#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 2.27 3.09 0.23 0.00 -1.26 -5.17 105.19 104.35 1l5i n GLY 5 Ca 0.00 -0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.83 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 4.85 0.85 -0.62 1.61 1.70 -1.26 -5.10 118.95 120.98 1l5i s ARG 6 Ca 0.00 -0.57 -0.28 0.00 -0.47 0.00 0.00 55.73 54.42 1l5i s ARG 6 Cb 0.00 -0.81 0.02 0.00 -0.57 0.00 0.00 34.95 33.59 1l5i s ARG 6 CO 0.00 0.21 1.32 0.12 -1.08 0.00 0.00 175.30 175.87 1l5i s PHE 7 N -0.60 2.37 -0.19 5.89 5.36 -1.26 -4.96 117.98 124.58 1l5i s PHE 7 Ca 0.02 0.31 -0.02 0.00 -0.96 0.00 0.00 56.93 56.28 1l5i s PHE 7 Cb -0.06 -4.49 0.06 0.00 -0.34 0.00 0.00 43.02 38.18 1l5i s PHE 7 CO 0.00 -1.89 0.01 0.45 -1.46 0.00 0.00 175.22 172.34 1l5i s SER 8 N 3.87 3.01 -0.13 6.13 0.15 -1.26 -4.10 113.70 121.36 1l5i s SER 8 Ca 0.45 -0.84 -0.04 0.00 0.70 0.00 0.00 55.95 56.22 1l5i s SER 8 Cb -0.09 -0.72 -0.03 0.00 -1.71 0.00 0.00 66.02 63.47 1l5i s SER 8 CO 0.22 -0.28 0.01 -0.63 1.20 0.00 0.00 173.24 173.77 1l5i s ILE 9 N 1.76 4.38 -0.19 6.45 1.01 -1.13 -4.91 121.20 128.56 1l5i s ILE 9 Ca -0.01 -0.20 -0.03 0.00 0.00 0.00 0.00 60.65 60.41 1l5i s ILE 9 Cb -0.17 -2.91 0.06 0.00 0.01 0.00 0.00 42.46 39.46 1l5i s ILE 9 CO -0.07 0.53 0.05 -0.54 0.00 0.00 0.00 174.94 174.91 1l5i s LYS 10 N -0.18 0.55 0.16 2.79 1.02 -1.26 0.86 119.74 123.69 1l5i s LYS 10 Ca 0.05 -0.38 -0.24 0.00 0.02 0.00 0.00 55.97 55.42 1l5i s LYS 10 Cb -0.12 -2.06 0.06 0.00 -0.52 0.00 0.00 37.83 35.19 1l5i s LYS 10 CO 0.02 -0.66 0.74 0.00 -0.92 0.00 0.00 175.35 174.53 1l5i s ALA 11 N 1.90 -1.55 -0.14 5.17 0.00 -1.00 -4.97 121.76 121.17 1l5i s ALA 11 Ca -0.00 0.32 0.17 0.00 0.00 0.00 0.00 51.96 52.45 1l5i s ALA 11 Cb -0.17 0.75 -0.08 0.00 0.00 0.00 0.00 23.12 23.62 1l5i s ALA 11 CO -0.09 -0.87 0.97 -0.22 0.00 0.00 0.00 175.76 175.55 1l5i h LYS 12 N 2.00 0.00 -6.19 0.00 3.11 -1.85 -1.72 116.57 111.92 1l5i h LYS 12 Ca -0.26 0.00 -0.69 0.00 -2.81 0.00 0.00 60.65 56.89 1l5i h LYS 12 Cb 1.27 0.00 -0.23 0.00 -1.00 0.00 0.00 32.23 32.27 1l5i h LYS 12 CO 0.31 0.29 -0.76 -0.80 -2.81 0.00 0.00 179.45 175.68 1l5i s ASN 13 N -5.86 4.07 -0.02 4.20 0.01 -1.26 -2.15 114.94 113.93 1l5i s ASN 13 Ca -0.01 -0.20 0.02 0.00 -0.71 0.00 0.00 52.86 51.96 1l5i s ASN 13 Cb 0.09 -0.96 0.01 0.00 0.41 0.00 0.00 41.25 40.79 1l5i s ASN 13 CO 0.80 0.33 -0.07 -0.31 -1.51 0.00 0.00 177.10 176.33 1l5i s TYR 14 N -0.61 0.77 -0.15 2.20 2.02 -0.69 -2.44 117.35 118.45 1l5i s TYR 14 Ca 0.09 -0.18 0.02 0.00 -0.37 0.00 0.00 57.07 56.62 1l5i s TYR 14 Cb -0.11 -0.57 0.02 0.00 -0.40 0.00 0.00 41.96 40.89 1l5i s TYR 14 CO 0.01 -0.09 -0.20 -0.06 -1.57 0.00 0.00 175.55 173.64 1l5i s PHE 15 N 0.28 2.63 -0.12 2.71 0.40 0.84 -1.74 117.98 122.98 1l5i s PHE 15 Ca -0.04 -1.43 -0.05 0.00 -0.60 0.00 0.00 56.93 54.82 1l5i s PHE 15 Cb -0.08 -1.81 -0.04 0.00 0.51 0.00 0.00 43.02 41.60 1l5i s PHE 15 CO 0.00 -0.69 0.07 -0.51 0.70 0.00 0.00 175.22 174.79 1l5i s LEU 16 N 1.06 3.94 -0.14 -0.37 2.01 0.09 -1.33 118.68 123.94 1l5i s LEU 16 Ca -0.01 0.26 0.00 0.00 0.01 0.00 0.00 54.13 54.39 1l5i s LEU 16 Cb -0.14 -1.94 0.02 0.00 0.01 0.00 0.00 46.19 44.14 1l5i s LEU 16 CO -0.07 0.36 -0.12 -0.89 1.01 0.00 0.00 176.35 176.64 1l5i s THR 17 N -0.73 1.42 -0.42 5.49 2.01 -1.00 -2.00 115.64 120.42 1l5i s THR 17 Ca 0.12 -0.55 -0.06 0.00 0.31 0.00 0.00 61.69 61.51 1l5i s THR 17 Cb -0.12 -1.36 0.10 0.00 0.01 0.00 0.00 72.50 71.13 1l5i s THR 17 CO 0.03 0.42 0.24 -0.31 -0.69 0.00 0.00 174.62 174.30 1l5i s TYR 18 N 1.55 3.45 0.22 4.92 1.51 -0.94 -2.13 117.35 125.93 1l5i s TYR 18 Ca 0.05 -1.98 -0.30 0.00 -1.01 0.00 0.00 57.07 53.83 1l5i s TYR 18 Cb -0.13 -3.11 -0.08 0.00 -0.11 0.00 0.00 41.96 38.52 1l5i s TYR 18 CO -0.10 -0.93 1.10 -1.25 -1.11 0.00 0.00 175.55 173.27 1l5i s PRO 19 N 1.29 4.61 -1.54 -1.71 0.04 -1.26 -2.41 135.00 134.02 1l5i s PRO 19 Ca 0.05 1.76 -0.08 0.00 0.04 0.00 0.00 61.00 62.76 1l5i s PRO 19 Cb -0.23 -3.24 0.08 0.00 0.04 0.00 0.00 34.50 31.15 1l5i s PRO 19 CO -0.01 0.13 0.21 0.36 0.04 0.00 0.00 177.00 177.73 1l5i n LYS 20 N 1.89 -0.86 -3.78 4.56 2.85 -0.54 -4.87 118.16 117.41 1l5i n LYS 20 Ca 0.01 0.10 -0.36 0.00 -1.05 0.00 0.00 58.31 57.01 1l5i n LYS 20 Cb 0.45 -3.68 -0.12 0.00 -0.65 0.00 0.00 35.03 31.03 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 4.80 2.03 -4.74 0.00 9.92 -1.26 -4.49 116.55 122.81 1l5i n ASP 22 Ca -0.16 -2.16 -0.41 0.00 -0.53 0.00 0.00 54.79 51.53 1l5i n ASP 22 Cb 0.52 -0.37 -0.03 0.00 -0.64 0.00 0.00 41.12 40.60 1l5i n ASP 22 CO 0.00 0.00 0.00 -0.22 0.13 0.00 0.00 177.20 177.11 1l5i s LEU 23 N -0.99 4.43 0.55 0.64 2.96 -1.26 -5.02 118.68 120.00 1l5i s LEU 23 Ca 0.18 2.39 -0.06 0.00 -0.22 0.00 0.00 54.13 56.42 1l5i s LEU 23 Cb 0.12 -3.61 -0.01 0.00 0.50 0.00 0.00 46.19 43.18 1l5i s LEU 23 CO 0.09 -0.47 0.86 0.42 -1.32 0.00 0.00 176.35 175.93 1l5i s THR 24 N -0.14 4.22 0.28 3.68 -4.23 -1.26 -4.94 115.64 113.24 1l5i s THR 24 Ca 0.54 0.12 0.14 0.00 -1.18 0.00 0.00 61.69 61.30 1l5i s THR 24 Cb -0.36 -3.64 0.05 0.00 1.34 0.00 0.00 72.50 69.90 1l5i s THR 24 CO 0.40 -0.65 1.72 0.07 -0.54 0.00 0.00 174.62 175.61 1l5i h LYS 25 N -0.01 0.00 -0.14 3.99 -0.00 -1.97 -1.04 116.57 117.40 1l5i h LYS 25 Ca -0.46 0.00 -0.02 0.00 -0.00 0.00 0.00 60.65 60.17 1l5i h LYS 25 Cb 1.23 0.00 -0.01 0.00 -0.00 0.00 0.00 32.23 33.46 1l5i h LYS 25 CO 0.61 0.48 0.03 1.49 -0.00 0.00 0.00 179.45 182.05 1l5i h GLU 26 N 0.00 0.23 -0.31 0.07 4.81 -1.96 1.41 114.58 118.84 1l5i h GLU 26 Ca -0.00 -0.06 -0.07 0.00 -0.13 0.00 0.00 59.36 59.09 1l5i h GLU 26 Cb 0.90 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 30.24 1l5i h GLU 26 CO 0.06 0.41 -0.10 -0.91 -0.73 0.00 0.00 179.01 177.74 1l5i h ASN 27 N 0.02 0.62 -0.53 1.04 -0.26 -1.93 0.42 115.58 114.96 1l5i h ASN 27 Ca 0.04 -0.38 -0.09 0.00 -0.56 0.00 0.00 56.30 55.31 1l5i h ASN 27 Cb 0.28 -0.17 -0.02 0.00 -1.06 0.00 0.00 38.32 37.35 1l5i h ASN 27 CO 0.00 0.86 0.00 0.00 -1.06 0.00 0.00 177.43 177.23 1l5i h ALA 28 N 0.78 0.93 -0.30 -0.83 0.00 -1.10 0.22 119.26 118.96 1l5i h ALA 28 Ca 0.07 -0.30 -0.14 0.00 0.00 0.00 0.00 54.91 54.55 1l5i h ALA 28 Cb 0.60 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.17 1l5i h ALA 28 CO 0.04 0.64 -0.37 1.25 0.00 0.00 0.00 179.25 180.81 1l5i h LEU 29 N 0.90 0.73 -0.21 0.00 7.12 0.21 0.81 115.31 124.87 1l5i h LEU 29 Ca 0.16 -0.32 -0.05 0.00 0.13 0.00 0.00 57.88 57.80 1l5i h LEU 29 Cb 0.52 -0.20 -0.01 0.00 -0.53 0.00 0.00 40.66 40.44 1l5i h LEU 29 CO 0.03 1.02 -0.08 0.77 -0.13 0.00 0.00 178.44 180.06 1l5i h SER 30 N 0.58 0.43 -0.10 1.25 4.64 0.27 0.52 113.55 121.14 1l5i h SER 30 Ca 0.06 -0.39 -0.06 0.00 -0.47 0.00 0.00 61.79 60.92 1l5i h SER 30 Cb 0.89 -0.12 0.00 0.00 -0.31 0.00 0.00 62.40 62.86 1l5i h SER 30 CO 0.08 0.72 -0.19 1.56 -0.87 0.00 0.00 176.83 178.14 1l5i h GLN 31 N 0.14 0.31 -0.29 4.77 4.20 -0.48 0.47 115.11 124.23 1l5i h GLN 31 Ca 0.05 -0.19 -0.01 0.00 0.06 0.00 0.00 58.65 58.56 1l5i h GLN 31 Cb 0.55 0.02 -0.01 0.00 0.30 0.00 0.00 27.48 28.34 1l5i h GLN 31 CO 0.03 0.78 0.15 0.82 -0.67 0.00 0.00 178.83 179.94 1l5i h ILE 32 N -0.13 1.13 -0.41 2.54 1.08 0.63 0.81 117.51 123.17 1l5i h ILE 32 Ca 0.01 -0.35 -0.05 0.00 -0.39 0.00 0.00 64.86 64.07 1l5i h ILE 32 Cb 0.76 0.84 -0.02 0.00 -3.07 0.00 0.00 36.82 35.33 1l5i h ILE 32 CO 0.04 0.13 0.05 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 -0.56 112.91 115.69 1l5i h THR 33 Ca 0.10 -0.77 0.00 0.00 0.77 0.00 0.00 66.41 66.51 1l5i h THR 33 Cb 0.07 0.84 