#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 1.63 3.24 0.23 0.00 -1.26 -5.18 105.19 103.86 1l5i n GLY 5 Ca 0.00 -0.26 -0.21 0.00 0.00 0.00 0.00 46.02 45.55 1l5i n GLY 5 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1l5i s ARG 6 N -1.77 1.02 -0.63 1.61 1.70 -1.26 -5.09 118.95 114.53 1l5i s ARG 6 Ca 0.00 -1.14 -0.27 0.00 -0.47 0.00 0.00 55.73 53.85 1l5i s ARG 6 Cb 0.00 -1.09 0.00 0.00 -0.57 0.00 0.00 34.95 33.29 1l5i s ARG 6 CO 0.00 0.24 1.56 0.12 -1.08 0.00 0.00 175.30 176.14 1l5i s PHE 7 N -1.51 2.02 -0.10 5.89 5.36 -1.26 -4.95 117.98 123.43 1l5i s PHE 7 Ca 0.05 0.44 -0.01 0.00 -0.96 0.00 0.00 56.93 56.45 1l5i s PHE 7 Cb -0.08 -4.34 0.03 0.00 -0.34 0.00 0.00 43.02 38.29 1l5i s PHE 7 CO 0.04 -2.18 -0.02 -1.54 -1.46 0.00 0.00 175.22 170.06 1l5i s SER 8 N 5.74 1.90 -0.08 6.13 1.04 -1.26 -4.21 113.70 122.96 1l5i s SER 8 Ca 0.54 -0.22 0.02 0.00 0.48 0.00 0.00 55.95 56.77 1l5i s SER 8 Cb -0.11 -0.58 -0.02 0.00 0.10 0.00 0.00 66.02 65.41 1l5i s SER 8 CO 0.20 -0.18 -0.14 -0.63 0.98 0.00 0.00 173.24 173.47 1l5i s ILE 9 N 1.88 3.06 -0.19 -1.02 1.01 -1.13 -4.91 121.20 119.91 1l5i s ILE 9 Ca 0.04 -0.70 -0.03 0.00 0.00 0.00 0.00 60.65 59.97 1l5i s ILE 9 Cb -0.13 -2.23 0.06 0.00 0.01 0.00 0.00 42.46 40.17 1l5i s ILE 9 CO -0.06 0.57 0.04 -0.54 0.00 0.00 0.00 174.94 174.94 1l5i s LYS 10 N -0.32 0.63 0.15 2.79 1.02 -1.26 0.11 119.74 122.85 1l5i s LYS 10 Ca 0.03 -0.38 -0.24 0.00 0.02 0.00 0.00 55.97 55.40 1l5i s LYS 10 Cb -0.13 -2.03 0.07 0.00 -0.52 0.00 0.00 37.83 35.22 1l5i s LYS 10 CO 0.02 -0.62 0.73 0.00 -0.92 0.00 0.00 175.35 174.56 1l5i s ALA 11 N 1.88 -1.58 -0.10 5.17 0.00 -0.80 -4.95 121.76 121.39 1l5i s ALA 11 Ca -0.00 0.40 0.14 0.00 0.00 0.00 0.00 51.96 52.50 1l5i s ALA 11 Cb -0.17 0.75 -0.07 0.00 0.00 0.00 0.00 23.12 23.63 1l5i s ALA 11 CO -0.08 -0.84 1.14 1.57 0.00 0.00 0.00 175.76 177.55 1l5i h LYS 12 N 2.00 0.00 -6.55 0.00 2.10 -1.83 0.35 116.57 112.64 1l5i h LYS 12 Ca -0.27 0.00 -0.69 0.00 -2.00 0.00 0.00 60.65 57.68 1l5i h LYS 12 Cb 1.27 0.00 -0.26 0.00 -0.90 0.00 0.00 32.23 32.34 1l5i h LYS 12 CO 0.32 0.49 -0.84 -0.80 -2.00 0.00 0.00 179.45 176.62 1l5i s ASN 13 N -6.22 3.46 0.01 7.07 0.01 -1.25 -0.07 114.94 117.96 1l5i s ASN 13 Ca 0.00 -0.41 0.03 0.00 -0.71 0.00 0.00 52.86 51.77 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 0.79 0.30 -0.09 -0.31 -1.51 0.00 0.00 177.10 176.28 1l5i s TYR 14 N -0.73 0.83 -0.14 2.20 2.02 -0.21 -0.74 117.35 120.57 1l5i s TYR 14 Ca 0.12 -0.26 0.02 0.00 -0.37 0.00 0.00 57.07 56.58 1l5i s TYR 14 Cb -0.10 -0.51 0.01 0.00 -0.40 0.00 0.00 41.96 40.95 1l5i s TYR 14 CO 0.01 -0.01 -0.22 -0.06 -1.57 0.00 0.00 175.55 173.70 1l5i s PHE 15 N -0.58 2.68 -0.15 2.71 0.08 0.26 -1.87 117.98 121.11 1l5i s PHE 15 Ca 0.00 -1.33 -0.05 0.00 0.12 0.00 0.00 56.93 55.67 1l5i s PHE 15 Cb -0.06 -1.82 -0.04 0.00 -0.57 0.00 0.00 43.02 40.54 1l5i s PHE 15 CO 0.00 -0.61 0.04 -0.51 -0.10 0.00 0.00 175.22 174.05 1l5i s LEU 16 N 0.82 3.74 -0.19 -0.37 2.01 -0.62 -1.74 118.68 122.32 1l5i s LEU 16 Ca -0.07 0.11 0.01 0.00 0.01 0.00 0.00 54.13 54.19 1l5i s LEU 16 Cb -0.15 -1.91 0.03 0.00 0.01 0.00 0.00 46.19 44.16 1l5i s LEU 16 CO -0.02 0.25 -0.17 -0.89 1.01 0.00 0.00 176.35 176.53 1l5i s THR 17 N -0.10 1.97 -0.42 5.49 2.01 -0.99 -2.32 115.64 121.28 1l5i s THR 17 Ca 0.06 -1.01 -0.06 0.00 0.31 0.00 0.00 61.69 60.99 1l5i s THR 17 Cb -0.12 -1.85 0.10 0.00 0.01 0.00 0.00 72.50 70.63 1l5i s THR 17 CO 0.01 0.40 0.24 -0.31 -0.69 0.00 0.00 174.62 174.28 1l5i s TYR 18 N 1.30 3.45 0.16 4.92 1.51 -0.91 -1.20 117.35 126.58 1l5i s TYR 18 Ca 0.02 -1.98 -0.30 0.00 -1.01 0.00 0.00 57.07 53.80 1l5i s TYR 18 Cb -0.14 -3.13 -0.07 0.00 -0.11 0.00 0.00 41.96 38.50 1l5i s TYR 18 CO -0.11 -0.93 1.12 -1.25 -1.11 0.00 0.00 175.55 173.27 1l5i s PRO 19 N 1.29 4.56 -1.45 -1.71 0.04 -1.26 -2.35 135.00 134.12 1l5i s PRO 19 Ca 0.05 1.74 -0.08 0.00 0.04 0.00 0.00 61.00 62.75 1l5i s PRO 19 Cb -0.24 -3.28 0.01 0.00 0.04 0.00 0.00 34.50 31.03 1l5i s PRO 19 CO -0.01 0.01 0.15 1.17 0.04 0.00 0.00 177.00 178.37 1l5i n LYS 20 N 2.57 -0.77 -4.06 4.56 4.81 -0.97 -4.89 118.16 119.40 1l5i n LYS 20 Ca 0.04 0.08 -0.35 0.00 -0.87 0.00 0.00 58.31 57.21 1l5i n LYS 20 Cb 0.46 -3.26 -0.13 0.00 0.02 0.00 0.00 35.03 32.11 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 4.39 1.97 -4.74 0.00 2.03 -1.26 -4.51 116.55 114.44 1l5i n ASP 22 Ca -0.17 -2.15 -0.41 0.00 0.52 0.00 0.00 54.79 52.57 1l5i n ASP 22 Cb 0.52 -0.35 -0.03 0.00 -0.72 0.00 0.00 41.12 40.53 1l5i n ASP 22 CO 0.00 0.00 0.00 -0.22 -1.92 0.00 0.00 177.20 175.06 1l5i s LEU 23 N -0.98 4.43 0.58 -2.67 2.96 -1.26 -5.02 118.68 116.72 1l5i s LEU 23 Ca 0.18 2.32 -0.05 0.00 -0.22 0.00 0.00 54.13 56.36 1l5i s LEU 23 Cb 0.12 -3.61 0.01 0.00 0.50 0.00 0.00 46.19 43.21 1l5i s LEU 23 CO 0.09 -0.46 0.89 0.42 -1.32 0.00 0.00 176.35 175.96 1l5i s THR 24 N 0.07 3.61 0.27 3.68 -4.23 -1.26 -4.93 115.64 112.85 1l5i s THR 24 Ca 0.55 -0.06 0.13 0.00 -1.18 0.00 0.00 61.69 61.13 1l5i s THR 24 Cb -0.35 -3.43 0.04 0.00 1.34 0.00 0.00 72.50 70.11 1l5i s THR 24 CO 0.37 -0.43 1.69 0.07 -0.54 0.00 0.00 174.62 175.79 1l5i h LYS 25 N -0.14 0.00 -0.10 3.99 2.10 -1.97 -1.15 116.57 119.30 1l5i h LYS 25 Ca -0.45 0.00 -0.01 0.00 -2.00 0.00 0.00 60.65 58.18 1l5i h LYS 25 Cb 1.26 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 32.59 1l5i h LYS 25 CO 0.60 0.50 0.01 0.93 -2.00 0.00 0.00 179.45 179.50 1l5i h GLU 26 N 0.00 0.17 -0.36 0.07 5.08 -1.97 1.41 114.58 118.98 1l5i h GLU 26 Ca -0.01 -0.05 -0.07 0.00 -1.00 0.00 0.00 59.36 58.24 1l5i h GLU 26 Cb 0.94 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 30.16 1l5i h GLU 26 CO 0.07 0.38 -0.04 -0.91 -1.00 0.00 0.00 179.01 177.51 1l5i h ASN 27 N -0.07 0.65 0.13 1.42 -0.26 -1.94 0.18 115.58 115.70 1l5i h ASN 27 Ca 0.03 -0.33 -0.10 0.00 -0.56 0.00 0.00 56.30 55.34 1l5i h ASN 27 Cb 0.30 -0.18 -0.01 0.00 -1.06 0.00 0.00 38.32 37.37 1l5i h ASN 27 CO 0.00 0.83 -0.33 0.00 -1.06 0.00 0.00 177.43 176.88 1l5i h ALA 28 N 0.84 1.17 -0.23 -0.83 0.00 -1.12 0.41 119.26 119.50 1l5i h ALA 28 Ca 0.10 -0.36 -0.08 0.00 0.00 0.00 0.00 54.91 54.56 1l5i h ALA 28 Cb 0.52 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.21 1l5i h ALA 28 CO 0.03 0.54 -0.17 1.25 0.00 0.00 0.00 179.25 180.90 1l5i h LEU 29 N 0.26 0.55 -0.29 0.00 7.12 0.23 0.60 115.31 123.78 1l5i h LEU 29 Ca 0.03 -0.44 -0.10 0.00 0.13 0.00 0.00 57.88 57.50 1l5i h LEU 29 Cb 0.71 -0.15 -0.01 0.00 -0.53 0.00 0.00 40.66 40.68 1l5i h LEU 29 CO 0.05 0.88 -0.20 -1.28 -0.13 0.00 0.00 178.44 177.76 1l5i h SER 30 N 0.23 0.67 -0.12 1.25 0.87 -0.40 0.59 113.55 116.64 1l5i h SER 30 Ca 0.04 -0.44 -0.02 0.00 -1.23 0.00 0.00 61.79 60.15 1l5i h SER 30 Cb 0.70 -0.19 -0.00 0.00 -0.44 0.00 0.00 62.40 62.47 1l5i h SER 30 CO 0.05 0.97 0.00 1.56 -0.53 0.00 0.00 176.83 178.88 1l5i h GLN 31 N 0.38 0.21 -0.31 2.24 4.20 -0.17 0.46 115.11 122.12 1l5i h GLN 31 Ca 0.06 -0.07 -0.04 0.00 0.06 0.00 0.00 58.65 58.66 1l5i h GLN 31 Cb 0.75 -0.02 -0.01 0.00 0.30 0.00 0.00 27.48 28.49 1l5i h GLN 31 CO 0.05 0.45 0.04 0.82 -0.67 0.00 0.00 178.83 179.52 1l5i h ILE 32 N -0.06 1.24 -0.28 2.54 1.08 0.21 0.40 117.51 122.65 1l5i h ILE 32 Ca 0.03 -0.85 -0.04 0.00 -0.39 0.00 0.00 64.86 63.61 1l5i h ILE 32 Cb 0.35 1.19 -0.02 0.00 -3.07 0.00 0.00 36.82 35.28 1l5i h ILE 32 CO 0.01 0.28 -0.02 0.74 -0.69 0.00 0.00 178.15 178.46 1l5i h THR 33 N 0.34 1.18 -0.00 -0.27 2.02 0.26 -0.33 112.91 116.11 1l5i h THR 33 Ca 0.09 -0.72 0.00 0.00 0.77 0.00 