105.19 107.29 1l5i n GLY 5 Ca 0.00 -0.77 -0.24 0.00 0.00 0.00 0.00 46.02 45.00 1l5i n GLY 5 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1l5i s ARG 6 N -0.03 2.12 -0.65 1.61 3.52 -1.26 -5.07 118.95 119.19 1l5i s ARG 6 Ca 0.00 -1.42 -0.27 0.00 -0.13 0.00 0.00 55.73 53.91 1l5i s ARG 6 Cb 0.00 -2.10 0.02 0.00 -1.56 0.00 0.00 34.95 31.31 1l5i s ARG 6 CO 0.00 0.38 1.40 0.12 -0.81 0.00 0.00 175.30 176.39 1l5i s PHE 7 N -2.14 2.22 -0.14 5.12 5.36 -1.26 -4.96 117.98 122.19 1l5i s PHE 7 Ca 0.29 0.28 -0.02 0.00 -0.96 0.00 0.00 56.93 56.52 1l5i s PHE 7 Cb -0.07 -4.47 0.04 0.00 -0.34 0.00 0.00 43.02 38.18 1l5i s PHE 7 CO 0.18 -2.03 -0.01 -1.54 -1.46 0.00 0.00 175.22 170.36 1l5i s SER 8 N 4.50 2.42 -0.14 6.13 1.04 -1.26 -4.20 113.70 122.19 1l5i s SER 8 Ca 0.46 -0.51 -0.03 0.00 0.48 0.00 0.00 55.95 56.34 1l5i s SER 8 Cb -0.09 -0.65 -0.03 0.00 0.10 0.00 0.00 66.02 65.35 1l5i s SER 8 CO 0.20 -0.22 -0.03 -0.63 0.98 0.00 0.00 173.24 173.53 1l5i s ILE 9 N 1.82 3.97 -0.17 -1.02 1.01 -1.14 -4.90 121.20 120.77 1l5i s ILE 9 Ca 0.02 -0.34 -0.03 0.00 0.00 0.00 0.00 60.65 60.30 1l5i s ILE 9 Cb -0.15 -2.72 0.05 0.00 0.01 0.00 0.00 42.46 39.65 1l5i s ILE 9 CO -0.07 0.51 0.03 -0.75 0.00 0.00 0.00 174.94 174.66 1l5i s LYS 10 N 0.12 0.66 0.15 2.79 2.20 -1.26 0.96 119.74 125.37 1l5i s LYS 10 Ca -0.01 -0.32 -0.24 0.00 -0.36 0.00 0.00 55.97 55.04 1l5i s LYS 10 Cb -0.13 -1.90 0.06 0.00 -1.51 0.00 0.00 37.83 34.35 1l5i s LYS 10 CO 0.03 -0.57 0.73 0.00 -0.36 0.00 0.00 175.35 175.17 1l5i s ALA 11 N 1.88 -1.56 0.07 3.13 0.00 -0.97 -4.96 121.76 119.34 1l5i s ALA 11 Ca 0.00 0.36 -0.03 0.00 0.00 0.00 0.00 51.96 52.30 1l5i s ALA 11 Cb -0.16 0.76 -0.27 0.00 0.00 0.00 0.00 23.12 23.44 1l5i s ALA 11 CO -0.07 -0.85 1.10 -0.22 0.00 0.00 0.00 175.76 175.72 1l5i h LYS 12 N 2.00 0.23 -6.56 0.00 3.11 -1.84 0.29 116.57 113.81 1l5i h LYS 12 Ca -0.27 -0.40 -0.67 0.00 -2.81 0.00 0.00 60.65 56.50 1l5i h LYS 12 Cb 1.27 0.15 -0.18 0.00 -1.00 0.00 0.00 32.23 32.47 1l5i h LYS 12 CO 0.31 1.17 -0.76 -0.80 -2.81 0.00 0.00 179.45 176.56 1l5i s ASN 13 N -7.06 4.17 0.01 4.20 0.01 -1.25 -0.65 114.94 114.36 1l5i s ASN 13 Ca -0.04 -0.40 0.03 0.00 -0.71 0.00 0.00 52.86 51.74 1l5i s ASN 13 Cb 0.07 -0.75 -0.01 0.00 0.41 0.00 0.00 41.25 40.97 1l5i s ASN 13 CO 0.87 0.21 -0.09 -0.31 -1.51 0.00 0.00 177.10 176.27 1l5i s TYR 14 N -1.09 0.84 -0.16 2.20 2.02 0.38 -1.16 117.35 120.37 1l5i s TYR 14 Ca 0.18 -0.24 0.01 0.00 -0.37 0.00 0.00 57.07 56.66 1l5i s TYR 14 Cb -0.11 -0.52 0.02 0.00 -0.40 0.00 0.00 41.96 40.95 1l5i s TYR 14 CO 0.10 -0.01 -0.20 -0.06 -1.57 0.00 0.00 175.55 173.80 1l5i s PHE 15 N -0.51 2.69 -0.18 2.71 0.08 0.40 -1.46 117.98 121.70 1l5i s PHE 15 Ca 0.01 -1.51 -0.07 0.00 0.12 0.00 0.00 56.93 55.48 1l5i s PHE 15 Cb -0.05 -1.85 -0.04 0.00 -0.57 0.00 0.00 43.02 40.51 1l5i s PHE 15 CO 0.00 -0.73 0.05 -0.51 -0.10 0.00 0.00 175.22 173.94 1l5i s LEU 16 N 1.14 3.75 -0.18 -0.37 2.01 -0.61 -1.84 118.68 122.57 1l5i s LEU 16 Ca 0.01 0.05 0.01 0.00 0.01 0.00 0.00 54.13 54.20 1l5i s LEU 16 Cb -0.14 -1.95 0.03 0.00 0.01 0.00 0.00 46.19 44.14 1l5i s LEU 16 CO -0.09 0.16 -0.16 -0.89 1.01 0.00 0.00 176.35 176.38 1l5i s THR 17 N 0.44 1.85 -0.44 5.49 2.01 -1.01 -1.98 115.64 121.99 1l5i s THR 17 Ca 0.02 -0.92 -0.09 0.00 0.31 0.00 0.00 61.69 61.02 1l5i s THR 17 Cb -0.13 -1.75 0.10 0.00 0.01 0.00 0.00 72.50 70.73 1l5i s THR 17 CO 0.01 0.40 0.30 -0.31 -0.69 0.00 0.00 174.62 174.33 1l5i s TYR 18 N 1.35 3.40 0.27 4.92 1.51 -0.97 -1.52 117.35 126.31 1l5i s TYR 18 Ca 0.03 -1.78 -0.30 0.00 -1.01 0.00 0.00 57.07 54.01 1l5i s TYR 18 Cb -0.14 -3.26 -0.09 0.00 -0.11 0.00 0.00 41.96 38.36 1l5i s TYR 18 CO -0.11 -0.94 1.08 -1.25 -1.11 0.00 0.00 175.55 173.23 1l5i s PRO 19 N 1.37 4.66 -1.64 -1.71 0.04 -1.26 -2.38 135.00 134.08 1l5i s PRO 19 Ca 0.05 1.76 -0.07 0.00 0.04 0.00 0.00 61.00 62.78 1l5i s PRO 19 Cb -0.25 -3.21 0.07 0.00 0.04 0.00 0.00 34.50 31.16 1l5i s PRO 19 CO 0.00 0.24 0.18 1.63 0.04 0.00 0.00 177.00 179.09 1l5i n LYS 20 N 1.32 -0.87 -3.93 4.56 5.02 -0.21 -4.88 118.16 119.16 1l5i n LYS 20 Ca -0.01 0.10 -0.35 0.00 -2.02 0.00 0.00 58.31 56.03 1l5i n LYS 20 Cb 0.45 -3.89 -0.14 0.00 -0.02 0.00 0.00 35.03 31.43 1l5i n LYS 20 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1l5i n ASP 22 N 4.70 2.25 -4.75 0.00 8.00 -1.26 -4.32 116.55 121.17 1l5i n ASP 22 Ca -0.18 -2.20 -0.41 0.00 0.71 0.00 0.00 54.79 52.71 1l5i n ASP 22 Cb 0.51 -0.40 -0.03 0.00 -0.02 0.00 0.00 41.12 41.18 1l5i n ASP 22 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 1l5i s LEU 23 N -1.03 4.42 0.53 0.64 2.96 -1.26 -5.01 118.68 119.93 1l5i s LEU 23 Ca 0.20 2.50 -0.05 0.00 -0.22 0.00 0.00 54.13 56.56 1l5i s LEU 23 Cb 0.13 -3.62 -0.02 0.00 0.50 0.00 0.00 46.19 43.19 1l5i s LEU 23 CO 0.09 -0.53 0.84 0.42 -1.32 0.00 0.00 176.35 175.84 1l5i s THR 24 N -0.25 4.33 0.31 3.68 -4.23 -1.26 -4.92 115.64 113.29 1l5i s THR 24 Ca 0.55 0.10 0.14 0.00 -1.18 0.00 0.00 61.69 61.30 1l5i s THR 24 Cb -0.38 -3.67 0.07 0.00 1.34 0.00 0.00 72.50 69.86 1l5i s THR 24 CO 0.42 -0.67 1.75 0.07 -0.54 0.00 0.00 174.62 175.65 1l5i h LYS 25 N 0.05 0.00 -0.16 3.99 2.10 -1.96 -0.79 116.57 119.80 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 32.55 1l5i h LYS 25 CO 0.61 0.44 0.02 0.93 -2.00 0.00 0.00 179.45 179.45 1l5i h GLU 26 N 0.00 0.27 -0.29 0.07 4.39 -1.97 1.45 114.58 118.51 1l5i h GLU 26 Ca -0.00 -0.07 -0.07 0.00 0.34 0.00 0.00 59.36 59.55 1l5i h GLU 26 Cb 0.83 -0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 29.44 1l5i h GLU 26 CO 0.06 0.45 -0.11 -0.91 -1.16 0.00 0.00 179.01 177.34 1l5i h ASN 27 N 0.05 0.59 -0.24 1.42 -0.26 -1.92 0.34 115.58 115.57 1l5i h ASN 27 Ca 0.05 -0.39 -0.09 0.00 -0.56 0.00 0.00 56.30 55.30 1l5i h ASN 27 Cb 0.32 -0.16 -0.02 0.00 -1.06 0.00 0.00 38.32 37.40 1l5i h ASN 27 CO 0.00 0.85 -0.16 0.00 -1.06 0.00 0.00 177.43 177.07 1l5i h ALA 28 N 0.76 1.04 -0.27 -0.83 0.00 -1.07 0.15 119.26 119.05 1l5i h ALA 28 Ca 0.07 -0.32 -0.09 0.00 0.00 0.00 0.00 54.91 54.56 1l5i h ALA 28 Cb 0.62 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 1l5i h ALA 28 CO 0.04 0.58 -0.20 1.25 0.00 0.00 0.00 179.25 180.92 1l5i h LEU 29 N 0.60 0.64 -0.41 0.00 7.12 0.22 0.82 115.31 124.30 1l5i h LEU 29 Ca 0.10 -0.44 -0.03 0.00 0.13 0.00 0.00 57.88 57.63 1l5i h LEU 29 Cb 0.61 -0.18 -0.02 0.00 -0.53 0.00 0.00 40.66 40.55 1l5i h LEU 29 CO 0.04 0.95 0.15 0.77 -0.13 0.00 0.00 178.44 180.22 1l5i h SER 30 N 0.34 0.59 -0.18 1.25 4.64 -0.04 0.65 113.55 120.80 1l5i h SER 30 Ca 0.05 -0.19 -0.09 0.00 -0.47 0.00 0.00 61.79 61.10 1l5i h SER 30 Cb 0.74 -0.15 -0.00 0.00 -0.31 0.00 0.00 62.40 62.67 1l5i h SER 30 CO 0.05 0.62 -0.23 1.56 -0.87 0.00 0.00 176.83 177.96 1l5i h GLN 31 N 0.53 0.47 -0.42 4.77 4.20 -0.64 -0.46 115.11 123.55 1l5i h GLN 31 Ca 0.14 -0.27 -0.01 0.00 0.06 0.00 0.00 58.65 58.57 1l5i h GLN 31 Cb 0.23 0.02 -0.02 0.00 0.30 0.00 0.00 27.48 28.01 1l5i h GLN 31 CO -0.01 0.85 0.23 0.82 -0.67 0.00 0.00 178.83 180.06 1l5i h ILE 32 N 0.12 1.15 -0.32 2.54 1.08 0.81 0.68 117.51 123.57 1l5i h ILE 32 Ca 0.02 -0.39 -0.05 0.00 -0.39 0.00 0.00 64.86 64.05 1l5i h ILE 32 Cb 0.79 0.64 -0.02 0.00 -3.07 0.00 0.00 36.82 35.17 1l5i h ILE 32 CO 0.05 0.16 -0.01 0.74 -0.69 0.00 0.00 178.15 178.41 1l5i h THR 33 N 0.55 1.19 -0.00 -0.27 2.02 0.34 -0.43 112.91 116.31 1l5i h THR 33 Ca 0.15 -0.77 0.00 0.00 