0.00 0.00 -1.74 0.00 0.00 68.15 67.32 1l5i h THR 33 CO -0.02 0.27 -0.16 0.59 0.37 0.00 0.00 175.52 176.58 1l5i n ASN 34 N -4.28 0.21 -4.65 4.18 3.02 0.15 -4.77 115.26 109.11 1l5i n ASN 34 Ca 0.02 0.28 -0.43 0.00 -0.03 0.00 0.00 54.58 54.43 1l5i n ASN 34 Cb 0.23 -0.28 -0.02 0.00 -0.61 0.00 0.00 39.78 39.09 1l5i n ASN 34 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1l5i s LEU 35 N -3.12 4.12 0.62 3.41 1.02 0.28 -5.01 118.68 120.00 1l5i s LEU 35 Ca 0.13 1.62 -0.09 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 42.84 1l5i s LEU 35 CO 0.59 -0.86 1.00 -1.10 0.02 0.00 0.00 176.35 176.00 1l5i s GLN 36 N 3.72 3.24 0.06 1.70 -0.21 -1.26 -4.95 119.66 121.96 1l5i s GLN 36 Ca 0.57 0.45 -0.10 0.00 0.02 0.00 0.00 55.36 56.30 1l5i s GLN 36 Cb -0.21 -2.13 0.00 0.00 1.00 0.00 0.00 33.01 31.67 1l5i s GLN 36 CO 0.18 -0.69 0.21 -0.08 -2.12 0.00 0.00 175.29 172.79 1l5i s THR 37 N -3.14 0.12 -1.70 -0.19 -1.32 -1.26 -5.02 115.64 103.12 1l5i s THR 37 Ca 0.55 -0.98 0.23 0.00 -1.21 0.00 0.00 61.69 60.29 1l5i s THR 37 Cb -0.11 -1.10 0.54 0.00 -1.51 0.00 0.00 72.50 70.32 1l5i s THR 37 CO 0.50 -0.54 1.77 -0.81 -2.21 0.00 0.00 174.62 173.34 1l5i n PRO 38 N 0.33 0.53 0.00 7.08 -0.04 -1.26 -4.57 135.00 137.06 1l5i n PRO 38 Ca -0.17 0.04 0.00 0.00 -0.04 0.00 0.00 63.50 63.33 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 -1.15 0.00 -3.64 0.52 5.66 -1.26 -5.11 114.28 109.30 1l5i n THR 39 Ca 0.14 0.00 -0.04 0.00 -3.05 0.00 0.00 64.05 61.10 1l5i n THR 39 Cb 0.13 0.00 -0.07 0.00 -1.55 0.00 0.00 70.33 68.85 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 -0.44 -0.13 1.09 3.04 -1.26 -4.99 114.94 112.61 1l5i s ASN 40 Ca 0.00 0.74 -0.22 0.00 0.04 0.00 0.00 52.86 53.42 1l5i s ASN 40 Cb 0.00 1.02 -0.03 0.00 -1.54 0.00 0.00 41.25 40.70 1l5i s ASN 40 CO 0.00 -0.12 0.68 -0.54 -3.04 0.00 0.00 177.10 174.08 1l5i s LYS 41 N 0.90 4.34 0.00 0.43 1.02 -1.26 -1.59 119.74 123.58 1l5i s LYS 41 Ca -0.04 0.78 0.00 0.00 0.02 0.00 0.00 55.97 56.73 1l5i s LYS 41 Cb -0.04 -3.51 0.00 0.00 -0.52 0.00 0.00 37.83 33.76 1l5i s LYS 41 CO -0.12 -0.08 0.00 1.28 -0.92 0.00 0.00 175.35 175.51 1l5i n LEU 42 N 4.39 0.00 -4.88 3.17 4.32 -0.59 -4.90 117.00 118.52 1l5i n LEU 42 Ca -0.01 0.00 -0.25 0.00 -0.02 0.00 0.00 56.01 55.73 1l5i n LEU 42 Cb 0.50 0.00 -0.04 0.00 -1.62 0.00 0.00 43.42 42.26 1l5i n LEU 42 CO 0.46 0.00 -0.14 0.12 -1.22 0.00 0.00 177.39 176.61 1l5i s PHE 43 N 0.00 3.32 -0.11 -1.77 5.36 -1.19 -2.89 117.98 120.70 1l5i s PHE 43 Ca 0.00 0.03 -0.03 0.00 -0.96 0.00 0.00 56.93 55.97 1l5i s PHE 43 Cb 0.00 -1.57 0.04 0.00 -0.34 0.00 0.00 43.02 41.15 1l5i s PHE 43 CO 0.00 0.51 0.07 0.42 -1.46 0.00 0.00 175.22 174.76 1l5i s ILE 44 N -1.81 -0.04 -0.17 3.12 1.01 0.77 -2.33 121.20 121.76 1l5i s ILE 44 Ca 0.33 0.10 -0.03 0.00 0.00 0.00 0.00 60.65 61.06 1l5i s ILE 44 Cb -0.10 -0.40 -0.02 0.00 0.01 0.00 0.00 42.46 41.95 1l5i s ILE 44 CO 0.26 -0.03 -0.06 -0.75 0.00 0.00 0.00 174.94 174.35 1l5i s LYS 45 N 2.13 3.50 -0.16 2.79 2.36 0.74 -1.53 119.74 129.57 1l5i s LYS 45 Ca 0.03 -0.60 -0.01 0.00 -2.55 0.00 0.00 55.97 52.85 1l5i s LYS 45 Cb -0.14 -2.87 0.04 0.00 -1.05 0.00 0.00 37.83 33.81 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 1.09 -0.04 5.43 1.01 -0.91 0.38 121.20 128.87 1l5i s ILE 46 Ca -0.03 -0.60 0.05 0.00 0.00 0.00 0.00 60.65 60.07 1l5i s ILE 46 Cb -0.15 -1.26 -0.01 0.00 0.01 0.00 0.00 42.46 41.05 1l5i s ILE 46 CO 0.02 0.14 -0.20 0.00 0.00 0.00 0.00 174.94 174.89 1l5i s ARG 48 N -0.19 3.33 -0.08 0.00 3.52 -1.26 -0.37 118.95 123.90 1l5i s ARG 48 Ca 0.00 -0.27 -0.05 0.00 -0.13 0.00 0.00 55.73 55.28 1l5i s ARG 48 Cb -0.11 -3.07 0.03 0.00 -1.56 0.00 0.00 34.95 30.25 1l5i s ARG 48 CO 0.02 0.72 0.19 -2.00 -0.81 0.00 0.00 175.30 173.42 