0.00 66.41 66.56 1l5i h THR 33 Cb 0.37 1.00 0.00 0.00 -1.74 0.00 0.00 68.15 67.78 1l5i h THR 33 CO 0.01 0.24 -0.25 0.59 0.37 0.00 0.00 175.52 176.48 1l5i n ASN 34 N -4.30 0.27 -4.65 4.18 3.02 0.16 -4.79 115.26 109.14 1l5i n ASN 34 Ca 0.01 0.09 -0.43 0.00 -0.03 0.00 0.00 54.58 54.22 1l5i n ASN 34 Cb 0.23 -0.11 -0.02 0.00 -0.61 0.00 0.00 39.78 39.27 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 -2.98 4.11 0.66 3.41 1.02 0.14 -5.00 118.68 120.03 1l5i s LEU 35 Ca 0.13 1.64 -0.11 0.00 0.02 0.00 0.00 54.13 55.81 1l5i s LEU 35 Cb 0.18 -3.54 -0.01 0.00 0.02 0.00 0.00 46.19 42.85 1l5i s LEU 35 CO 0.61 -0.87 1.05 -1.58 0.02 0.00 0.00 176.35 175.58 1l5i s GLN 36 N 3.76 3.20 0.08 1.70 0.74 -1.26 -4.96 119.66 122.91 1l5i s GLN 36 Ca 0.58 0.54 -0.10 0.00 0.05 0.00 0.00 55.36 56.43 1l5i s GLN 36 Cb -0.22 -2.07 0.00 0.00 1.10 0.00 0.00 33.01 31.82 1l5i s GLN 36 CO 0.18 -0.79 0.22 -0.08 -0.55 0.00 0.00 175.29 174.27 1l5i s THR 37 N -3.24 0.12 -1.48 -0.34 -1.32 -1.26 -5.02 115.64 103.10 1l5i s THR 37 Ca 0.56 -1.03 0.23 0.00 -1.21 0.00 0.00 61.69 60.25 1l5i s THR 37 Cb -0.11 -1.19 0.42 0.00 -1.51 0.00 0.00 72.50 70.11 1l5i s THR 37 CO 0.52 -0.57 1.75 -0.81 -2.21 0.00 0.00 174.62 173.31 1l5i n PRO 38 N 0.16 0.36 0.00 7.08 -0.04 -1.26 -4.59 135.00 136.71 1l5i n PRO 38 Ca -0.16 0.06 0.00 0.00 -0.04 0.00 0.00 63.50 63.36 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 -1.26 0.00 -3.64 0.52 5.66 -1.26 -5.11 114.28 109.19 1l5i n THR 39 Ca 0.11 0.00 -0.09 0.00 -3.05 0.00 0.00 64.05 61.02 1l5i n THR 39 Cb 0.17 0.00 -0.07 0.00 -1.55 0.00 0.00 70.33 68.88 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 0.39 -0.44 -0.24 1.09 2.47 -1.26 -4.98 114.94 111.97 1l5i s ASN 40 Ca 0.00 0.83 -0.19 0.00 0.42 0.00 0.00 52.86 53.92 1l5i s ASN 40 Cb 0.00 0.84 -0.02 0.00 -1.45 0.00 0.00 41.25 40.62 1l5i s ASN 40 CO 0.00 -0.15 0.57 -0.54 -3.72 0.00 0.00 177.10 173.26 1l5i s LYS 41 N 0.18 4.12 0.00 0.43 1.02 -1.26 -1.93 119.74 122.31 1l5i s LYS 41 Ca 0.03 0.46 0.00 0.00 0.02 0.00 0.00 55.97 56.48 1l5i s LYS 41 Cb -0.05 -3.62 0.00 0.00 -0.52 0.00 0.00 37.83 33.64 1l5i s LYS 41 CO -0.06 -0.32 0.00 -0.11 -0.92 0.00 0.00 175.35 173.94 1l5i n LEU 42 N 5.39 0.10 -4.87 3.17 7.94 -0.83 -4.90 117.00 123.00 1l5i n LEU 42 Ca -0.03 0.00 -0.21 0.00 -1.11 0.00 0.00 56.01 54.66 1l5i n LEU 42 Cb 0.50 0.00 -0.03 0.00 0.53 0.00 0.00 43.42 44.41 1l5i n LEU 42 CO 0.42 0.00 -0.09 0.12 -1.11 0.00 0.00 177.39 176.73 1l5i s PHE 43 N 0.00 3.02 -0.04 1.96 5.36 -1.17 -3.57 117.98 123.54 1l5i s PHE 43 Ca 0.00 -0.22 -0.01 0.00 -0.96 0.00 0.00 56.93 55.74 1l5i s PHE 43 Cb 0.00 -1.69 0.03 0.00 -0.34 0.00 0.00 43.02 41.02 1l5i s PHE 43 CO 0.00 0.27 0.07 0.42 -1.46 0.00 0.00 175.22 174.53 1l5i s ILE 44 N -2.22 -0.07 -0.27 3.12 1.01 0.23 -2.63 121.20 120.38 1l5i s ILE 44 Ca 0.39 0.23 0.03 0.00 0.00 0.00 0.00 60.65 61.30 1l5i s ILE 44 Cb -0.07 -0.15 0.07 0.00 0.01 0.00 0.00 42.46 42.32 1l5i s ILE 44 CO 0.27 0.10 -0.07 -0.75 0.00 0.00 0.00 174.94 174.48 1l5i s LYS 45 N 1.26 1.99 -0.26 2.79 2.47 0.17 -1.45 119.74 126.71 1l5i s LYS 45 Ca -0.07 -1.34 -0.03 0.00 -1.56 0.00 0.00 55.97 52.96 1l5i s LYS 45 Cb -0.12 -2.86 0.02 0.00 -1.46 0.00 0.00 37.83 33.41 1l5i s LYS 45 CO -0.04 -0.63 -0.02 0.42 0.16 0.00 0.00 175.35 175.23 1l5i s ILE 46 N 1.14 3.19 -0.01 5.43 1.01 -1.00 0.41 121.20 131.37 1l5i s ILE 46 Ca -0.05 -0.90 0.03 0.00 0.00 0.00 0.00 60.65 59.72 1l5i s ILE 46 Cb -0.20 -2.62 -0.00 0.00 0.01 0.00 0.00 42.46 39.65 1l5i s ILE 46 CO -0.06 0.18 -0.10 0.00 0.00 0.00 0.00 174.94 174.97 1l5i s ARG 48 N -0.09 3.63 -0.01 0.00 3.52 -1.26 -0.66 118.95 124.07 1l5i s ARG 48 Ca 0.02 0.02 0.00 0.00 -0.13 0.00 0.00 55.73 55.63 1l5i s ARG 48 Cb -0.05 -3.11 0.02 0.00 -1.56 0.00 0.00 34.95 30.24 1l5i s ARG 48 CO -0.00 0.67 0.01 -2.00 -0.81 0.00 0.00 175.30 173.17 1l5i s GLU 49 N -1.54 0.04 -0.14 5.12 2.12 -0.54 -4.90 118.70 118.87 1l5i s GLU 49 Ca 0.25 0.09 -0.10 0.00 0.36 0.00 0.00 54.97 55.57 1l5i s GLU 49 Cb -0.14 -0.20 -0.05 0.00 0.26 0.00 0.00 34.13 34.01 1l5i s GLU 49 CO 0.14 -0.09 0.20 -0.51 -0.54 0.00 0.00 175.26 174.45 1l5i s LEU 50 N 0.65 4.32 0.45 2.70 2.01 -1.26 -0.16 118.68 127.39 1l5i s LEU 50 Ca -0.06 0.47 -0.11 0.00 0.01 0.00 0.00 54.13 54.44 1l5i s LEU 50 Cb -0.08 -2.20 -0.06 0.00 0.01 0.00 0.00 46.19 43.86 1l5i s LEU 50 CO -0.02 0.27 0.84 -1.00 1.01 0.00 0.00 176.35 177.46 1l5i s HIS 51 N -0.34 3.49 -1.31 0.29 3.76 -0.13 -4.88 115.29 116.17 1l5i s HIS 51 Ca 0.14 1.14 0.22 0.00 -0.15 0.00 0.00 55.06 56.42 1l5i s HIS 51 Cb -0.12 -2.53 1.08 0.00 1.11 0.00 0.00 32.58 32.12 1l5i s HIS 51 CO 0.03 -0.23 1.73 0.39 -0.85 0.00 0.00 174.74 175.81 1l5i n GLU 52 N -1.56 0.23 -0.01 1.40 -0.58 -1.26 -2.08 120.64 116.78 1l5i n GLU 52 Ca 0.03 0.09 0.14 0.00 -0.42 0.00 0.00 57.16 57.00 1l5i n GLU 52 Cb 0.54 -1.50 0.65 0.00 -0.57 0.00 0.00 31.44 30.56 1l5i n GLU 52 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 1l5i n ASN 53 N -1.35 0.94 0.00 1.62 3.02 -1.26 -4.87 115.26 113.36 1l5i n ASN 53 Ca 0.09 -1.35 0.00 0.00 -0.03 0.00 0.00 54.58 53.29 1l5i n ASN 53 Cb 0.20 -0.01 0.00 0.00 -0.61 0.00 0.00 39.78 39.36 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 1.09 0.77 3.77 7.41 0.00 -0.88 -5.03 105.19 112.32 1l5i n GLY 54 Ca 0.20 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.85 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 -0.24 4.05 -0.09 1.61 -1.05 -1.25 -4.93 118.70 116.80 1l5i s GLU 55 Ca 0.00 0.11 -0.30 0.00 -0.15 0.00 0.00 54.97 54.64 1l5i s GLU 55 Cb 0.00 -3.35 -0.03 0.00 -0.44 0.00 0.00 34.13 30.32 1l5i s GLU 55 CO 0.00 0.42 1.24 -1.25 0.95 0.00 0.00 175.26 176.62 1l5i s PRO 56 N -0.09 4.30 0.15 -4.83 0.04 -1.26 -0.95 135.00 132.37 1l5i s PRO 56 Ca 0.17 1.69 0.07 0.00 0.04 0.00 0.00 61.00 62.98 1l5i s PRO 56 Cb -0.13 -3.63 -0.04 0.00 0.04 0.00 0.00 34.50 30.73 1l5i s PRO 56 CO 0.06 -0.55 -0.04 -1.58 0.04 0.00 0.00 177.00 174.92 1l5i s HIS 57 N 2.69 2.78 -0.03 0.56 2.46 0.78 -0.54 115.29 123.99 1l5i s HIS 57 Ca 0.56 -0.15 0.04 0.00 0.47 0.00 0.00 55.06 55.98 1l5i s HIS 57 Cb -0.24 -1.38 -0.00 0.00 -0.13 0.00 0.00 32.58 30.83 1l5i s HIS 57 CO 0.20 0.49 -0.14 -1.17 -2.47 0.00 0.00 174.74 171.65 1l5i s LEU 58 N -2.71 1.92 0.01 8.88 1.98 -0.99 -1.46 118.68 126.30 1l5i s LEU 58 Ca 0.25 -0.27 0.08 0.00 -2.89 0.00 0.00 54.13 51.31 1l5i s LEU 58 Cb -0.10 -0.76 -0.02 0.00 0.66 0.00 0.00 46.19 45.97 1l5i s LEU 58 CO 0.17 0.14 -0.26 -1.00 -1.89 0.00 0.00 176.35 173.51 1l5i s HIS 59 N -0.07 2.33 -0.02 5.38 3.76 0.16 -2.13 115.29 124.71 1l5i s HIS 59 Ca 0.00 -0.42 -0.01 0.00 -0.15 0.00 0.00 55.06 54.48 1l5i s HIS 59 Cb -0.08 -1.46 0.01 0.00 1.11 0.00 0.00 32.58 32.16 1l5i s HIS 59 CO 0.01 0.03 0.04 0.42 -0.85 0.00 0.00 174.74 174.39 1l5i s ILE 60 N -0.70 -0.01 -0.18 0.60 1.01 -0.98 -1.62 121.20 119.33 1l5i s ILE 60 Ca 0.11 0.02 -0.04 0.00 0.00 0.00 0.00 60.65 60.73 1l5i s ILE 60 Cb -0.10 -0.07 0.06 0.00 0.01 0.00 0.00 42.46 42.36 1l5i s ILE 60 CO 0.00 0.01 0.07 -0.22 0.00 0.00 0.00 174.94 174.80 1l5i s LEU 61 N 0.12 0.59 0.13 2.97 1.98 0.16 -1.59 118.68 123.05 1l5i s LEU 61 Ca -0.01 -0.67 0.09 0.00 -2.89 0.00 0.00 54.13 50.65 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 -0.34 -0.16 -0.63 -1.89 0.00 0.00 176.35 173.33 1l5i s ILE 62 N 2.06 2.91 -0.11 6.68 1.01 -0.78 0.42 121.20 133.39 1l5i s ILE 62 Ca 0.01 -1.55 -0.02 0.00 0.00 0.00 0.00 60.65 59.09 1l5i s ILE 62 Cb -0.16 -2.36 0.04 0.00 0.01 0.00 0.00 42.46 39.98 1l5i s ILE 62 