0.77 0.00 0.00 66.41 66.56 1l5i h THR 33 Cb 0.05 0.96 0.00 0.00 -1.74 0.00 0.00 68.15 67.42 1l5i h THR 33 CO -0.02 0.26 -0.21 0.59 0.37 0.00 0.00 175.52 176.50 1l5i n ASN 34 N -4.29 0.30 -4.65 4.18 5.03 -0.19 -4.79 115.26 110.86 1l5i n ASN 34 Ca 0.01 -0.03 -0.43 0.00 0.87 0.00 0.00 54.58 55.00 1l5i n ASN 34 Cb 0.24 -0.12 -0.02 0.00 -1.02 0.00 0.00 39.78 38.86 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 -2.88 4.12 0.60 3.41 1.02 0.23 -5.01 118.68 120.17 1l5i s LEU 35 Ca 0.16 1.64 -0.08 0.00 0.02 0.00 0.00 54.13 55.87 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 0.58 -0.86 0.95 -1.10 0.02 0.00 0.00 176.35 175.94 1l5i s GLN 36 N 3.73 3.24 0.07 1.70 -0.21 -1.26 -4.96 119.66 121.96 1l5i s GLN 36 Ca 0.57 0.34 -0.10 0.00 0.02 0.00 0.00 55.36 56.20 1l5i s GLN 36 Cb -0.22 -2.19 0.01 0.00 1.00 0.00 0.00 33.01 31.60 1l5i s GLN 36 CO 0.18 -0.61 0.22 -0.08 -2.12 0.00 0.00 175.29 172.87 1l5i s THR 37 N -3.06 0.12 -1.36 -0.19 -1.32 -1.26 -5.02 115.64 103.55 1l5i s THR 37 Ca 0.53 -0.97 0.23 0.00 -1.21 0.00 0.00 61.69 60.27 1l5i s THR 37 Cb -0.11 -1.11 0.36 0.00 -1.51 0.00 0.00 72.50 70.13 1l5i s THR 37 CO 0.49 -0.54 1.73 -0.81 -2.21 0.00 0.00 174.62 173.28 1l5i n PRO 38 N 0.30 0.27 0.00 7.08 -0.04 -1.26 -4.59 135.00 136.76 1l5i n PRO 38 Ca -0.17 0.08 0.00 0.00 -0.04 0.00 0.00 63.50 63.37 1l5i n PRO 38 Cb 0.61 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.57 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 -1.32 0.00 -3.62 0.52 5.66 -1.26 -5.11 114.28 109.15 1l5i n THR 39 Ca 0.10 0.00 -0.08 0.00 -3.05 0.00 0.00 64.05 61.02 1l5i n THR 39 Cb 0.19 0.00 -0.06 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 0.35 -0.32 -0.31 1.09 2.47 -1.26 -4.99 114.94 111.97 1l5i s ASN 40 Ca 0.00 0.54 -0.21 0.00 0.42 0.00 0.00 52.86 53.61 1l5i s ASN 40 Cb 0.00 0.52 -0.01 0.00 -1.45 0.00 0.00 41.25 40.31 1l5i s ASN 40 CO 0.00 -0.17 0.68 -0.54 -3.72 0.00 0.00 177.10 173.35 1l5i s LYS 41 N -0.25 3.92 -0.18 0.43 1.02 -1.26 -1.91 119.74 121.51 1l5i s LYS 41 Ca 0.03 0.39 -0.15 0.00 0.02 0.00 0.00 55.97 56.26 1l5i s LYS 41 Cb -0.04 -3.73 -0.10 0.00 -0.52 0.00 0.00 37.83 33.45 1l5i s LYS 41 CO -0.06 -0.60 -0.08 -0.11 -0.92 0.00 0.00 175.35 173.57 1l5i n LEU 42 N 5.98 1.86 -4.07 3.17 7.94 -0.48 -4.90 117.00 126.50 1l5i n LEU 42 Ca 0.00 0.50 -0.11 0.00 -1.11 0.00 0.00 56.01 55.29 1l5i n LEU 42 Cb 0.49 -0.88 -0.11 0.00 0.53 0.00 0.00 43.42 43.44 1l5i n LEU 42 CO 0.47 -0.08 -0.39 0.12 -1.11 0.00 0.00 177.39 176.41 1l5i s PHE 43 N -2.39 0.60 -0.08 1.96 5.36 -1.01 -2.17 117.98 120.25 1l5i s PHE 43 Ca -0.24 -0.63 -0.02 0.00 -0.96 0.00 0.00 56.93 55.08 1l5i s PHE 43 Cb 0.05 -0.37 0.04 0.00 -0.34 0.00 0.00 43.02 42.39 1l5i s PHE 43 CO 0.40 -0.15 0.05 0.42 -1.46 0.00 0.00 175.22 174.48 1l5i s ILE 44 N -2.03 0.08 -0.12 3.12 1.01 -0.27 -2.03 121.20 120.96 1l5i s ILE 44 Ca -0.06 0.18 0.02 0.00 0.00 0.00 0.00 60.65 60.79 1l5i s ILE 44 Cb -0.06 -0.39 -0.00 0.00 0.01 0.00 0.00 42.46 42.02 1l5i s ILE 44 CO -0.02 0.10 -0.20 -0.75 0.00 0.00 0.00 174.94 174.08 1l5i s LYS 45 N 2.09 3.14 -0.17 2.79 2.47 0.02 -1.23 119.74 128.85 1l5i s LYS 45 Ca 0.04 -0.81 -0.00 0.00 -1.56 0.00 0.00 55.97 53.63 1l5i s LYS 45 Cb -0.13 -2.45 0.04 0.00 -1.46 0.00 0.00 37.83 33.84 1l5i s LYS 45 CO -0.05 0.13 -0.06 0.42 0.16 0.00 0.00 175.35 175.95 1l5i s ILE 46 N 0.50 1.19 -0.03 5.43 1.01 -0.90 -0.01 121.20 128.38 1l5i s ILE 46 Ca -0.13 -0.67 0.04 0.00 0.00 0.00 0.00 60.65 59.89 1l5i s ILE 46 Cb -0.17 -1.34 -0.01 0.00 0.01 0.00 0.00 42.46 40.96 1l5i s ILE 46 CO 0.05 0.14 -0.16 0.00 0.00 0.00 0.00 174.94 174.98 1l5i s ARG 48 N -0.08 3.15 -0.03 0.00 3.52 -1.26 0.09 118.95 