1l5i s GLU 49 N -1.39 0.18 -0.14 5.12 2.56 -0.92 -4.94 118.70 119.17 1l5i s GLU 49 Ca 0.20 0.37 -0.10 0.00 0.00 0.00 0.00 54.97 55.43 1l5i s GLU 49 Cb -0.12 -0.04 -0.05 0.00 2.00 0.00 0.00 34.13 35.92 1l5i s GLU 49 CO 0.10 -0.10 0.19 -0.51 -0.56 0.00 0.00 175.26 174.38 1l5i s LEU 50 N 0.73 4.31 0.48 2.70 2.01 -1.26 -0.99 118.68 126.66 1l5i s LEU 50 Ca -0.05 0.45 -0.17 0.00 0.01 0.00 0.00 54.13 54.37 1l5i s LEU 50 Cb -0.07 -2.19 -0.08 0.00 0.01 0.00 0.00 46.19 43.86 1l5i s LEU 50 CO -0.04 0.26 0.95 -1.00 1.01 0.00 0.00 176.35 177.53 1l5i s HIS 51 N -0.28 3.43 -1.30 0.29 3.76 -0.12 -4.90 115.29 116.16 1l5i s HIS 51 Ca 0.14 1.44 0.21 0.00 -0.15 0.00 0.00 55.06 56.70 1l5i s HIS 51 Cb -0.12 -2.76 1.01 0.00 1.11 0.00 0.00 32.58 31.82 1l5i s HIS 51 CO 0.03 -0.28 1.67 0.39 -0.85 0.00 0.00 174.74 175.70 1l5i n GLU 52 N -1.35 0.21 0.00 1.40 4.71 -1.26 -1.98 120.64 122.37 1l5i n GLU 52 Ca 0.06 0.10 0.15 0.00 -0.01 0.00 0.00 57.16 57.46 1l5i n GLU 52 Cb 0.54 -1.50 0.74 0.00 -1.01 0.00 0.00 31.44 30.21 1l5i n GLU 52 CO 0.00 0.00 0.00 -1.71 0.09 0.00 0.00 177.13 175.51 1l5i n ASN 53 N -1.35 0.68 0.00 1.62 5.15 -1.26 -4.86 115.26 115.24 1l5i n ASN 53 Ca 0.09 -1.17 0.00 0.00 -0.60 0.00 0.00 54.58 52.90 1l5i n ASN 53 Cb 0.19 -0.01 0.00 0.00 -0.53 0.00 0.00 39.78 39.43 1l5i n ASN 53 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1l5i n GLY 54 N 1.10 0.78 3.76 8.20 0.00 -0.84 -5.03 105.19 113.16 1l5i n GLY 54 Ca 0.21 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.86 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 -0.33 4.09 0.10 1.61 -1.05 -1.25 -4.93 118.70 116.94 1l5i s GLU 55 Ca 0.00 0.08 -0.30 0.00 -0.15 0.00 0.00 54.97 54.60 1l5i s GLU 55 Cb 0.00 -3.37 -0.06 0.00 -0.44 0.00 0.00 34.13 30.26 1l5i s GLU 55 CO 0.00 0.38 1.15 -1.25 0.95 0.00 0.00 175.26 176.49 1l5i s PRO 56 N 0.05 4.49 0.17 -4.83 0.04 -1.26 -0.95 135.00 132.71 1l5i s PRO 56 Ca 0.17 1.73 0.11 0.00 0.04 0.00 0.00 61.00 63.04 1l5i s PRO 56 Cb -0.13 -3.33 -0.04 0.00 0.04 0.00 0.00 34.50 31.03 1l5i s PRO 56 CO 0.05 -0.13 -0.24 -1.58 0.04 0.00 0.00 177.00 175.13 1l5i s HIS 57 N 0.62 2.23 -0.01 0.56 2.46 -0.16 -1.40 115.29 119.60 1l5i s HIS 57 Ca 0.55 -0.38 0.03 0.00 0.47 0.00 0.00 55.06 55.74 1l5i s HIS 57 Cb -0.29 -1.13 -0.01 0.00 -0.13 0.00 0.00 32.58 31.02 1l5i s HIS 57 CO 0.31 0.44 -0.10 -1.17 -2.47 0.00 0.00 174.74 171.74 1l5i s LEU 58 N -2.51 1.96 -0.05 8.88 1.98 -1.01 -2.17 118.68 125.76 1l5i s LEU 58 Ca 0.18 -0.19 0.06 0.00 -2.89 0.00 0.00 54.13 51.29 1l5i s LEU 58 Cb -0.08 -0.56 -0.01 0.00 0.66 0.00 0.00 46.19 46.20 1l5i s LEU 58 CO 0.08 0.11 -0.24 -1.00 -1.89 0.00 0.00 176.35 173.42 1l5i s HIS 59 N -0.13 2.31 -0.01 5.38 3.76 0.50 -2.21 115.29 124.89 1l5i s HIS 59 Ca 0.02 -0.68 0.01 0.00 -0.15 0.00 0.00 55.06 54.27 1l5i s HIS 59 Cb -0.05 -1.52 0.00 0.00 1.11 0.00 0.00 32.58 32.12 1l5i s HIS 59 CO -0.00 -0.20 -0.04 0.42 -0.85 0.00 0.00 174.74 174.07 1l5i s ILE 60 N -0.14 0.35 -0.17 0.60 1.01 -0.84 -1.02 121.20 120.98 1l5i s ILE 60 Ca -0.03 -0.14 -0.04 0.00 0.00 0.00 0.00 60.65 60.44 1l5i s ILE 60 Cb -0.13 -0.33 0.06 0.00 0.01 0.00 0.00 42.46 42.07 1l5i s ILE 60 CO 0.03 0.12 0.08 -0.22 0.00 0.00 0.00 174.94 174.95 1l5i s LEU 61 N 0.20 0.50 0.14 2.97 1.98 0.16 -0.73 118.68 123.91 1l5i s LEU 61 Ca -0.02 -0.61 0.09 0.00 -2.89 0.00 0.00 54.13 50.69 1l5i s LEU 61 Cb -0.05 -0.31 -0.04 0.00 0.66 0.00 0.00 46.19 46.45 1l5i s LEU 61 CO -0.00 -0.33 -0.13 -0.63 -1.89 0.00 0.00 176.35 173.36 1l5i s ILE 62 N 2.08 3.07 -0.04 6.68 1.01 -0.71 -0.19 121.20 133.11 1l5i s ILE 62 Ca 0.02 -1.54 0.01 0.00 0.00 0.00 0.00 60.65 59.13 1l5i s ILE 62 Cb -0.16 -2.46 0.02 0.00 0.01 0.00 0.00 42.46 39.87 1l5i s ILE 62 CO -0.08 0.01 -0.03 0.00 0.00 0.00 