CO -0.09 0.05 0.02 0.00 0.00 0.00 0.00 174.94 174.92 1l5i s GLN 63 N -2.31 0.56 0.34 2.79 1.03 -1.08 -1.04 119.66 119.94 1l5i s GLN 63 Ca 0.20 -0.03 -0.04 0.00 0.04 0.00 0.00 55.36 55.52 1l5i s GLN 63 Cb -0.10 -1.32 -0.05 0.00 0.03 0.00 0.00 33.01 31.58 1l5i s GLN 63 CO 0.11 -0.42 0.61 -0.06 -2.54 0.00 0.00 175.29 172.99 1l5i s PHE 64 N 1.96 3.49 0.39 9.60 0.40 0.90 -1.97 117.98 132.77 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 0.81 0.00 0.51 0.00 0.00 43.02 42.08 1l5i s PHE 64 CO -0.06 0.07 2.00 1.49 0.70 0.00 0.00 175.22 179.42 1l5i h GLU 65 N 1.26 0.46 -6.10 0.44 4.81 -1.70 -3.43 114.58 110.33 1l5i h GLU 65 Ca -0.48 -0.05 -0.56 0.00 -0.13 0.00 0.00 59.36 58.14 1l5i h GLU 65 Cb 1.20 -0.09 -0.18 0.00 0.63 0.00 0.00 28.75 30.31 1l5i h GLU 65 CO 0.64 0.39 -0.79 0.20 -0.73 0.00 0.00 179.01 178.72 1l5i s GLY 66 N -3.80 1.50 -0.13 1.92 0.00 -1.26 -5.04 107.32 100.51 1l5i s GLY 66 Ca -0.08 -1.56 -0.30 0.00 0.00 0.00 0.00 44.72 42.79 1l5i s GLY 66 CO 0.74 -1.60 2.11 0.28 0.00 0.00 0.00 173.10 174.62 1l5i n LYS 67 N 0.21 2.23 -3.48 2.90 5.02 -1.26 -4.66 118.16 119.12 1l5i n LYS 67 Ca -0.12 0.72 -0.37 0.00 -2.02 0.00 0.00 58.31 56.52 1l5i n LYS 67 Cb 0.57 -3.06 -0.06 0.00 -0.02 0.00 0.00 35.03 32.46 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 6.59 3.67 -0.44 2.13 5.04 0.11 -4.80 117.35 129.65 1l5i s TYR 68 Ca 0.97 0.97 -0.15 0.00 -2.44 0.00 0.00 57.07 56.42 1l5i s TYR 68 Cb -0.43 -2.28 0.05 0.00 0.35 0.00 0.00 41.96 39.64 1l5i s TYR 68 CO 0.40 0.57 0.34 1.21 -1.34 0.00 0.00 175.55 176.73 1l5i s ASN 69 N -1.38 6.10 -1.00 4.32 3.04 -1.26 -1.91 114.94 122.86 1l5i s ASN 69 Ca 0.29 -1.14 -0.02 0.00 0.04 0.00 0.00 52.86 52.03 1l5i s ASN 69 Cb -0.16 -2.16 0.30 0.00 -1.54 0.00 0.00 41.25 37.68 1l5i s ASN 69 CO 0.16 -0.55 1.32 0.00 -3.04 0.00 0.00 177.10 175.00 1l5i n THR 71 N 1.29 3.17 -3.59 0.00 5.66 -1.26 -2.82 114.28 116.74 1l5i n THR 71 Ca 0.27 -2.03 -0.01 0.00 -3.05 0.00 0.00 64.05 59.23 1l5i n THR 71 Cb 0.35 -0.67 -0.04 0.00 -1.55 0.00 0.00 70.33 68.42 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 -1.25 -0.99 -0.27 1.09 2.47 -1.26 -4.73 114.94 109.99 1l5i s ASN 72 Ca 0.55 1.38 -0.02 0.00 0.42 0.00 0.00 52.86 55.20 1l5i s ASN 72 Cb 0.45 2.08 0.13 0.00 -1.45 0.00 0.00 41.25 42.46 1l5i s ASN 72 CO 0.08 -0.19 2.24 0.00 -3.72 0.00 0.00 177.10 175.50 1l5i n GLN 73 N 5.24 1.79 -0.00 0.43 6.02 -1.26 -3.62 117.38 125.96 1l5i n GLN 73 Ca -0.12 -1.41 0.02 0.00 -0.01 0.00 0.00 57.00 55.47 1l5i n GLN 73 Cb 0.51 -1.63 -0.03 0.00 1.02 0.00 0.00 30.24 30.11 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 0.74 0.55 0.06 -1.09 1.74 -1.26 -4.45 116.66 112.96 1l5i n ARG 74 Ca 0.29 -0.03 -0.19 0.00 -0.77 0.00 0.00 57.85 57.15 1l5i n ARG 74 Cb 0.58 -1.10 -0.10 0.00 -1.02 0.00 0.00 32.46 30.83 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 0.91 -0.28 -1.55 3.57 -2.01 -3.12 116.94 114.47 1l5i h PHE 75 Ca -0.01 -0.52 0.00 0.00 3.53 0.00 0.00 57.97 60.96 1l5i h PHE 75 Cb 0.33 -0.09 0.00 0.00 2.79 0.00 0.00 35.95 38.97 1l5i h PHE 75 CO 0.00 1.36 0.00 1.19 -2.23 0.00 0.00 178.31 178.63 1l5i n PHE 76 N -3.80 0.51 -1.92 0.41 3.72 -1.26 -4.85 117.46 110.27 1l5i n PHE 76 Ca -0.11 -0.22 -0.41 0.00 -0.05 0.00 0.00 57.45 56.66 1l5i n PHE 76 Cb 0.90 -0.07 -0.03 0.00 -0.94 0.00 0.00 39.48 39.34 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 5.58 -0.10 4.37 1.01 -1.18 -4.48 116.67 121.05 1l5i s ASP 77 Ca 0.20 1.16 -0.01 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 41.50 1l5i s ASP 77 CO 0.12 -1.98 -0.04 -0.76 0.21 0.00 0.00 175.17 172.71 1l5i s LEU 78 N 7.99 3.28 0.29 1.23 1.43 -0.96 -4.99 118.68 126.95 1l5i s LEU 78 Ca 0.81 -0.02 0.08 0.00 -1.03 0.00 0.00 54.13 53.98 1l5i s LEU 