124.34 1l5i s ARG 48 Ca -0.00 -0.35 -0.01 0.00 -0.13 0.00 0.00 55.73 55.24 1l5i s ARG 48 Cb -0.09 -2.94 0.02 0.00 -1.56 0.00 0.00 34.95 30.39 1l5i s ARG 48 CO 0.01 0.71 0.06 -2.00 -0.81 0.00 0.00 175.30 173.27 1l5i s GLU 49 N -1.20 0.02 -0.14 5.12 2.56 -0.81 -4.94 118.70 119.31 1l5i s GLU 49 Ca 0.17 0.18 -0.10 0.00 0.00 0.00 0.00 54.97 55.23 1l5i s GLU 49 Cb -0.12 -0.14 -0.05 0.00 2.00 0.00 0.00 34.13 35.83 1l5i s GLU 49 CO 0.07 -0.11 0.18 -0.51 -0.56 0.00 0.00 175.26 174.33 1l5i s LEU 50 N 0.72 4.31 0.49 2.70 2.01 -1.26 -1.34 118.68 126.31 1l5i s LEU 50 Ca -0.06 0.44 -0.15 0.00 0.01 0.00 0.00 54.13 54.37 1l5i s LEU 50 Cb -0.08 -2.17 -0.08 0.00 0.01 0.00 0.00 46.19 43.87 1l5i s LEU 50 CO -0.03 0.28 0.94 -1.00 1.01 0.00 0.00 176.35 177.55 1l5i s HIS 51 N -0.33 3.45 -1.33 0.29 3.76 -0.02 -4.94 115.29 116.16 1l5i s HIS 51 Ca 0.14 1.38 0.21 0.00 -0.15 0.00 0.00 55.06 56.64 1l5i s HIS 51 Cb -0.12 -2.72 1.05 0.00 1.11 0.00 0.00 32.58 31.89 1l5i s HIS 51 CO 0.03 -0.30 1.69 0.39 -0.85 0.00 0.00 174.74 175.69 1l5i n GLU 52 N -1.48 0.24 -0.02 1.40 1.02 -1.26 -2.00 120.64 118.54 1l5i n GLU 52 Ca 0.06 0.10 0.13 0.00 -0.02 0.00 0.00 57.16 57.42 1l5i n GLU 52 Cb 0.54 -1.50 0.61 0.00 -0.02 0.00 0.00 31.44 31.07 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 -1.33 0.97 0.00 1.62 4.13 -1.26 -4.86 115.26 114.52 1l5i n ASN 53 Ca 0.09 -1.40 0.00 0.00 1.68 0.00 0.00 54.58 54.95 1l5i n ASN 53 Cb 0.19 -0.02 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 1.07 0.78 3.77 7.41 0.00 -0.85 -5.03 105.19 112.35 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 -0.23 4.08 0.46 1.61 -1.05 -1.25 -4.93 118.70 117.39 1l5i s GLU 55 Ca 0.00 0.09 -0.22 0.00 -0.15 0.00 0.00 54.97 54.70 1l5i s GLU 55 Cb 0.00 -3.36 -0.09 0.00 -0.44 0.00 0.00 34.13 30.24 1l5i s GLU 55 CO 0.00 0.39 1.04 -1.25 0.95 0.00 0.00 175.26 176.39 1l5i s PRO 56 N 0.01 3.92 0.02 -4.83 0.04 -1.26 -0.84 135.00 132.06 1l5i s PRO 56 Ca 0.17 1.42 -0.02 0.00 0.04 0.00 0.00 61.00 62.61 1l5i s PRO 56 Cb -0.13 -2.25 -0.02 0.00 0.04 0.00 0.00 34.50 32.14 1l5i s PRO 56 CO 0.05 -0.33 0.01 -1.58 0.04 0.00 0.00 177.00 175.18 1l5i s HIS 57 N -1.86 0.24 -0.01 0.56 2.46 -0.45 -1.05 115.29 115.18 1l5i s HIS 57 Ca 0.64 -0.51 0.05 0.00 0.47 0.00 0.00 55.06 55.71 1l5i s HIS 57 Cb -0.18 -0.18 -0.01 0.00 -0.13 0.00 0.00 32.58 32.07 1l5i s HIS 57 CO 0.23 -0.23 -0.15 -1.17 -2.47 0.00 0.00 174.74 170.95 1l5i s LEU 58 N -1.61 2.03 -0.02 8.88 1.98 -1.00 -1.92 118.68 127.03 1l5i s LEU 58 Ca -0.13 -0.27 0.06 0.00 -2.89 0.00 0.00 54.13 50.90 1l5i s LEU 58 Cb -0.08 -0.75 -0.02 0.00 0.66 0.00 0.00 46.19 46.00 1l5i s LEU 58 CO -0.02 0.18 -0.21 -1.00 -1.89 0.00 0.00 176.35 173.41 1l5i s HIS 59 N -0.36 1.86 -0.04 5.38 3.76 0.11 -2.29 115.29 123.71 1l5i s HIS 59 Ca 0.06 -0.35 -0.04 0.00 -0.15 0.00 0.00 55.06 54.58 1l5i s HIS 59 Cb -0.06 -1.19 0.01 0.00 1.11 0.00 0.00 32.58 32.45 1l5i s HIS 59 CO -0.01 -0.03 0.11 0.42 -0.85 0.00 0.00 174.74 174.39 1l5i s ILE 60 N -0.49 -0.00 -0.18 0.60 1.01 -0.84 -0.71 121.20 120.59 1l5i s ILE 60 Ca 0.08 0.01 -0.04 0.00 0.00 0.00 0.00 60.65 60.70 1l5i s ILE 60 Cb -0.08 -0.17 0.06 0.00 0.01 0.00 0.00 42.46 42.28 1l5i s ILE 60 CO -0.01 0.01 0.07 -0.22 0.00 0.00 0.00 174.94 174.79 1l5i s LEU 61 N 0.14 0.60 0.12 2.97 1.98 0.98 -1.58 118.68 123.89 1l5i s LEU 61 Ca -0.01 -0.68 0.09 0.00 -2.89 0.00 0.00 54.13 50.64 1l5i s LEU 61 Cb -0.02 -0.35 -0.04 0.00 0.66 0.00 0.00 46.19 46.44 1l5i s LEU 61 CO -0.00 -0.34 -0.16 -0.63 -1.89 0.00 0.00 176.35 173.32 1l5i s ILE 62 N 2.05 2.94 -0.11 6.68 1.01 -0.54 -0.80 121.20 132.43 1l5i s ILE 62 Ca 0.01 -1.48 -0.02 0.00 0.00 0.00 0.00 60.65 59.16 1l5i s