0.00 174.94 174.84 1l5i s GLN 63 N -2.46 0.61 0.19 2.79 1.03 -0.98 -1.70 119.66 119.13 1l5i s GLN 63 Ca 0.22 -0.03 0.05 0.00 0.04 0.00 0.00 55.36 55.64 1l5i s GLN 63 Cb -0.10 -0.69 -0.04 0.00 0.03 0.00 0.00 33.01 32.21 1l5i s GLN 63 CO 0.13 -0.10 0.20 -0.06 -2.54 0.00 0.00 175.29 172.92 1l5i s PHE 64 N 0.96 3.24 0.39 9.60 0.40 -0.91 -1.54 117.98 130.13 1l5i s PHE 64 Ca -0.10 -0.01 0.07 0.00 -0.60 0.00 0.00 56.93 56.28 1l5i s PHE 64 Cb -0.14 -1.53 0.80 0.00 0.51 0.00 0.00 43.02 42.66 1l5i s PHE 64 CO -0.01 0.51 2.00 1.49 0.70 0.00 0.00 175.22 179.91 1l5i h GLU 65 N 2.03 0.49 -5.73 0.44 4.22 -1.63 -3.43 114.58 110.97 1l5i h GLU 65 Ca -0.48 -0.06 -0.48 0.00 0.08 0.00 0.00 59.36 58.42 1l5i h GLU 65 Cb 1.21 -0.10 -0.15 0.00 0.50 0.00 0.00 28.75 30.21 1l5i h GLU 65 CO 0.64 0.40 -0.75 0.20 -2.18 0.00 0.00 179.01 177.32 1l5i s GLY 66 N -3.78 1.45 0.01 1.92 0.00 -1.26 -5.05 107.32 100.62 1l5i s GLY 66 Ca -0.08 -1.63 -0.30 0.00 0.00 0.00 0.00 44.72 42.72 1l5i s GLY 66 CO 0.74 -1.71 2.01 0.28 0.00 0.00 0.00 173.10 174.42 1l5i n LYS 67 N -0.20 2.77 -3.83 2.90 5.02 -1.26 -4.75 118.16 118.82 1l5i n LYS 67 Ca -0.09 1.00 -0.34 0.00 -2.02 0.00 0.00 58.31 56.85 1l5i n LYS 67 Cb 0.59 -3.04 -0.05 0.00 -0.02 0.00 0.00 35.03 32.51 1l5i n LYS 67 CO 0.00 0.00 0.00 -0.47 -0.52 0.00 0.00 177.40 176.41 1l5i s TYR 68 N 4.90 3.57 -0.30 2.13 5.04 -0.65 -4.86 117.35 127.19 1l5i s TYR 68 Ca 0.90 0.49 -0.10 0.00 -2.44 0.00 0.00 57.07 55.92 1l5i s TYR 68 Cb -0.42 -1.92 -0.02 0.00 0.35 0.00 0.00 41.96 39.94 1l5i s TYR 68 CO 0.41 0.64 0.16 1.21 -1.34 0.00 0.00 175.55 176.64 1l5i s ASN 69 N -1.72 5.68 -0.83 4.32 3.04 -1.26 -2.38 114.94 121.79 1l5i s ASN 69 Ca 0.26 -0.34 0.02 0.00 0.04 0.00 0.00 52.86 52.84 1l5i s ASN 69 Cb -0.13 -2.04 0.27 0.00 -1.54 0.00 0.00 41.25 37.81 1l5i s ASN 69 CO 0.16 -0.14 1.05 0.00 -3.04 0.00 0.00 177.10 175.12 1l5i n THR 71 N 1.09 2.59 -3.46 0.00 5.66 -1.26 -2.85 114.28 116.04 1l5i n THR 71 Ca 0.28 -1.39 0.01 0.00 -3.05 0.00 0.00 64.05 59.90 1l5i n THR 71 Cb 0.38 -0.63 -0.03 0.00 -1.55 0.00 0.00 70.33 68.49 1l5i n THR 71 CO 0.00 0.00 0.00 0.21 -3.05 0.00 0.00 175.07 172.23 1l5i s ASN 72 N -0.64 -1.03 -0.26 1.09 2.47 -1.26 -4.74 114.94 110.57 1l5i s ASN 72 Ca 0.41 1.18 -0.02 0.00 0.42 0.00 0.00 52.86 54.85 1l5i s ASN 72 Cb 0.34 2.08 0.07 0.00 -1.45 0.00 0.00 41.25 42.29 1l5i s ASN 72 CO 0.08 -0.20 2.46 0.00 -3.72 0.00 0.00 177.10 175.72 1l5i n GLN 73 N 5.34 1.88 -0.00 0.43 10.64 -1.26 -3.60 117.38 130.81 1l5i n GLN 73 Ca -0.09 -1.47 0.01 0.00 -1.83 0.00 0.00 57.00 53.62 1l5i n GLN 73 Cb 0.50 -1.73 -0.01 0.00 -0.86 0.00 0.00 30.24 28.14 1l5i n GLN 73 CO 0.00 0.00 0.00 0.54 -1.83 0.00 0.00 177.06 175.77 1l5i n ARG 74 N 0.98 1.76 0.07 2.61 1.74 -1.26 -4.51 116.66 118.05 1l5i n ARG 74 Ca 0.33 -0.01 -0.20 0.00 -0.77 0.00 0.00 57.85 57.19 1l5i n ARG 74 Cb 0.61 -0.92 -0.11 0.00 -1.02 0.00 0.00 32.46 31.02 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 0.95 -0.28 -1.55 3.57 -2.01 -3.14 116.94 114.49 1l5i h PHE 75 Ca 0.00 -0.57 0.00 0.00 3.53 0.00 0.00 57.97 60.93 1l5i h PHE 75 Cb 0.07 -0.09 0.00 0.00 2.79 0.00 0.00 35.95 38.72 1l5i h PHE 75 CO 0.00 1.41 0.00 1.19 -2.23 0.00 0.00 178.31 178.68 1l5i n PHE 76 N -3.79 0.51 -1.92 0.41 3.72 -1.26 -4.85 117.46 110.28 1l5i n PHE 76 Ca -0.12 -0.22 -0.41 0.00 -0.05 0.00 0.00 57.45 56.66 1l5i n PHE 76 Cb 0.94 -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 -0.81 5.47 -0.09 4.37 1.01 -1.19 -4.46 116.67 120.98 1l5i s ASP 77 Ca 0.20 1.02 -0.02 0.00 0.71 0.00 0.00 52.55 54.46 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 0.11 -2.09 -0.00 -0.76 0.21 0.00 0.00 175.17 172.64 1l5i s LEU 78 N 8.38 3.56 0.29 1.23 1.02 -0.97 -4.98 118.68 127.22 1l5i s LEU 78 Ca 