#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 1.99 3.11 0.23 0.00 -1.26 -5.18 105.19 104.08 1l5i n GLY 5 Ca 0.00 -1.20 -0.18 0.00 0.00 0.00 0.00 46.02 44.64 1l5i n GLY 5 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1l5i s ARG 6 N -2.10 0.82 -0.67 1.61 3.00 -1.26 -5.09 118.95 115.25 1l5i s ARG 6 Ca 0.06 -0.70 -0.27 0.00 0.00 0.00 0.00 55.73 54.82 1l5i s ARG 6 Cb -0.01 -0.78 0.02 0.00 0.00 0.00 0.00 34.95 34.18 1l5i s ARG 6 CO 0.05 0.19 1.36 0.12 0.00 0.00 0.00 175.30 177.02 1l5i s PHE 7 N -0.86 2.25 -0.10 -0.53 5.36 -1.26 -4.96 117.98 117.88 1l5i s PHE 7 Ca -0.00 0.20 -0.01 0.00 -0.96 0.00 0.00 56.93 56.16 1l5i s PHE 7 Cb -0.08 -4.51 0.03 0.00 -0.34 0.00 0.00 43.02 38.13 1l5i s PHE 7 CO 0.01 -2.02 -0.02 0.45 -1.46 0.00 0.00 175.22 172.19 1l5i s SER 8 N 4.25 1.99 -0.10 6.13 0.15 -1.26 -4.19 113.70 120.66 1l5i s SER 8 Ca 0.43 -0.27 -0.01 0.00 0.70 0.00 0.00 55.95 56.80 1l5i s SER 8 Cb -0.09 -0.59 -0.03 0.00 -1.71 0.00 0.00 66.02 63.61 1l5i s SER 8 CO 0.19 -0.19 -0.08 -0.63 1.20 0.00 0.00 173.24 173.73 1l5i s ILE 9 N 1.87 3.60 -0.18 6.45 1.01 -1.12 -4.90 121.20 127.93 1l5i s ILE 9 Ca 0.04 -0.49 -0.03 0.00 0.00 0.00 0.00 60.65 60.17 1l5i s ILE 9 Cb -0.13 -2.51 0.06 0.00 0.01 0.00 0.00 42.46 39.89 1l5i s ILE 9 CO -0.06 0.55 0.03 -0.54 0.00 0.00 0.00 174.94 174.92 1l5i s LYS 10 N -0.24 0.66 0.15 2.79 1.02 -1.26 0.73 119.74 123.59 1l5i s LYS 10 Ca 0.03 -0.37 -0.24 0.00 0.02 0.00 0.00 55.97 55.41 1l5i s LYS 10 Cb -0.13 -1.99 0.07 0.00 -0.52 0.00 0.00 37.83 35.25 1l5i s LYS 10 CO 0.03 -0.60 0.73 0.00 -0.92 0.00 0.00 175.35 174.59 1l5i s ALA 11 N 1.87 -1.57 -0.12 5.17 0.00 -0.86 -4.96 121.76 121.28 1l5i s ALA 11 Ca -0.00 0.39 0.16 0.00 0.00 0.00 0.00 51.96 52.51 1l5i s ALA 11 Cb -0.17 0.75 -0.09 0.00 0.00 0.00 0.00 23.12 23.61 1l5i s ALA 11 CO -0.08 -0.84 0.98 1.57 0.00 0.00 0.00 175.76 177.39 1l5i h LYS 12 N 2.00 0.00 -6.37 0.00 5.09 -1.83 0.19 116.57 115.65 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 -0.29 0.00 0.10 0.00 0.00 32.23 33.31 1l5i h LYS 12 CO 0.32 0.35 -0.86 -0.80 -2.09 0.00 0.00 179.45 176.37 1l5i s ASN 13 N -5.96 3.27 0.01 7.07 0.01 -1.25 -0.82 114.94 117.27 1l5i s ASN 13 