78 Cb -0.21 -1.74 -0.06 0.00 0.03 0.00 0.00 46.19 44.21 1l5i s LEU 78 CO 0.30 0.31 -0.10 0.68 0.23 0.00 0.00 176.35 177.77 1l5i s VAL 79 N -0.47 1.95 -0.32 -1.59 -7.23 -1.26 0.45 120.40 111.93 1l5i s VAL 79 Ca 0.07 -2.20 -0.23 0.00 -1.81 0.00 0.00 61.98 57.81 1l5i s VAL 79 Cb -0.12 -2.43 0.00 0.00 0.56 0.00 0.00 36.38 34.39 1l5i s VAL 79 CO 0.02 -0.33 0.79 -0.55 -0.31 0.00 0.00 175.10 174.73 1l5i s SER 80 N -3.48 6.65 0.00 4.85 0.15 -0.05 -4.90 113.70 116.91 1l5i s SER 80 Ca 0.29 0.62 0.20 0.00 0.70 0.00 0.00 55.95 57.76 1l5i s SER 80 Cb 0.01 -2.41 1.18 0.00 -1.71 0.00 0.00 66.02 63.10 1l5i s SER 80 CO 0.13 -0.64 1.61 -0.81 1.20 0.00 0.00 173.24 174.73 1l5i n PRO 81 N 6.25 0.75 -0.04 5.44 -0.04 -1.26 -2.43 135.00 143.68 1l5i n PRO 81 Ca 0.04 0.00 -0.01 0.00 -0.04 0.00 0.00 63.50 63.49 1l5i n PRO 81 Cb 0.48 -1.41 -0.09 0.00 -0.04 0.00 0.00 33.50 32.43 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 -0.91 0.46 -4.04 0.52 -2.24 -1.26 -5.01 114.28 101.78 1l5i n THR 82 Ca 0.15 -0.40 -0.12 0.00 -2.27 0.00 0.00 64.05 61.41 1l5i n THR 82 Cb 0.07 -0.31 -0.11 0.00 -2.10 0.00 0.00 70.33 67.87 1l5i n THR 82 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1l5i s ARG 83 N -2.52 0.48 -1.28 -0.78 1.70 -1.02 -5.04 118.95 110.49 1l5i s ARG 83 Ca -0.05 -0.75 -0.08 0.00 -0.47 0.00 0.00 55.73 54.38 1l5i s ARG 83 Cb 0.05 -0.17 -0.07 0.00 -0.57 0.00 0.00 34.95 34.19 1l5i s ARG 83 CO 0.49 0.02 2.54 0.43 -1.08 0.00 0.00 175.30 177.70 1l5i n SER 84 N 1.42 6.82 -4.08 -2.89 7.64 -1.26 -4.06 113.62 117.22 1l5i n SER 84 Ca -0.23 -2.46 -0.21 0.00 1.01 0.00 0.00 58.87 56.99 1l5i n SER 84 Cb 0.55 -1.34 -0.15 0.00 -1.01 0.00 0.00 64.21 62.26 1l5i n SER 84 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1l5i s ALA 85 N 2.81 0.99 0.05 -0.43 0.00 -1.26 -5.05 121.76 118.87 1l5i s ALA 85 Ca 0.55 -0.54 0.04 0.00 0.00 0.00 0.00 51.96 52.01 1l5i s ALA 85 Cb 0.14 -0.24 -0.04 0.00 0.00 0.00 0.00 23.12 22.98 1l5i s ALA 85 CO -0.05 0.24 -0.02 -1.01 0.00 0.00 0.00 175.76 174.92 1l5i s HIS 86 N -0.33 2.98 -0.06 0.00 3.76 -1.26 -0.88 115.29 119.50 1l5i s HIS 86 Ca 0.04 -0.01 0.04 0.00 -0.15 0.00 0.00 55.06 54.98 1l5i s HIS 86 Cb -0.05 -1.57 0.00 0.00 1.11 0.00 0.00 32.58 32.07 1l5i s HIS 86 CO -0.00 0.46 -0.16 -0.06 -0.85 0.00 0.00 174.74 174.12 1l5i s PHE 87 N -1.20 1.73 -0.42 1.40 0.08 0.17 -4.96 117.98 114.79 1l5i s PHE 87 Ca 0.23 -0.57 -0.04 0.00 0.12 0.00 0.00 56.93 56.66 1l5i s PHE 87 Cb -0.12 -1.19 0.11 0.00 -0.57 0.00 0.00 43.02 41.25 1l5i s PHE 87 CO 0.14 -0.23 0.22 -1.58 -0.10 0.00 0.00 175.22 173.67 1l5i s HIS 88 N 0.28 3.56 0.68 0.36 5.65 -1.26 -2.26 115.29 122.29 1l5i s HIS 88 Ca -0.09 -2.32 -0.11 0.00 0.25 0.00 0.00 55.06 52.78 1l5i s HIS 88 Cb -0.14 -3.25 0.00 0.00 -1.18 0.00 0.00 32.58 28.01 1l5i s HIS 88 CO 0.04 -0.97 1.06 -1.25 -0.65 0.00 0.00 174.74 172.96 1l5i s PRO 89 N 1.18 3.00 -0.21 2.88 0.04 -1.26 -4.88 135.00 135.74 1l5i s PRO 89 Ca 0.08 0.99 -0.22 0.00 0.04 0.00 0.00 61.00 61.89 1l5i s PRO 89 Cb -0.23 -2.00 -0.02 0.00 0.04 0.00 0.00 34.50 32.29 1l5i s PRO 89 CO -0.04 -1.05 0.68 -0.80 0.04 0.00 0.00 177.00 175.83 1l5i s ASN 90 N -3.65 6.72 -0.09 6.66 0.01 -0.34 -4.79 114.94 119.45 1l5i s ASN 90 Ca 0.59 0.88 -0.23 0.00 -0.71 0.00 0.00 52.86 53.38 1l5i s ASN 90 Cb -0.14 -2.37 -0.03 0.00 0.41 0.00 0.00 41.25 39.11 1l5i s ASN 90 CO 0.52 -0.34 0.70 -0.63 -1.51 0.00 0.00 177.10 175.83 1l5i s ILE 91 N 2.20 5.04 -0.03 0.60 1.01 -1.26 -2.35 121.20 126.41 1l5i s ILE 91 Ca 0.30 1.42 0.01 0.00 0.00 0.00 0.00 60.65 62.38 1l5i s ILE 91 Cb -0.16 -4.03 0.02 0.00 0.01 0.00 0.00 42.46 38.30 1l5i s ILE 91 CO 0.10 0.22 -0.04 -1.10 0.00 0.00 0.00 174.94 174.12 1l5i s GLN 92 N 1.01 0.61 -0.37 2.79 -0.21 -0.71 -4.97 