0.80 0.13 0.08 0.00 0.02 0.00 0.00 54.13 55.16 1l5i s LEU 78 Cb -0.19 -1.81 -0.06 0.00 0.02 0.00 0.00 46.19 44.14 1l5i s LEU 78 CO 0.29 0.37 -0.09 0.68 0.02 0.00 0.00 176.35 177.61 1l5i s VAL 79 N -0.82 1.94 -0.27 -1.59 -7.23 -1.26 0.33 120.40 111.50 1l5i s VAL 79 Ca 0.13 -2.19 -0.24 0.00 -1.81 0.00 0.00 61.98 57.87 1l5i s VAL 79 Cb -0.11 -2.47 -0.00 0.00 0.56 0.00 0.00 36.38 34.36 1l5i s VAL 79 CO 0.02 -0.30 0.81 -0.55 -0.31 0.00 0.00 175.10 174.77 1l5i s SER 80 N -3.49 6.75 0.00 4.85 0.15 -0.19 -4.90 113.70 116.86 1l5i s SER 80 Ca 0.30 0.87 0.23 0.00 0.70 0.00 0.00 55.95 58.05 1l5i s SER 80 Cb 0.02 -2.42 1.24 0.00 -1.71 0.00 0.00 66.02 63.15 1l5i s SER 80 CO 0.13 -0.55 1.76 -0.81 1.20 0.00 0.00 173.24 174.97 1l5i n PRO 81 N 6.09 0.47 -0.01 5.44 -0.04 -1.26 -2.53 135.00 143.16 1l5i n PRO 81 Ca 0.05 0.05 0.04 0.00 -0.04 0.00 0.00 63.50 63.59 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 -1.19 0.04 -4.27 0.52 -2.24 -1.26 -5.00 114.28 100.87 1l5i n THR 82 Ca 0.13 -0.22 -0.17 0.00 -2.27 0.00 0.00 64.05 61.52 1l5i n THR 82 Cb 0.15 0.22 -0.14 0.00 -2.10 0.00 0.00 70.33 68.46 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 -2.61 0.69 -0.86 -0.78 3.00 -1.05 -5.03 118.95 112.30 1l5i s ARG 83 Ca -0.03 -0.47 -0.07 0.00 -1.00 0.00 0.00 55.73 54.16 1l5i s ARG 83 Cb 0.06 -0.63 -0.12 0.00 0.00 0.00 0.00 34.95 34.25 1l5i s ARG 83 CO 0.38 0.16 2.72 0.45 0.00 0.00 0.00 175.30 179.02 1l5i n SER 84 N 2.42 6.08 -4.10 -2.12 2.88 -1.26 -3.86 113.62 113.66 1l5i n SER 84 Ca -0.16 -2.40 -0.20 0.00 -1.33 0.00 0.00 58.87 54.78 1l5i n SER 84 Cb 0.56 -1.28 -0.14 0.00 -0.75 0.00 0.00 64.21 62.61 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 2.28 1.03 0.05 -1.46 0.00 -1.26 -5.04 121.76 117.35 1l5i s ALA 85 Ca 0.55 -0.66 0.03 0.00 0.00 0.00 0.00 51.96 51.89 1l5i s ALA 85 Cb 0.18 -0.20 -0.04 0.00 0.00 0.00 0.00 23.12 23.07 1l5i s ALA 85 CO -0.03 0.21 0.00 -1.01 0.00 0.00 0.00 175.76 174.93 1l5i s HIS 86 N -0.60 3.03 -0.07 0.00 3.76 -1.26 -1.02 115.29 119.13 1l5i s HIS 86 Ca 0.02 0.02 0.03 0.00 -0.15 0.00 0.00 55.06 54.98 1l5i s HIS 86 Cb -0.06 -1.59 0.01 0.00 1.11 0.00 0.00 32.58 32.04 1l5i s HIS 86 CO 0.00 0.47 -0.16 -0.06 -0.85 0.00 0.00 174.74 174.15 1l5i s PHE 87 N -1.23 1.75 -0.44 1.40 0.08 0.15 -4.96 117.98 114.74 1l5i s PHE 87 Ca 0.24 -0.63 -0.07 0.00 0.12 0.00 0.00 56.93 56.59 1l5i s PHE 87 Cb -0.12 -1.22 0.10 0.00 -0.57 0.00 0.00 43.02 41.21 1l5i s PHE 87 CO 0.15 -0.27 0.28 -1.58 -0.10 0.00 0.00 175.22 173.70 1l5i s HIS 88 N 0.42 3.44 0.51 0.36 5.65 -1.26 -2.28 115.29 122.12 1l5i s HIS 88 Ca -0.12 -1.91 -0.19 0.00 0.25 0.00 0.00 55.06 53.08 1l5i s HIS 88 Cb -0.15 -3.24 -0.07 0.00 -1.18 0.00 0.00 32.58 27.94 1l5i s HIS 88 CO 0.04 -0.94 1.04 -1.25 -0.65 0.00 0.00 174.74 172.98 1l5i s PRO 89 N 1.32 3.68 -0.15 2.88 0.04 -1.26 -4.93 135.00 136.58 1l5i s PRO 89 Ca 0.05 1.30 -0.22 0.00 0.04 0.00 0.00 61.00 62.17 1l5i s PRO 89 Cb -0.24 -2.08 -0.03 0.00 0.04 0.00 0.00 34.50 32.19 1l5i s PRO 89 CO -0.01 -0.52 0.68 -0.80 0.04 0.00 0.00 177.00 176.39 1l5i s ASN 90 N -2.24 6.82 -0.11 6.66 0.01 -0.91 -4.84 114.94 120.34 1l5i s ASN 90 Ca 0.66 0.99 -0.21 0.00 -0.71 0.00 0.00 52.86 53.60 1l5i s ASN 90 Cb -0.16 -2.38 -0.04 0.00 0.41 0.00 0.00 41.25 39.08 1l5i s ASN 90 CO 0.25 -0.24 0.58 -0.63 -1.51 0.00 0.00 177.10 175.55 1l5i s ILE 91 N 1.60 5.11 -0.03 0.60 1.01 -1.26 -2.36 121.20 125.88 1l5i s ILE 91 Ca 0.33 1.18 0.01 0.00 0.00 0.00 0.00 60.65 62.17 1l5i s ILE 91 Cb -0.16 -3.92 0.01 0.00 0.01 0.00 0.00 42.46 38.40 1l5i s ILE 91 CO 0.13 0.27 -0.04 -1.10 0.00 0.00 0.00 174.94 174.20 1l5i s GLN 92 N 0.84 0.63 -0.22 2.79 -0.21 -0.44 -4.97 119.66 118.07 1l5i s GLN 92 Ca 0.31 -0.11 -0.19 0.00 0.02 0.00 0.00 55.36 55.39 