Ca -0.01 -0.42 0.03 0.00 -0.71 0.00 0.00 52.86 51.74 1l5i s ASN 13 Cb 0.08 -0.60 -0.01 0.00 0.41 0.00 0.00 41.25 41.14 1l5i s ASN 13 CO 0.80 0.30 -0.10 -0.31 -1.51 0.00 0.00 177.10 176.28 1l5i s TYR 14 N -0.50 0.87 -0.15 2.20 2.02 -0.40 -0.37 117.35 121.03 1l5i s TYR 14 Ca 0.06 -0.22 0.02 0.00 -0.37 0.00 0.00 57.07 56.57 1l5i s TYR 14 Cb -0.11 -0.55 0.01 0.00 -0.40 0.00 0.00 41.96 40.92 1l5i s TYR 14 CO 0.01 -0.01 -0.21 -0.06 -1.57 0.00 0.00 175.55 173.71 1l5i s PHE 15 N -0.42 2.65 -0.15 2.71 0.08 0.68 -2.10 117.98 121.42 1l5i s PHE 15 Ca 0.02 -1.40 -0.05 0.00 0.12 0.00 0.00 56.93 55.62 1l5i s PHE 15 Cb -0.05 -1.82 -0.03 0.00 -0.57 0.00 0.00 43.02 40.55 1l5i s PHE 15 CO -0.00 -0.66 0.02 -0.51 -0.10 0.00 0.00 175.22 173.97 1l5i s LEU 16 N 0.97 3.60 -0.16 -0.37 2.01 -0.85 -1.56 118.68 122.32 1l5i s LEU 16 Ca -0.03 0.04 0.01 0.00 0.01 0.00 0.00 54.13 54.15 1l5i s LEU 16 Cb -0.15 -1.88 0.02 0.00 0.01 0.00 0.00 46.19 44.19 1l5i s LEU 16 CO -0.05 0.22 -0.20 -0.89 1.01 0.00 0.00 176.35 176.44 1l5i s THR 17 N 0.08 1.99 -0.43 5.49 2.01 -0.98 -2.17 115.64 121.63 1l5i s THR 17 Ca 0.03 -0.91 -0.07 0.00 0.31 0.00 0.00 61.69 61.05 1l5i s THR 17 Cb -0.13 -1.79 0.10 0.00 0.01 0.00 0.00 72.50 70.69 1l5i s THR 17 CO 0.02 0.53 0.27 -0.31 -0.69 0.00 0.00 174.62 174.43 1l5i s TYR 18 N 1.18 3.44 0.18 4.92 1.51 -0.86 -1.21 117.35 126.50 1l5i s TYR 18 Ca 0.01 -1.94 -0.30 0.00 -1.01 0.00 0.00 57.07 53.83 1l5i s TYR 18 Cb -0.14 -3.21 -0.08 0.00 -0.11 0.00 0.00 41.96 38.42 1l5i s TYR 18 CO -0.09 -0.94 1.12 -1.25 -1.11 0.00 0.00 175.55 173.27 1l5i s PRO 19 N 1.31 4.57 -1.39 -1.71 0.04 -1.26 -2.14 135.00 134.42 1l5i s PRO 19 Ca 0.05 1.74 -0.13 0.00 0.04 0.00 0.00 61.00 62.71 1l5i s PRO 19 Cb -0.24 -3.27 0.02 0.00 0.04 0.00 0.00 34.50 31.04 1l5i s PRO 19 CO -0.01 0.04 0.24 1.17 0.04 0.00 0.00 177.00 178.48 1l5i n LYS 20 N 2.42 -0.67 -4.17 4.56 4.81 -0.49 -4.90 118.16 119.71 1l5i n LYS 20 Ca 0.03 0.07 -0.34 0.00 -0.87 0.00 0.00 58.31 57.20 1l5i n LYS 20 Cb 0.46 -3.07 -0.14 0.00 0.02 0.00 0.00 35.03 32.30 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 4.36 1.75 -4.74 0.00 -0.08 -1.26 -4.39 116.55 112.18 1l5i n ASP 22 Ca -0.18 -2.11 -0.41 0.00 -1.51 0.00 0.00 54.79 50.58 1l5i n ASP 22 Cb 0.51 -0.30 -0.03 0.00 2.34 0.00 0.00 41.12 43.64 1l5i n ASP 22 CO 0.00 0.00 0.00 -0.22 0.12 0.00 0.00 177.20 177.10 1l5i s LEU 23 N -0.97 4.43 0.54 -2.67 2.96 -1.26 -5.02 118.68 116.70 1l5i s LEU 23 Ca 0.17 2.32 -0.06 0.00 -0.22 0.00 0.00 54.13 56.34 1l5i s LEU 23 Cb 0.10 -3.61 -0.01 0.00 0.50 0.00 0.00 46.19 43.17 1l5i s LEU 23 CO 0.09 -0.44 0.85 0.42 -1.32 0.00 0.00 176.35 175.95 1l5i s THR 24 N -0.01 4.25 0.29 3.68 -4.23 -1.26 -4.91 115.64 113.44 1l5i s THR 24 Ca 0.54 0.12 0.16 0.00 -1.18 0.00 0.00 61.69 61.33 1l5i s THR 24 Cb -0.34 -3.65 0.10 0.00 1.34 0.00 0.00 72.50 69.95 1l5i s THR 24 CO 0.38 -0.66 1.77 0.07 -0.54 0.00 0.00 174.62 175.64 1l5i h LYS 25 N 0.00 0.00 -0.15 3.99 2.10 -1.95 -1.08 116.57 119.48 1l5i h LYS 25 Ca -0.46 0.00 -0.02 0.00 -2.00 0.00 0.00 60.65 58.17 1l5i h LYS 25 Cb 1.23 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 32.56 1l5i h LYS 25 CO 0.61 0.40 0.01 1.49 -2.00 0.00 0.00 179.45 179.97 1l5i h GLU 26 N 0.00 0.26 -0.33 0.07 4.81 -1.97 1.50 114.58 118.93 1l5i h GLU 26 Ca -0.00 -0.08 -0.08 0.00 -0.13 0.00 0.00 59.36 59.07 1l5i h GLU 26 Cb 0.80 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 30.14 1l5i h GLU 26 CO 0.05 0.46 -0.09 -0.91 -0.73 0.00 0.00 179.01 177.80 1l5i h ASN 27 N 0.02 0.65 -0.14 1.04 -0.26 -1.92 0.37 115.58 115.33 1l5i h ASN 27 Ca 0.04 -0.37 -0.11 0.00 -0.56 0.00 0.00 56.30 55.31 1l5i h ASN 27 Cb 0.34 -0.18 -0.01 0.00 -1.06 0.00 0.00 38.32 37.41 1l5i h ASN 27 CO 0.01 0.87 -0.26 0.00 -1.06 0.00 0.00 177.43 176.99 1l5i h ALA 28 N 0.80 0.98 -0.35 -0.83 0.00 -1.12 0.30 119.26 119.04 1l5i h ALA 28 Ca 0.08 -0.37 -0.13 0.00 0.00 0.00 0.00 54.91 54.49 1l5i h ALA 28 Cb 0.59 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.24 1l5i h ALA 28 CO 0.03 0.60 -0.29 1.25 0.00 0.00 0.00 179.25 180.84 1l5i h LEU 29 N 0.53 0.87 -0.26 0.00 7.12 0.24 0.73 115.31 124.53 1l5i h LEU 29 Ca 0.07 -0.45 -0.07 0.00 0.13 0.00 0.00 57.88 57.56 1l5i h LEU 29 Cb 0.72 -0.24 -0.01 0.00 -0.53 0.00 0.00 40.66 40.60 1l5i h LEU 29 CO 0.06 1.13 -0.11 0.77 -0.13 0.00 0.00 178.44 180.16 1l5i h SER 30 N 0.61 0.55 -0.09 1.25 4.64 -0.01 0.57 113.55 121.08 1l5i h SER 30 Ca 0.06 -0.40 -0.03 0.00 -0.47 0.00 0.00 61.79 60.96 1l5i h SER 30 Cb 0.86 -0.15 -0.00 0.00 -0.31 0.00 0.00 62.40 62.80 1l5i h SER 30 CO 0.07 0.83 -0.05 1.56 -0.87 0.00 0.00 176.83 178.37 1l5i h GLN 31 N 0.28 0.19 -0.34 4.77 4.20 -0.36 0.24 115.11 124.08 1l5i h GLN 31 Ca 0.06 -0.08 -0.01 0.00 0.06 0.00 0.00 58.65 58.67 1l5i h GLN 31 Cb 0.61 -0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.37 1l5i h GLN 31 CO 0.03 0.55 0.15 0.82 -0.67 0.00 0.00 178.83 179.72 1l5i h ILE 32 N -0.18 1.17 -0.73 2.54 1.08 0.48 0.65 117.51 122.52 1l5i h ILE 32 Ca 0.02 -0.50 -0.04 0.00 -0.39 0.00 0.00 64.86 63.95 1l5i h ILE 32 Cb 0.50 0.87 -0.03 0.00 -3.07 0.00 0.00 36.82 35.09 1l5i h ILE 32 CO 0.01 0.18 0.30 0.74 -0.69 0.00 0.00 178.15 178.69 1l5i h THR 33 N 0.41 1.24 -0.00 -0.27 2.02 0.18 -0.42 112.91 116.06 1l5i h THR 33 Ca 0.12 -0.75 0.00 0.00 0.77 0.00 0.00 66.41 66.54 1l5i h THR 33 Cb 0.14 0.37 0.00 0.00 -1.74 0.00 0.00 68.15 66.92 1l5i h THR 33 CO -0.01 0.31 -0.07 0.59 0.37 0.00 0.00 175.52 176.71 1l5i n ASN 34 N -4.30 0.15 -4.65 4.18 3.02 0.84 -4.76 115.26 109.74 1l5i n ASN 34 Ca 0.07 -0.07 -0.43 0.00 -0.03 0.00 0.00 54.58 54.12 1l5i n ASN 34 Cb 0.17 -0.25 -0.02 0.00 -0.61 0.00 0.00 39.78 39.07 1l5i n ASN 34 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 1l5i s LEU 35 N -2.71 4.09 0.69 3.41 2.96 0.22 -5.00 118.68 122.34 1l5i s LEU 35 Ca 0.23 1.58 -0.11 0.00 -0.22 0.00 0.00 54.13 55.61 1l5i s LEU 35 Cb 0.20 -3.54 0.00 0.00 0.50 0.00 0.00 46.19 43.35 1l5i s LEU 35 CO 0.50 -0.89 1.07 -1.58 -1.32 0.00 0.00 176.35 174.13 1l5i s GLN 36 N 3.79 2.98 0.03 1.98 0.74 -1.26 -4.96 119.66 122.96 1l5i s GLN 36 Ca 0.57 0.72 -0.12 0.00 0.05 0.00 0.00 55.36 56.58 1l5i s GLN 36 Cb -0.21 -2.01 0.01 0.00 1.10 0.00 0.00 33.01 31.90 1l5i s GLN 36 CO 0.19 -1.00 0.25 -0.08 -0.55 0.00 0.00 175.29 174.09 1l5i s THR 37 N -3.18 0.09 -1.71 -0.34 -1.32 -1.26 -5.02 115.64 102.89 1l5i s THR 37 Ca 0.58 -0.73 0.23 0.00 -1.21 0.00 0.00 61.69 60.56 1l5i s THR 37 Cb -0.12 -0.83 0.54 0.00 -1.51 0.00 0.00 72.50 70.57 1l5i s THR 37 CO 0.54 -0.40 1.76 -0.81 -2.21 0.00 0.00 174.62 173.50 1l5i n PRO 38 N 0.81 0.53 