ILE 62 Cb -0.16 -2.36 0.04 0.00 0.01 0.00 0.00 42.46 39.99 1l5i s ILE 62 CO -0.09 0.09 0.02 0.00 0.00 0.00 0.00 174.94 174.96 1l5i s GLN 63 N -2.19 0.51 0.36 2.79 -2.07 -0.86 -0.47 119.66 117.72 1l5i s GLN 63 Ca 0.19 -0.02 -0.05 0.00 -1.82 0.00 0.00 55.36 53.66 1l5i s GLN 63 Cb -0.11 -1.31 -0.05 0.00 -1.09 0.00 0.00 33.01 30.46 1l5i s GLN 63 CO 0.11 -0.43 0.64 -0.06 -1.32 0.00 0.00 175.29 174.23 1l5i s PHE 64 N 1.98 3.50 0.40 9.60 0.40 0.17 -1.38 117.98 132.64 1l5i s PHE 64 Ca 0.03 0.69 0.07 0.00 -0.60 0.00 0.00 56.93 57.12 1l5i s PHE 64 Cb -0.14 -2.16 0.81 0.00 0.51 0.00 0.00 43.02 42.04 1l5i s PHE 64 CO -0.06 0.02 2.01 1.49 0.70 0.00 0.00 175.22 179.38 1l5i h GLU 65 N 1.14 0.50 -5.77 0.44 4.81 -1.69 -3.44 114.58 110.58 1l5i h GLU 65 Ca -0.48 -0.05 -0.49 0.00 -0.13 0.00 0.00 59.36 58.21 1l5i h GLU 65 Cb 1.20 -0.10 -0.16 0.00 0.63 0.00 0.00 28.75 30.32 1l5i h GLU 65 CO 0.64 0.39 -0.76 0.20 -0.73 0.00 0.00 179.01 178.76 1l5i s GLY 66 N -3.76 1.45 -0.13 1.92 0.00 -1.26 -5.05 107.32 100.49 1l5i s GLY 66 Ca -0.08 -1.61 -0.29 0.00 0.00 0.00 0.00 44.72 42.74 1l5i s GLY 66 CO 0.74 -1.69 2.13 0.28 0.00 0.00 0.00 173.10 174.56 1l5i n LYS 67 N -0.12 2.24 -3.43 2.90 5.02 -1.26 -4.69 118.16 118.81 1l5i n LYS 67 Ca -0.10 0.71 -0.38 0.00 -2.02 0.00 0.00 58.31 56.52 1l5i n LYS 67 Cb 0.59 -3.11 -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 6.83 3.72 -0.45 2.13 5.04 0.09 -4.81 117.35 129.90 1l5i s TYR 68 Ca 0.97 1.04 -0.16 0.00 -2.44 0.00 0.00 57.07 56.48 1l5i s TYR 68 Cb -0.41 -2.36 0.05 0.00 0.35 0.00 0.00 41.96 39.59 1l5i s TYR 68 CO 0.39 0.58 0.37 1.21 -1.34 0.00 0.00 175.55 176.76 1l5i s ASN 69 N -0.88 6.14 -0.96 4.32 3.04 -1.26 -2.29 114.94 123.05 1l5i s ASN 69 Ca 0.25 -1.13 -0.01 0.00 0.04 0.00 0.00 52.86 52.01 1l5i s ASN 69 Cb -0.17 -2.18 0.29 0.00 -1.54 0.00 0.00 41.25 37.65 1l5i s ASN 69 CO 0.14 -0.58 1.26 0.00 -3.04 0.00 0.00 177.10 174.88 1l5i n THR 71 N 1.23 2.44 -3.65 0.00 5.66 -1.26 -2.89 114.28 115.81 1l5i n THR 71 Ca 0.27 -1.26 -0.02 0.00 -3.05 0.00 0.00 64.05 59.99 1l5i n THR 71 Cb 0.35 -0.64 -0.05 0.00 -1.55 0.00 0.00 70.33 68.45 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 -0.52 -1.06 -0.26 1.09 2.47 -1.26 -4.70 114.94 110.71 1l5i s ASN 72 Ca 0.38 1.52 -0.02 0.00 0.42 0.00 0.00 52.86 55.16 1l5i s ASN 72 Cb 0.32 2.18 0.11 0.00 -1.45 0.00 0.00 41.25 42.40 1l5i s ASN 72 CO 0.07 -0.22 2.29 0.00 -3.72 0.00 0.00 177.10 175.52 1l5i n GLN 73 N 5.40 1.78 -0.00 0.43 6.02 -1.26 -3.59 117.38 126.16 1l5i n GLN 73 Ca -0.12 -1.37 0.02 0.00 -0.01 0.00 0.00 57.00 55.52 1l5i n GLN 73 Cb 0.49 -1.63 -0.03 0.00 1.02 0.00 0.00 30.24 30.10 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 0.84 0.37 0.07 -1.09 5.12 -1.26 -4.46 116.66 116.24 1l5i n ARG 74 Ca 0.29 -0.03 -0.20 0.00 -1.93 0.00 0.00 57.85 55.98 1l5i n ARG 74 Cb 0.59 -1.06 -0.11 0.00 -1.16 0.00 0.00 32.46 30.72 1l5i n ARG 74 CO 0.00 0.00 0.00 0.35 -1.93 0.00 0.00 177.63 176.05 1l5i h PHE 75 N 0.00 0.96 -0.28 -1.55 3.57 -2.00 -3.13 116.94 114.51 1l5i h PHE 75 Ca 0.00 -0.56 0.00 0.00 3.53 0.00 0.00 57.97 60.94 1l5i h PHE 75 Cb 0.16 -0.09 0.00 0.00 2.79 0.00 0.00 35.95 38.80 1l5i h PHE 75 CO 0.00 1.40 0.00 1.19 -2.23 0.00 0.00 178.31 178.67 1l5i n PHE 76 N -3.80 0.52 -1.93 0.41 3.72 -1.26 -4.85 117.46 110.26 1l5i n PHE 76 Ca -0.12 -0.22 -0.42 0.00 -0.05 0.00 0.00 57.45 56.65 1l5i n PHE 76 Cb 0.93 -0.07 -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 -0.82 5.63 -0.11 4.37 1.01 -1.19 -4.45 116.67 121.12 1l5i s ASP 77 Ca 0.20 1.17 -0.03 0.00 0.71 0.00 0.00 52.55 54.61 1l5i s ASP 77 Cb 0.12 -2.52 -0.03 0.00 1.01 0.00 0.00 42.92 41.49 1l5i s ASP 77 CO 0.12 -1.94 