1l5i s GLN 92 Cb -0.16 -0.65 -0.03 0.00 1.00 0.00 0.00 33.01 33.17 1l5i s GLN 92 CO 0.13 -0.02 0.54 0.20 -2.12 0.00 0.00 175.29 174.02 1l5i s GLY 93 N 0.58 1.98 -0.35 3.09 0.00 -1.26 -0.11 107.32 111.24 1l5i s GLY 93 Ca -0.07 -0.45 -0.29 0.00 0.00 0.00 0.00 44.72 43.91 1l5i s GLY 93 CO -0.00 1.17 1.27 0.00 0.00 0.00 0.00 173.10 175.54 1l5i s ALA 94 N 1.93 3.28 -0.29 3.20 0.00 -1.02 -4.88 121.76 123.97 1l5i s ALA 94 Ca 0.24 -0.06 -0.02 0.00 0.00 0.00 0.00 51.96 52.12 1l5i s ALA 94 Cb -0.15 -3.82 0.09 0.00 0.00 0.00 0.00 23.12 19.24 1l5i s ALA 94 CO 0.09 -1.94 2.42 0.36 0.00 0.00 0.00 175.76 176.69 1l5i n LYS 95 N 7.50 1.92 -4.43 0.00 2.85 -1.26 -4.61 118.16 120.13 1l5i n LYS 95 Ca 0.14 -1.57 -0.22 0.00 -1.05 0.00 0.00 58.31 55.61 1l5i n LYS 95 Cb 0.47 -1.75 -0.09 0.00 -0.65 0.00 0.00 35.03 33.02 1l5i n LYS 95 CO 0.00 0.00 0.00 -1.12 -0.05 0.00 0.00 177.40 176.23 1l5i s SER 96 N 0.62 2.23 0.00 -5.58 0.01 -1.26 -5.13 113.70 104.59 1l5i s SER 96 Ca 0.40 -1.61 0.00 0.00 1.31 0.00 0.00 55.95 56.05 1l5i s SER 96 Cb 0.27 0.41 0.00 0.00 0.21 0.00 0.00 66.02 66.91 1l5i s SER 96 CO -0.07 -0.89 0.00 -1.20 0.41 0.00 0.00 173.24 171.49 1l5i n SER 97 N -1.13 0.00 -0.01 2.44 7.64 -1.26 -4.83 113.62 116.47 1l5i n SER 97 Ca -0.02 0.00 0.14 0.00 1.01 0.00 0.00 58.87 60.00 1l5i n SER 97 Cb 0.65 0.00 0.66 0.00 -1.01 0.00 0.00 64.21 64.51 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 0.04 -0.31 6.43 7.64 -1.26 -3.67 113.62 122.49 1l5i n SER 98 Ca 0.00 0.18 0.35 0.00 1.01 0.00 0.00 58.87 60.42 1l5i n SER 98 Cb 0.00 -0.37 0.68 0.00 -1.01 0.00 0.00 64.21 63.51 1l5i n SER 98 CO 0.00 0.00 0.00 -0.78 -3.01 0.00 0.00 175.04 171.25 1l5i h ASP 99 N 0.03 0.00 -0.29 6.43 1.82 -2.01 1.76 116.42 124.16 1l5i h ASP 99 Ca 0.00 0.00 -0.07 0.00 -0.39 0.00 0.00 57.03 56.57 1l5i h ASP 99 Cb 0.41 0.00 -0.01 0.00 0.68 0.00 0.00 39.33 40.42 1l5i h ASP 99 CO 0.00 0.00 -0.08 -0.37 -1.61 0.00 0.00 179.24 177.18 1l5i h VAL 100 N 0.00 1.28 -0.94 2.25 -1.51 -1.92 -2.76 116.25 112.65 1l5i h VAL 100 Ca 0.57 -1.12 0.10 0.00 -1.23 0.00 0.00 66.70 65.02 1l5i h VAL 100 Cb 2.61 1.42 -0.08 0.00 -2.13 0.00 0.00 31.29 33.10 1l5i h VAL 100 CO -0.01 0.36 0.58 0.50 -1.23 0.00 0.00 177.57 177.77 1l5i h LYS 101 N 0.33 0.93 -0.75 5.19 3.11 0.24 0.22 116.57 125.82 1l5i h LYS 101 Ca 0.07 -0.06 0.05 0.00 -2.81 0.00 0.00 60.65 57.90 1l5i h LYS 101 Cb 0.57 -0.21 -0.05 0.00 -1.00 0.00 0.00 32.23 31.54 1l5i h LYS 101 CO 0.03 0.61 0.46 0.77 -2.81 0.00 0.00 179.45 178.52 1l5i h SER 102 N 0.95 0.74 0.31 4.20 0.02 -1.20 -1.32 113.55 117.24 1l5i h SER 102 Ca 0.46 0.01 -0.14 0.00 -0.84 0.00 0.00 61.79 61.28 1l5i h SER 102 Cb 0.40 -0.15 -0.01 0.00 0.14 0.00 0.00 62.40 62.79 1l5i h SER 102 CO -0.25 0.49 -0.55 0.22 -1.14 0.00 0.00 176.83 175.60 1l5i h TYR 103 N 0.88 0.33 -0.45 3.45 3.20 -0.72 -2.84 116.97 120.82 1l5i h TYR 103 Ca 0.32 -0.12 0.01 0.00 3.14 0.00 0.00 58.73 62.08 1l5i h TYR 103 Cb 0.09 -0.06 -0.02 0.00 1.54 0.00 0.00 36.73 38.28 1l5i h TYR 103 CO -0.04 0.76 0.30 0.82 -1.64 0.00 0.00 178.16 178.36 1l5i h ILE 104 N 0.20 1.10 -0.14 1.81 2.04 0.43 0.60 117.51 123.56 1l5i h ILE 104 Ca 0.00 -0.20 -0.08 0.00 1.00 0.00 0.00 64.86 65.58 1l5i h ILE 104 Cb 1.04 0.46 -0.01 0.00 -0.74 0.00 0.00 36.82 37.56 1l5i h ILE 104 CO 0.09 0.11 -0.26 -0.78 0.00 0.00 0.00 178.15 177.30 1l5i h ASP 105 N 0.59 0.24 0.00 1.72 1.82 -1.12 -3.30 116.42 116.37 1l5i h ASP 105 Ca 0.17 -0.07 -0.58 0.00 -0.39 0.00 0.00 57.03 56.16 1l5i h ASP 105 Cb -0.03 -0.07 0.03 0.00 0.68 0.00 0.00 39.33 39.94 1l5i h ASP 105 CO -0.04 0.51 2.53 0.29 -1.61 0.00 0.00 179.24 180.92 1l5i n LYS 106 N -4.15 1.89 -1.69 0.28 5.02 0.20 -4.87 118.16 114.84 1l5i n LYS 106 Ca -0.01 -1.83 -0.22 0.00 -2.02 0.00 0.00 