0.00 7.08 -0.04 -1.26 -4.56 135.00 137.57 1l5i n PRO 38 Ca -0.20 0.04 0.00 0.00 -0.04 0.00 0.00 63.50 63.30 1l5i n PRO 38 Cb 0.58 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.54 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 -1.14 0.00 -3.64 0.52 5.66 -1.26 -5.12 114.28 109.30 1l5i n THR 39 Ca 0.14 0.00 -0.05 0.00 -3.05 0.00 0.00 64.05 61.09 1l5i n THR 39 Cb 0.13 0.00 -0.07 0.00 -1.55 0.00 0.00 70.33 68.84 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 0.53 -0.39 -0.27 1.09 2.47 -1.26 -4.98 114.94 112.13 1l5i s ASN 40 Ca 0.00 0.69 -0.20 0.00 0.42 0.00 0.00 52.86 53.78 1l5i s ASN 40 Cb 0.00 0.88 -0.02 0.00 -1.45 0.00 0.00 41.25 40.66 1l5i s ASN 40 CO 0.00 -0.12 0.61 -0.54 -3.72 0.00 0.00 177.10 173.33 1l5i s LYS 41 N 0.61 4.04 0.00 0.43 1.02 -1.26 -1.61 119.74 122.97 1l5i s LYS 41 Ca -0.01 0.43 0.00 0.00 0.02 0.00 0.00 55.97 56.41 1l5i s LYS 41 Cb -0.04 -3.67 0.00 0.00 -0.52 0.00 0.00 37.83 33.59 1l5i s LYS 41 CO -0.11 -0.45 0.00 -0.11 -0.92 0.00 0.00 175.35 173.77 1l5i n LEU 42 N 5.73 0.36 -4.86 3.17 7.94 -0.98 -4.91 117.00 123.45 1l5i n LEU 42 Ca -0.01 0.00 -0.28 0.00 -1.11 0.00 0.00 56.01 54.61 1l5i n LEU 42 Cb 0.49 0.00 -0.05 0.00 0.53 0.00 0.00 43.42 44.39 1l5i n LEU 42 CO 0.43 0.00 -0.18 0.12 -1.11 0.00 0.00 177.39 176.65 1l5i s PHE 43 N 0.00 3.32 -0.12 1.96 5.36 -1.14 -3.66 117.98 123.70 1l5i s PHE 43 Ca 0.00 0.09 -0.04 0.00 -0.96 0.00 0.00 56.93 56.02 1l5i s PHE 43 Cb 0.00 -1.62 0.06 0.00 -0.34 0.00 0.00 43.02 41.12 1l5i s PHE 43 CO 0.00 0.53 0.17 0.42 -1.46 0.00 0.00 175.22 174.88 1l5i s ILE 44 N -1.63 -0.26 -0.13 3.12 1.01 -0.35 -2.34 121.20 120.60 1l5i s ILE 44 Ca 0.32 0.19 0.02 0.00 0.00 0.00 0.00 60.65 61.19 1l5i s ILE 44 Cb -0.11 -0.42 0.01 0.00 0.01 0.00 0.00 42.46 41.94 1l5i s ILE 44 CO 0.25 0.02 -0.21 -0.75 0.00 0.00 0.00 174.94 174.26 1l5i s LYS 45 N 2.29 3.07 -0.17 2.79 2.47 0.61 -1.44 119.74 129.36 1l5i s LYS 45 Ca 0.04 -0.84 -0.00 0.00 -1.56 0.00 0.00 55.97 53.61 1l5i s LYS 45 Cb -0.13 -2.45 0.04 0.00 -1.46 0.00 0.00 37.83 33.83 1l5i s LYS 45 CO -0.08 0.04 -0.05 0.42 0.16 0.00 0.00 175.35 175.84 1l5i s ILE 46 N 0.71 1.14 -0.02 5.43 1.01 -0.98 0.21 121.20 128.70 