0.00 -0.76 0.21 0.00 0.00 175.17 172.80 1l5i s LEU 78 N 7.83 3.56 0.31 1.23 1.43 -0.97 -4.97 118.68 127.09 1l5i s LEU 78 Ca 0.81 0.09 0.08 0.00 -1.03 0.00 0.00 54.13 54.09 1l5i s LEU 78 Cb -0.21 -1.83 -0.06 0.00 0.03 0.00 0.00 46.19 44.12 1l5i s LEU 78 CO 0.31 0.32 -0.09 0.68 0.23 0.00 0.00 176.35 177.80 1l5i s VAL 79 N -0.52 1.99 -0.27 -1.59 -7.23 -1.26 0.39 120.40 111.91 1l5i s VAL 79 Ca 0.09 -2.18 -0.24 0.00 -1.81 0.00 0.00 61.98 57.84 1l5i s VAL 79 Cb -0.12 -2.54 -0.00 0.00 0.56 0.00 0.00 36.38 34.28 1l5i s VAL 79 CO 0.02 -0.26 0.83 -0.55 -0.31 0.00 0.00 175.10 174.83 1l5i s SER 80 N -3.53 6.77 0.00 4.85 0.15 0.06 -4.90 113.70 117.10 1l5i s SER 80 Ca 0.31 0.89 0.23 0.00 0.70 0.00 0.00 55.95 58.08 1l5i s SER 80 Cb 0.03 -2.43 1.26 0.00 -1.71 0.00 0.00 66.02 63.17 1l5i s SER 80 CO 0.14 -0.58 1.76 -0.81 1.20 0.00 0.00 173.24 174.96 1l5i n PRO 81 N 6.13 0.49 -0.01 5.44 -0.04 -1.26 -2.55 135.00 143.21 1l5i n PRO 81 Ca 0.05 0.04 0.03 0.00 -0.04 0.00 0.00 63.50 63.59 1l5i n PRO 81 Cb 0.48 -1.50 -0.06 0.00 -0.04 0.00 0.00 33.50 32.38 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 -1.17 0.04 -4.23 0.52 -2.24 -1.26 -5.01 114.28 100.92 1l5i n THR 82 Ca 0.14 -0.19 -0.17 0.00 -2.27 0.00 0.00 64.05 61.56 1l5i n THR 82 Cb 0.14 0.24 -0.13 0.00 -2.10 0.00 0.00 70.33 68.48 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 -2.52 0.67 -0.80 -0.78 3.52 -1.06 -5.03 118.95 112.95 1l5i s ARG 83 Ca -0.03 -0.55 -0.07 0.00 -0.13 0.00 0.00 55.73 54.95 1l5i s ARG 83 Cb 0.05 -0.60 -0.14 0.00 -1.56 0.00 0.00 34.95 32.70 1l5i s ARG 83 CO 0.32 0.15 2.84 0.45 -0.81 0.00 0.00 175.30 178.25 1l5i n SER 84 N 2.20 6.12 -4.12 -2.12 2.88 -1.26 -3.82 113.62 113.51 1l5i n SER 84 Ca -0.17 -2.41 -0.23 0.00 -1.33 0.00 0.00 58.87 54.73 1l5i n SER 84 Cb 0.56 -1.30 -0.15 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 2.10 1.21 0.05 -1.46 0.00 -1.26 -5.04 121.76 117.37 1l5i s ALA 85 Ca 0.57 -0.64 0.03 0.00 0.00 0.00 0.00 51.96 51.93 1l5i s ALA 85 Cb 0.20 -0.30 -0.04 0.00 0.00 0.00 0.00 23.12 22.98 1l5i s ALA 85 CO -0.03 0.30 0.02 -1.01 0.00 0.00 0.00 175.76 175.04 1l5i s HIS 86 N -0.36 3.07 -0.04 0.00 3.76 -1.26 -0.76 115.29 119.70 1l5i s HIS 86 Ca 0.05 0.04 0.04 0.00 -0.15 0.00 0.00 55.06 55.05 1l5i s HIS 86 Cb -0.06 -1.61 -0.00 0.00 1.11 0.00 0.00 32.58 32.02 1l5i s HIS 86 CO -0.00 0.48 -0.17 -0.06 -0.85 0.00 0.00 174.74 174.14 1l5i s PHE 87 N -1.24 1.67 -0.42 1.40 0.08 0.16 -4.97 117.98 114.66 1l5i s PHE 87 Ca 0.24 -0.45 -0.05 0.00 0.12 0.00 0.00 56.93 56.79 1l5i s PHE 87 Cb -0.12 -1.12 0.11 0.00 -0.57 0.00 0.00 43.02 41.32 1l5i s PHE 87 CO 0.16 -0.14 0.24 -1.58 -0.10 0.00 0.00 175.22 173.80 1l5i s HIS 88 N -0.03 3.50 0.71 0.36 5.65 -1.26 -2.30 115.29 121.92 1l5i s HIS 88 Ca -0.02 -2.15 -0.11 0.00 0.25 0.00 0.00 55.06 53.03 1l5i s HIS 88 Cb -0.11 -3.22 0.02 0.00 -1.18 0.00 0.00 32.58 28.09 1l5i s HIS 88 CO 0.02 -0.96 1.06 -1.25 -0.65 0.00 0.00 174.74 172.96 1l5i s PRO 89 N 1.24 2.83 -0.34 2.88 0.04 -1.26 -4.90 135.00 135.49 1l5i s PRO 89 Ca 0.06 0.91 -0.19 0.00 0.04 0.00 0.00 61.00 61.82 1l5i s PRO 89 Cb -0.24 -1.98 -0.00 0.00 0.04 0.00 0.00 34.50 32.32 1l5i s PRO 89 CO -0.02 -1.17 0.57 -0.80 0.04 0.00 0.00 177.00 175.62 1l5i s ASN 90 N -3.81 6.38 -0.11 6.66 0.01 -0.58 -4.85 114.94 118.64 1l5i s ASN 90 Ca 0.58 0.12 -0.23 0.00 -0.71 0.00 0.00 52.86 52.63 1l5i s ASN 90 Cb -0.14 -2.30 -0.03 0.00 0.41 0.00 0.00 41.25 39.19 1l5i s ASN 90 CO 0.55 -0.51 0.70 -0.63 -1.51 0.00 0.00 177.10 175.70 1l5i s ILE 91 N 2.52 5.02 -0.03 0.60 1.01 -1.26 -2.41 121.20 126.65 1l5i s ILE 91 Ca 0.22 1.41 0.01 0.00 0.00 0.00 0.00 60.65 62.29 1l5i s ILE 91 Cb -0.15 -4.03 0.01 