58.31 54.23 1l5i n LYS 106 Cb 0.37 -2.82 0.15 0.00 -0.02 0.00 0.00 35.03 32.70 1l5i n LYS 106 CO 0.00 0.00 0.00 -0.40 -0.52 0.00 0.00 177.40 176.48 1l5i n ASP 107 N 6.27 0.33 0.00 4.39 5.68 -1.25 -5.03 116.55 126.95 1l5i n ASP 107 Ca 0.49 -1.52 0.00 0.00 -0.50 0.00 0.00 54.79 53.27 1l5i n ASP 107 Cb 0.32 -0.74 0.00 0.00 -1.14 0.00 0.00 41.12 39.56 1l5i n ASP 107 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1l5i n GLY 108 N -1.76 1.05 3.01 6.12 0.00 -1.26 -4.93 105.19 107.42 1l5i n GLY 108 Ca 0.13 0.04 -0.22 0.00 0.00 0.00 0.00 46.02 45.97 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 -6.10 -4.71 1.61 8.00 -1.26 -4.83 116.55 109.26 1l5i n ASP 109 Ca 0.00 -0.29 -0.23 0.00 0.71 0.00 0.00 54.79 54.98 1l5i n ASP 109 Cb 0.00 -4.91 -0.07 0.00 -0.02 0.00 0.00 41.12 36.12 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 -3.18 3.02 0.06 2.53 -7.23 -1.26 -4.59 120.40 109.76 1l5i s VAL 110 Ca 0.30 -1.76 0.02 0.00 -1.81 0.00 0.00 61.98 58.74 1l5i s VAL 110 Cb -0.13 -2.94 -0.04 0.00 0.56 0.00 0.00 36.38 33.83 1l5i s VAL 110 CO 0.38 -0.21 0.08 -0.22 -0.31 0.00 0.00 175.10 174.81 1l5i s LEU 111 N -3.80 3.80 -0.03 1.32 0.20 0.26 -5.02 118.68 115.41 1l5i s LEU 111 Ca 0.36 0.02 0.01 0.00 0.69 0.00 0.00 54.13 55.21 1l5i s LEU 111 Cb -0.03 -2.43 0.02 0.00 -0.43 0.00 0.00 46.19 43.33 1l5i s LEU 111 CO 0.22 0.19 -0.04 -0.70 -0.29 0.00 0.00 176.35 175.73 1l5i s GLU 112 N -2.24 0.66 0.03 1.98 -6.30 -1.26 -2.14 118.70 109.43 1l5i s GLU 112 Ca 0.28 -0.09 -0.02 0.00 -2.50 0.00 0.00 54.97 52.64 1l5i s GLU 112 Cb -0.12 -0.69 -0.02 0.00 0.00 0.00 0.00 34.13 33.30 1l5i s GLU 112 CO 0.20 -0.05 0.01 -0.46 0.02 0.00 0.00 175.26 174.98 1l5i s TRP 113 N 0.73 0.32 0.29 5.30 -0.00 -0.58 -5.03 118.94 119.96 1l5i s TRP 113 Ca -0.09 -0.68 0.00 0.00 -0.00 0.00 0.00 56.10 55.33 1l5i s TRP 113 Cb -0.12 -0.23 0.00 0.00 -0.00 0.00 0.00 33.47 33.11 1l5i s TRP 113 CO -0.00 -0.30 0.00 0.41 -0.00 0.00 0.00 176.95 177.05 1l5i n GLY 114 N 0.89 -1.93 3.08 5.86 0.00 -1.26 -0.16 105.19 111.66 1l5i n GLY 114 Ca -0.19 -1.23 -0.27 0.00 0.00 0.00 0.00 46.02 44.33 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 -2.19 1.38 0.38 2.61 2.01 -1.14 -4.60 115.64 114.08 1l5i s THR 115 Ca 0.00 -0.62 -0.23 0.00 0.31 0.00 0.00 61.69 61.15 1l5i s THR 115 Cb 0.00 -1.23 -0.10 0.00 0.01 0.00 0.00 72.50 71.17 1l5i s THR 115 CO 0.00 0.41 0.95 0.12 -0.69 0.00 0.00 174.62 175.40 1l5i s PHE 116 N 0.57 3.48 -0.16 4.92 2.19 -1.26 -3.37 117.98 124.35 1l5i s PHE 116 Ca -0.16 1.68 -0.02 0.00 0.33 0.00 0.00 56.93 58.77 1l5i s PHE 116 Cb -0.16 -2.88 0.05 0.00 -1.31 0.00 0.00 43.02 38.71 1l5i s PHE 116 CO 0.05 0.03 0.00 -0.65 1.83 0.00 0.00 175.22 176.49 1l5i s GLN 117 N -2.68 0.87 0.16 10.12 -0.21 -1.26 -4.99 119.66 121.67 1l5i s GLN 117 Ca 0.57 -0.33 -0.12 0.00 0.02 0.00 0.00 55.36 55.49 1l5i s GLN 117 Cb -0.13 -1.82 -0.07 0.00 1.00 0.00 0.00 33.01 31.99 1l5i s GLN 117 CO 0.18 -0.50 0.53 0.42 -2.12 0.00 0.00 175.29 173.80 1l5i s ILE 118 N 1.82 4.91 -0.06 1.08 1.01 -1.26 -5.05 121.20 123.64 1l5i s ILE 118 Ca 0.01 0.68 -0.27 0.00 0.00 0.00 0.00 60.65 61.07 1l5i s ILE 118 Cb -0.15 -3.69 -0.03 0.00 0.01 0.00 0.00 42.46 38.60 1l5i s ILE 118 CO -0.07 0.16 0.85 1.51 0.00 0.00 0.00 174.94 177.38 1l5i s ASP 119 N -1.91 7.15 0.00 3.58 -4.77 -1.26 -4.43 116.67 115.03 1l5i s ASP 119 Ca 0.40 1.39 0.00 0.00 -3.30 0.00 0.00 52.55 51.05 1l5i s ASP 119 Cb -0.14 -2.49 0.00 0.00 -1.09 0.00 0.00 42.92 39.20 1l5i s ASP 119 CO 0.20 -0.23 0.00 0.61 0.70 0.00 0.00 175.17 176.45 1l5i n GLY 120 N 3.07 1.61 0.00 2.12 0.00 -1.26 -5.14 105.19 105.59 1l5i n GLY 120 Ca 0.03 -0.73 0.00 0.00 0.00 0.00 0.00 46.02 45.32 1l5i n GLY 120 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19