1l5i s ILE 46 Ca -0.09 -0.70 0.05 0.00 0.00 0.00 0.00 60.65 59.91 1l5i s ILE 46 Cb -0.16 -1.34 -0.01 0.00 0.01 0.00 0.00 42.46 40.96 1l5i s ILE 46 CO 0.01 0.09 -0.18 0.00 0.00 0.00 0.00 174.94 174.86 1l5i s ARG 48 N -0.28 3.21 -0.13 0.00 3.52 -1.26 -0.27 118.95 123.74 1l5i s ARG 48 Ca 0.04 -0.31 -0.09 0.00 -0.13 0.00 0.00 55.73 55.24 1l5i s ARG 48 Cb -0.09 -2.98 0.04 0.00 -1.56 0.00 0.00 34.95 30.37 1l5i s ARG 48 CO 0.00 0.72 0.33 -2.00 -0.81 0.00 0.00 175.30 173.54 1l5i s GLU 49 N -1.20 0.33 -0.14 5.12 2.56 -0.97 -4.93 118.70 119.47 1l5i s GLU 49 Ca 0.17 0.58 -0.10 0.00 0.00 0.00 0.00 54.97 55.63 1l5i s GLU 49 Cb -0.12 0.02 -0.05 0.00 2.00 0.00 0.00 34.13 35.99 1l5i s GLU 49 CO 0.07 -0.12 0.19 -0.51 -0.56 0.00 0.00 175.26 174.33 1l5i s LEU 50 N 0.90 4.32 0.55 2.70 1.02 -1.26 -1.86 118.68 125.04 1l5i s LEU 50 Ca -0.06 0.45 -0.12 0.00 0.02 0.00 0.00 54.13 54.42 1l5i s LEU 50 Cb -0.07 -2.18 -0.05 0.00 0.02 0.00 0.00 46.19 43.91 1l5i s LEU 50 CO -0.07 0.28 0.96 -1.00 0.02 0.00 0.00 176.35 176.54 1l5i s HIS 51 N -0.34 3.55 -1.45 0.29 3.76 -0.75 -4.92 115.29 115.42 1l5i s HIS 51 Ca 0.14 1.26 0.13 0.00 -0.15 0.00 0.00 55.06 56.43 1l5i s HIS 51 Cb -0.12 -2.66 0.65 0.00 1.11 0.00 0.00 32.58 31.56 1l5i s HIS 51 CO 0.03 -0.48 1.32 -0.85 -0.85 0.00 0.00 174.74 173.91 1l5i n GLU 52 N -2.17 0.19 0.00 1.40 0.28 -1.26 -1.39 120.64 117.69 1l5i n GLU 52 Ca 0.05 0.16 0.16 0.00 -0.16 0.00 0.00 57.16 57.36 1l5i n GLU 52 Cb 0.54 -1.50 0.86 0.00 1.43 0.00 0.00 31.44 32.77 1l5i n GLU 52 CO 0.00 0.00 0.00 0.09 -0.16 0.00 0.00 177.13 177.06 1l5i n ASN 53 N -1.27 0.16 0.00 -1.84 4.13 -1.26 -4.85 115.26 110.32 1l5i n ASN 53 Ca 0.06 -0.86 0.00 0.00 1.68 0.00 0.00 54.58 55.46 1l5i n ASN 53 Cb 0.10 -0.05 0.00 0.00 -1.54 0.00 0.00 39.78 38.28 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 1.08 0.78 3.77 7.41 0.00 -0.49 -5.01 105.19 112.73 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 -0.03 4.06 -0.09 1.61 4.04 -1.25 -4.95 118.70 122.09 1l5i s GLU 55 Ca 0.00 0.14 -0.30 0.00 0.04 0.00 0.00 54.97 54.85 1l5i s GLU 55 Cb 0.00 -3.35 -0.03 0.00 0.02 0.00 0.00 34.13 30.78 1l5i s GLU 55 CO 0.00 0.41 1.24 -1.25 -1.84 0.00 0.00 175.26 