0.00 0.01 0.00 0.00 42.46 38.30 1l5i s ILE 91 CO 0.13 0.19 -0.04 -1.58 0.00 0.00 0.00 174.94 173.64 1l5i s GLN 92 N 1.25 0.65 -0.36 2.79 0.74 -0.77 -4.97 119.66 119.00 1l5i s GLN 92 Ca 0.35 -0.11 -0.20 0.00 0.05 0.00 0.00 55.36 55.45 1l5i s GLN 92 Cb -0.17 -0.67 0.00 0.00 1.10 0.00 0.00 33.01 33.27 1l5i s GLN 92 CO 0.15 -0.02 0.59 0.20 -0.55 0.00 0.00 175.29 175.66 1l5i s GLY 93 N 0.60 1.77 -0.38 2.59 0.00 -1.26 -0.46 107.32 110.18 1l5i s GLY 93 Ca -0.07 -0.93 -0.24 0.00 0.00 0.00 0.00 44.72 43.48 1l5i s GLY 93 CO -0.00 1.42 0.84 0.00 0.00 0.00 0.00 173.10 175.36 1l5i s ALA 94 N 2.60 3.39 0.00 3.20 0.00 -0.31 -4.96 121.76 125.68 1l5i s ALA 94 Ca 0.22 -0.64 0.00 0.00 0.00 0.00 0.00 51.96 51.55 1l5i s ALA 94 Cb -0.15 -3.46 0.00 0.00 0.00 0.00 0.00 23.12 19.52 1l5i s ALA 94 CO 0.14 -1.62 0.00 1.17 0.00 0.00 0.00 175.76 175.45 1l5i n LYS 95 N 6.64 2.62 -3.32 0.00 4.81 -1.26 -3.90 118.16 123.75 1l5i n LYS 95 Ca 0.05 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 -1.81 6.92 0.00 3.14 0.15 -1.26 -4.82 113.70 116.02 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 0.16 0.00 -1.20 1.20 0.00 0.00 173.24 173.40 1l5i n SER 97 N 1.13 0.00 -0.00 5.45 7.64 -1.26 -4.98 113.62 121.59 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 0.70 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 0.02 -0.10 6.43 7.64 -1.26 -3.64 113.62 122.71 1l5i n SER 98 Ca 0.00 0.09 0.26 0.00 1.01 0.00 0.00 58.87 60.23 1l5i n SER 98 Cb 0.00 -0.36 0.59 0.00 -1.01 0.00 0.00 64.21 63.43 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 0.01 0.00 -0.40 6.43 1.82 -1.99 1.82 116.42 124.12 1l5i h ASP 99 Ca 0.00 0.00 -0.09 0.00 -0.39 0.00 0.00 57.03 56.55 1l5i h ASP 99 Cb 0.37 0.00 -0.01 0.00 0.68 0.00 0.00 39.33 40.37 1l5i h ASP 99 CO 0.00 0.00 -0.10 -0.37 -1.61 0.00 0.00 179.24 177.16 1l5i h VAL 100 N 0.00 1.28 0.03 2.25 -1.51 -1.98 0.12 116.25 116.43 1l5i h VAL 100 Ca 0.38 -1.19 -0.00 0.00 -1.23 0.00 0.00 66.70 64.66 1l5i h VAL 100 Cb 2.16 1.23 0.00 0.00 -2.13 0.00 0.00 31.29 32.55 1l5i h VAL 100 CO -0.00 0.40 -0.02 0.50 -1.23 0.00 0.00 177.57 177.22 1l5i h LYS 101 N 0.58 -0.04 -0.16 5.19 3.11 0.25 0.48 116.57 125.97 1l5i h LYS 101 Ca 0.10 0.00 0.02 0.00 -2.81 0.00 0.00 60.65 57.97 1l5i h LYS 101 Cb 0.62 0.01 -0.02 0.00 -1.00 0.00 0.00 32.23 31.84 1l5i h LYS 101 CO 0.04 0.10 0.02 1.03 -2.81 0.00 0.00 179.45 177.83 1l5i h SER 102 N -0.18 -0.02 -0.41 4.20 0.87 -1.35 0.45 113.55 117.12 1l5i h SER 102 Ca -0.00 0.03 -0.03 0.00 -1.23 0.00 0.00 61.79 60.56 1l5i h SER 102 Cb 0.16 0.04 -0.02 0.00 -0.44 0.00 0.00 62.40 62.14 1l5i h SER 102 CO 0.01 0.02 0.17 0.22 -0.53 0.00 0.00 176.83 176.71 1l5i h TYR 103 N 0.08 0.67 -0.07 2.24 3.20 -0.61 -0.96 116.97 121.53 1l5i h TYR 103 Ca 0.07 -0.03 -0.08 0.00 3.14 0.00 0.00 58.73 61.83 1l5i h TYR 103 Cb 0.08 -0.21 -0.01 0.00 1.54 0.00 0.00 36.73 38.13 1l5i h TYR 103 CO -0.14 0.54 -0.33 0.82 -1.64 0.00 0.00 178.16 177.41 1l5i h ILE 104 N 0.67 1.26 0.00 1.81 2.04 0.80 -2.04 117.51 122.04 1l5i h ILE 104 Ca 0.16 -1.24 -0.15 0.00 1.00 0.00 0.00 64.86 64.63 1l5i h ILE 104 Cb 0.16 1.58 -0.02 0.00 -0.74 0.00 0.00 36.82 37.80 1l5i h ILE 104 CO -0.01 0.37 -0.70 -0.78 0.00 0.00 0.00 178.15 177.02 1l5i h ASP 105 N 0.11 0.00 0.00 1.72 3.58 0.27 -3.36 116.42 118.75 1l5i h ASP 105 Ca 0.01 0.00 -0.67 0.00 0.42 0.00 0.00 57.03 56.79 1l5i h ASP 105 Cb 0.64 0.00 0.01 0.00 1.72 0.00 0.00 39.33 41.71 1l5i h ASP 105 CO 0.05 0.70 2.69 0.29 -2.88 0.00 0.00 179.24 180.09 1l5i n LYS 106 N -3.60 2.12 -2.08 0.28 5.02 -0.49 -4.90 118.16 114.51 1l5i n LYS 106 Ca -0.01 -2.15 -0.27 0.00 -2.02 0.00 0.00 58.31 53.86 1l5i n LYS 106 Cb 0.71 -3.06 0.10 