119.66 117.82 1l5i s GLN 92 Ca 0.36 -0.10 -0.19 0.00 0.02 0.00 0.00 55.36 55.46 1l5i s GLN 92 Cb -0.17 -0.65 0.00 0.00 1.00 0.00 0.00 33.01 33.19 1l5i s GLN 92 CO 0.17 -0.03 0.54 0.20 -2.12 0.00 0.00 175.29 174.04 1l5i s GLY 93 N 0.61 1.80 -0.39 3.09 0.00 -1.26 -0.57 107.32 110.61 1l5i s GLY 93 Ca -0.07 -1.06 -0.24 0.00 0.00 0.00 0.00 44.72 43.34 1l5i s GLY 93 CO -0.00 1.31 0.84 0.00 0.00 0.00 0.00 173.10 175.25 1l5i s ALA 94 N 2.46 3.38 0.00 3.20 0.00 0.08 -5.00 121.76 125.88 1l5i s ALA 94 Ca 0.19 -0.65 0.00 0.00 0.00 0.00 0.00 51.96 51.50 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 0.14 -1.64 0.00 1.17 0.00 0.00 0.00 175.76 175.43 1l5i n LYS 95 N 6.65 1.36 -3.52 0.00 4.81 -1.26 -3.93 118.16 122.27 1l5i n LYS 95 Ca 0.04 0.00 -0.36 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 -1.54 1.17 0.00 0.00 177.40 177.03 1l5i s SER 96 N -1.52 6.74 0.00 3.14 1.04 -1.26 -4.85 113.70 116.99 1l5i s SER 96 Ca 0.00 0.90 0.00 0.00 0.48 0.00 0.00 55.95 57.33 1l5i s SER 96 Cb 0.00 -2.22 0.00 0.00 0.10 0.00 0.00 66.02 63.90 1l5i s SER 96 CO 0.00 0.24 0.00 -1.20 0.98 0.00 0.00 173.24 173.26 1l5i n SER 97 N 1.35 0.00 0.00 7.02 7.64 -1.26 -4.98 113.62 123.40 1l5i n SER 97 Ca -0.11 0.00 0.15 0.00 1.01 0.00 0.00 58.87 59.92 1l5i n SER 97 Cb 0.52 0.00 0.75 0.00 -1.01 0.00 0.00 64.21 64.48 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 0.00 -0.21 6.43 3.41 -1.26 -3.68 113.62 118.31 1l5i n SER 98 Ca 0.00 -0.13 0.31 0.00 -0.26 0.00 0.00 58.87 58.78 1l5i n SER 98 Cb 0.00 -0.29 0.62 0.00 -0.26 0.00 0.00 64.21 64.28 1l5i n SER 98 CO 0.00 0.00 0.00 -2.24 -0.16 0.00 0.00 175.04 172.64 1l5i h ASP 99 N 0.00 0.00 -0.38 4.04 3.04 -1.99 2.04 116.42 123.17 1l5i h ASP 99 Ca 0.00 0.00 -0.09 0.00 -3.24 0.00 0.00 57.03 53.70 1l5i h ASP 99 Cb 0.29 0.00 -0.01 0.00 -1.04 0.00 0.00 39.33 38.56 1l5i h ASP 99 CO 0.00 0.00 -0.11 -0.37 -2.04 0.00 0.00 179.24 176.72 1l5i h VAL 100 N 0.00 1.28 -0.16 4.15 -1.51 -1.99 0.10 116.25 118.12 1l5i h VAL 100 Ca 0.48 -1.20 -0.01 0.00 -1.23 0.00 0.00 66.70 64.74 1l5i h VAL 100 Cb 2.45 1.26 -0.01 0.00 -2.13 0.00 0.00 31.29 32.87 1l5i h VAL 100 CO -0.01 0.40 0.07 0.50 -1.23 0.00 0.00 177.57 177.31 1l5i h LYS 101 N 0.55 0.23 -0.39 5.19 3.11 0.30 0.36 116.57 125.92 1l5i h LYS 101 Ca 0.09 -0.04 0.03 0.00 -2.81 0.00 0.00 60.65 57.93 1l5i h LYS 101 Cb 0.63 -0.04 -0.03 0.00 -1.00 0.00 0.00 32.23 31.79 1l5i h LYS 101 CO 0.04 0.30 0.19 0.77 -2.81 0.00 0.00 179.45 177.94 1l5i h SER 102 N 0.12 0.28 -0.09 4.20 0.02 -1.28 0.42 113.55 117.22 1l5i h SER 102 Ca 0.05 0.02 -0.07 0.00 -0.84 0.00 0.00 61.79 60.96 1l5i h SER 102 Cb 0.14 -0.03 -0.01 0.00 0.14 0.00 0.00 62.40 62.64 1l5i h SER 102 CO -0.01 0.21 -0.13 0.22 -1.14 0.00 0.00 176.83 175.98 1l5i h TYR 103 N 0.40 0.46 -0.12 3.45 3.20 -0.72 -2.00 116.97 121.63 1l5i h TYR 103 Ca 0.17 -0.07 -0.09 0.00 3.14 0.00 0.00 58.73 61.88 1l5i h TYR 103 Cb 0.08 -0.12 -0.01 0.00 1.54 0.00 0.00 36.73 38.21 1l5i h TYR 103 CO -0.10 0.55 -0.34 0.82 -1.64 0.00 0.00 178.16 177.44 1l5i h ILE 104 N 0.40 1.28 0.00 1.81 2.04 0.70 -1.57 117.51 122.17 1l5i h ILE 104 Ca 0.08 -1.35 -0.01 0.00 1.00 0.00 0.00 64.86 64.58 1l5i h ILE 104 Cb 0.47 1.57 -0.00 0.00 -0.74 0.00 0.00 36.82 38.11 1l5i h ILE 104 CO 0.03 0.40 -0.04 -0.78 0.00 0.00 0.00 178.15 177.76 1l5i h ASP 105 N 0.21 0.00 0.00 1.72 3.58 -0.21 -3.34 116.42 118.38 1l5i h ASP 105 Ca 0.03 0.00 -0.65 0.00 0.42 0.00 0.00 57.03 56.82 1l5i h ASP 105 Cb 0.71 0.00 0.01 0.00 1.72 0.00 0.00 39.33 41.77 1l5i h ASP 105 CO 0.05 0.04 2.74 0.29 -2.88 0.00 0.00 179.24 179.48 1l5i n LYS 106 N -3.15 2.19 -2.14 0.28 5.02 -0.59 -4.91 118.16 114.87 1l5i n LYS 106 Ca 0.01 -2.13 -0.29 0.00 -2.02 0.00 0.00 58.31 53.88 1l5i n LYS 106 Cb 0.34 -3.02 0.03 0.00 -0.02 0.00 0.00 35.03 32.35 1l5i n LYS 106 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1l5i s ASP 107 N 4.03 5.80 0.00 4.39 1.11 -1.26 -4.99 116.67 125.75 1l5i s ASP 107 Ca 0.53 1.05 0.00 0.00 0.18 0.00 0.00 52.55 54.31 1l5i s ASP 107 Cb 0.14 -2.05 0.00 0.00 1.07 0.00 0.00 42.92 42.09 1l5i s ASP 107 CO 0.02 -1.03 0.00 0.61 1.18 0.00 0.00 175.17 175.94 1l5i n GLY 108 N -2.71 0.23 1.28 0.21 0.00 -1.26 -5.00 105.19 97.93 1l5i n GLY 108 Ca 0.05 0.02 -0.00 0.00 0.00 0.00 0.00 46.02 46.09 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 -2.04 -4.16 1.61 8.00 -1.26 -4.98 116.55 113.72 1l5i n ASP 109 Ca 0.00 -0.01 -0.11 0.00 0.71 0.00 0.00 54.79 55.38 1l5i n ASP 109 Cb 0.00 -0.58 -0.10 0.00 -0.02 0.00 0.00 41.12 40.43 1l5i n ASP 109 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1l5i s VAL 110 N -3.01 0.04 -0.15 2.53 0.11 -1.26 -4.49 120.40 114.17 1l5i s VAL 110 Ca 0.00 -1.91 -0.01 0.00 -2.93 0.00 0.00 61.98 57.14 1l5i s VAL 110 Cb -0.00 -2.31 0.04 0.00 -1.53 0.00 0.00 36.38 32.58 1l5i s VAL 110 CO 0.01 -0.16 -0.04 -0.22 -3.33 0.00 0.00 175.10 171.36 1l5i s LEU 111 N -3.11 1.42 0.03 2.54 0.20 -0.89 -5.02 118.68 113.85 1l5i s LEU 111 Ca 0.32 -0.58 0.03 0.00 0.69 0.00 0.00 54.13 54.60 1l5i s LEU 111 Cb 0.07 -0.83 -0.04 0.00 -0.43 0.00 0.00 46.19 44.96 1l5i s LEU 111 CO 0.08 -0.19 -0.04 -1.83 -0.29 0.00 0.00 176.35 174.08 1l5i s GLU 112 N 1.70 2.57 0.10 1.98 1.03 -1.26 -2.37 118.70 122.45 1l5i s GLU 112 Ca 0.01 -0.74 0.06 0.00 0.03 0.00 0.00 54.97 54.33 1l5i s GLU 112 Cb -0.15 -2.53 -0.03 0.00 -0.80 0.00 0.00 34.13 30.62 1l5i s GLU 112 CO -0.08 0.59 -0.14 -0.46 -1.33 0.00 0.00 175.26 173.84 1l5i s TRP 113 N -1.09 1.33 0.03 4.83 -0.00 -0.53 -4.94 118.94 118.58 1l5i s TRP 113 Ca 0.20 -0.53 0.00 0.00 -0.00 0.00 0.00 56.10 55.76 1l5i s TRP 113 Cb -0.11 -0.72 0.00 0.00 -0.00 0.00 0.00 33.47 32.64 1l5i s TRP 113 CO 0.11 0.11 0.00 0.41 -0.00 0.00 0.00 176.95 177.58 1l5i n GLY 114 N 0.76 -1.19 3.11 5.86 0.00 -1.26 0.78 105.19 113.25 1l5i n GLY 114 Ca -0.17 -1.07 -0.28 0.00 0.00 0.00 0.00 46.02 44.49 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 -0.24 1.59 0.40 2.61 2.01 -1.23 -4.68 115.64 116.09 1l5i s THR 115 Ca 0.00 -0.73 -0.22 0.00 0.31 0.00 0.00 61.69 61.04 1l5i s THR 115 Cb 0.00 -1.41 -0.11 0.00 0.01 0.00 0.00 72.50 71.00 1l5i s THR 115 CO 0.00 0.46 0.95 0.12 -0.69 0.00 0.00 174.62 175.45 1l5i s PHE 116 N 0.59 3.41 -0.14 4.92 2.19 -1.26 -3.90 117.98 123.79 1l5i s PHE 116 Ca -0.15 1.66 -0.08 0.00 0.33 0.00 0.00 56.93 58.69 1l5i s PHE 116 Cb -0.17 -2.87 0.05 0.00 -1.31 0.00 0.00 43.02 38.73 1l5i s PHE 116 CO 0.05 -0.02 0.35 1.14 1.83 0.00 0.00 175.22 178.56 1l5i s GLN 117 N -2.87 0.33 -0.42 10.12 -2.07 -1.26 -5.04 119.66 118.44 1l5i s GLN 117 Ca 0.59 0.68 -0.24 0.00 -1.82 0.00 0.00 55.36 54.57 1l5i s GLN 117 Cb -0.12 -0.05 0.02 0.00 -1.09 0.00 0.00 33.01 31.78 1l5i s GLN 117 CO 0.16 -0.15 0.81 0.42 -1.32 0.00 0.00 175.29 175.21 1l5i s ILE 118 N 1.28 4.64 -0.68 3.63 1.09 -1.26 -4.98 121.20 124.91 1l5i s ILE 118 Ca -0.09 0.63 -0.26 0.00 -1.10 0.00 0.00 60.65 59.83 1l5i s ILE 118 Cb -0.09 -4.31 -0.00 0.00 -1.06 0.00 0.00 42.46 37.00 1l5i s ILE 118 CO -0.10 -0.65 1.65 -0.62 -0.10 0.00 0.00 174.94 175.11 1l5i s ASP 119 N 2.07 5.61 0.00 3.58 2.15 -1.26 -4.68 116.67 124.14 1l5i s ASP 119 Ca 0.32 -0.05 0.00 0.00 0.43 0.00 0.00 52.55 53.25 1l5i s ASP 119 Cb -0.12 -2.54 0.00 0.00 -0.30 0.00 0.00 42.92 39.96 1l5i s ASP 119 CO 0.22 -2.18 0.00 0.61 -0.17 0.00 0.00 175.17 173.64 1l5i n GLY 120 N 5.69 2.03 0.49 2.66 0.00 -1.26 -5.20 105.19 109.60 1l5i n GLY 120 Ca 0.16 0.24 0.14 0.00 0.00 0.00 0.00 46.02 46.55 1l5i n GLY 120 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36