0.00 -0.02 0.00 0.00 35.03 32.77 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 4.16 4.34 0.00 4.39 1.47 -1.26 -4.98 116.67 124.79 1l5i s ASP 107 Ca 0.53 0.46 0.00 0.00 1.18 0.00 0.00 52.55 54.72 1l5i s ASP 107 Cb 0.14 -0.92 0.00 0.00 -0.34 0.00 0.00 42.92 41.80 1l5i s ASP 107 CO 0.02 -1.94 0.00 0.61 0.68 0.00 0.00 175.17 174.54 1l5i n GLY 108 N -3.21 0.54 2.85 2.12 0.00 -1.26 -4.95 105.19 101.28 1l5i n GLY 108 Ca 0.10 0.39 -0.21 0.00 0.00 0.00 0.00 46.02 46.30 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 -5.82 -4.57 1.61 8.00 -1.26 -4.88 116.55 109.63 1l5i n ASP 109 Ca 0.00 -0.23 -0.27 0.00 0.71 0.00 0.00 54.79 55.00 1l5i n ASP 109 Cb 0.00 -4.67 -0.11 0.00 -0.02 0.00 0.00 41.12 36.32 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 -3.12 2.14 -0.03 2.53 -7.23 -1.26 -4.59 120.40 108.85 1l5i s VAL 110 Ca 0.25 -2.13 -0.01 0.00 -1.81 0.00 0.00 61.98 58.27 1l5i s VAL 110 Cb -0.11 -2.77 -0.04 0.00 0.56 0.00 0.00 36.38 34.02 1l5i s VAL 110 CO 0.30 -0.13 0.07 -0.22 -0.31 0.00 0.00 175.10 174.81 1l5i s LEU 111 N -3.64 3.86 -0.07 1.32 0.20 0.26 -5.01 118.68 115.59 1l5i s LEU 111 Ca 0.33 0.17 0.02 0.00 0.69 0.00 0.00 54.13 55.34 1l5i s LEU 111 Cb 0.05 -2.16 0.01 0.00 -0.43 0.00 0.00 46.19 43.67 1l5i s LEU 111 CO 0.17 0.30 -0.14 -0.70 -0.29 0.00 0.00 176.35 175.70 1l5i s GLU 112 N -1.51 1.85 0.04 1.98 2.12 -1.26 -2.13 118.70 119.79 1l5i s GLU 112 Ca 0.20 -0.47 0.01 0.00 0.36 0.00 0.00 54.97 55.08 1l5i s GLU 112 Cb -0.12 -1.51 -0.03 0.00 0.26 0.00 0.00 34.13 32.74 1l5i s GLU 112 CO 0.11 0.04 -0.05 -0.46 -0.54 0.00 0.00 175.26 174.36 1l5i s TRP 113 N 0.63 0.49 0.25 5.30 -0.00 -0.36 -5.05 118.94 120.20 1l5i s TRP 113 Ca -0.15 -0.63 0.00 0.00 -0.00 0.00 0.00 56.10 55.32 1l5i s TRP 113 Cb -0.16 -0.32 0.00 0.00 -0.00 0.00 0.00 33.47 32.99 1l5i s TRP 113 CO 0.04 -0.17 0.00 0.41 -0.00 0.00 0.00 176.95 177.23 1l5i n GLY 114 N 1.20 -1.87 3.06 5.86 0.00 -1.26 -1.12 105.19 111.07 1l5i n GLY 114 Ca -0.21 -1.20 -0.29 0.00 0.00 0.00 0.00 46.02 44.31 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 -1.79 1.60 0.39 2.61 2.01 -0.92 -4.72 115.64 114.82 1l5i s THR 115 Ca 0.00 -0.69 -0.23 0.00 0.31 0.00 0.00 61.69 61.08 1l5i s THR 115 Cb 0.00 -1.46 -0.11 0.00 0.01 0.00 0.00 72.50 70.94 1l5i s THR 115 CO 0.00 0.46 0.95 0.12 -0.69 0.00 0.00 174.62 175.46 1l5i s PHE 116 N 1.08 3.46 -0.15 4.92 5.36 -1.26 -4.15 117.98 127.24 1l5i s PHE 116 Ca -0.04 1.68 -0.08 0.00 -0.96 0.00 0.00 56.93 57.53 1l5i s PHE 116 Cb -0.14 -2.89 0.05 0.00 -0.34 0.00 0.00 43.02 39.70 1l5i s PHE 116 CO -0.04 -0.00 0.36 1.14 -1.46 0.00 0.00 175.22 175.22 1l5i s GLN 117 N -2.73 0.34 -0.24 10.12 -2.07 -1.26 -5.06 119.66 118.76 1l5i s GLN 117 Ca 0.57 0.70 -0.17 0.00 -1.82 0.00 0.00 55.36 54.64 1l5i s GLN 117 Cb -0.13 -0.04 -0.03 0.00 -1.09 0.00 0.00 33.01 31.72 1l5i s GLN 117 CO 0.17 -0.15 0.47 0.42 -1.32 0.00 0.00 175.29 174.88 1l5i s ILE 118 N 1.28 5.12 -0.07 3.63 1.09 -1.26 -4.97 121.20 126.02 1l5i s ILE 118 Ca -0.09 0.81 -0.18 0.00 -1.10 0.00 0.00 60.65 60.10 1l5i s ILE 118 Cb -0.09 -3.79 -0.13 0.00 -1.06 0.00 0.00 42.46 37.39 1l5i s ILE 118 CO -0.11 0.15 0.70 -0.78 -0.10 0.00 0.00 174.94 174.80 1l5i h ASP 119 N 7.81 -0.18 -2.26 3.58 1.82 -2.01 -3.50 116.42 121.68 1l5i h ASP 119 Ca -0.32 -0.31 0.00 0.00 -0.39 0.00 0.00 57.03 56.01 1l5i h ASP 119 Cb 1.15 0.05 0.00 0.00 0.68 0.00 0.00 39.33 41.21 1l5i h ASP 119 CO 0.71 0.40 0.00 0.61 -1.61 0.00 0.00 179.24 179.34 1l5i n GLY 120 N 0.85 -0.35 0.40 -0.78 0.00 -1.26 -5.32 105.19 98.73 1l5i n GLY 120 Ca -0.07 -2.21 0.14 0.00 0.00 0.00 0.00 46.02 43.89 1l5i n GLY 120 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19