173.82 1l5i s PRO 56 N -0.08 4.30 0.20 -4.83 0.04 -1.26 -1.81 135.00 131.55 1l5i s PRO 56 Ca 0.18 1.69 0.10 0.00 0.04 0.00 0.00 61.00 63.01 1l5i s PRO 56 Cb -0.14 -3.64 -0.04 0.00 0.04 0.00 0.00 34.50 30.72 1l5i s PRO 56 CO 0.06 -0.55 -0.12 -1.58 0.04 0.00 0.00 177.00 174.84 1l5i s HIS 57 N 2.71 2.54 -0.03 0.56 2.46 -0.78 0.53 115.29 123.29 1l5i s HIS 57 Ca 0.56 -0.26 0.02 0.00 0.47 0.00 0.00 55.06 55.86 1l5i s HIS 57 Cb -0.24 -1.23 0.00 0.00 -0.13 0.00 0.00 32.58 30.99 1l5i s HIS 57 CO 0.20 0.53 -0.09 -1.17 -2.47 0.00 0.00 174.74 171.74 1l5i s LEU 58 N -2.92 1.76 -0.00 8.88 1.98 -0.91 -2.29 118.68 125.17 1l5i s LEU 58 Ca 0.25 -0.18 0.04 0.00 -2.89 0.00 0.00 54.13 51.35 1l5i s LEU 58 Cb -0.08 -0.54 -0.03 0.00 0.66 0.00 0.00 46.19 46.19 1l5i s LEU 58 CO 0.14 0.06 -0.12 -1.00 -1.89 0.00 0.00 176.35 173.54 1l5i s HIS 59 N 0.25 2.74 -0.04 5.38 3.76 0.63 -2.03 115.29 125.98 1l5i s HIS 59 Ca -0.04 -0.13 -0.03 0.00 -0.15 0.00 0.00 55.06 54.71 1l5i s HIS 59 Cb -0.09 -1.58 0.02 0.00 1.11 0.00 0.00 32.58 32.04 1l5i s HIS 59 CO 0.01 0.28 0.10 0.42 -0.85 0.00 0.00 174.74 174.69 1l5i s ILE 60 N -0.89 -0.02 -0.18 0.60 1.01 -0.92 -1.71 121.20 119.09 1l5i s ILE 60 Ca 0.15 0.06 -0.04 0.00 0.00 0.00 0.00 60.65 60.81 1l5i s ILE 60 Cb -0.11 -0.15 0.06 0.00 0.01 0.00 0.00 42.46 42.27 1l5i s ILE 60 CO 0.05 0.02 0.08 -0.22 0.00 0.00 0.00 174.94 174.87 1l5i s LEU 61 N 0.37 0.55 0.11 2.97 1.98 0.13 -2.00 118.68 122.79 1l5i s LEU 61 Ca -0.03 -0.68 0.11 0.00 -2.89 0.00 0.00 54.13 50.64 1l5i s LEU 61 Cb -0.04 -0.33 -0.04 0.00 0.66 0.00 0.00 46.19 46.44 1l5i s LEU 61 CO -0.01 -0.34 -0.27 -0.63 -1.89 0.00 0.00 176.35 173.21 1l5i s ILE 62 N 2.07 2.22 -0.10 6.68 1.01 -0.89 -0.28 121.20 131.91 1l5i s ILE 62 Ca 0.01 -1.66 -0.02 0.00 0.00 0.00 0.00 60.65 58.98 1l5i s ILE 62 Cb -0.16 -1.95 0.04 0.00 0.01 0.00 0.00 42.46 40.40 1l5i s ILE 62 CO -0.09 0.16 0.04 0.00 0.00 0.00 0.00 174.94 175.05 1l5i s GLN 63 N -1.83 0.35 0.35 2.79 1.03 -0.99 -1.27 119.66 120.08 1l5i s GLN 63 Ca 0.13 0.06 -0.06 0.00 0.04 0.00 0.00 55.36 55.54 1l5i s GLN 63 Cb -0.10 -1.17 -0.05 0.00 0.03 0.00 0.00 33.01 31.72 1l5i s GLN 63 CO 0.05 -0.42 0.63 -0.06 -2.54 0.00 0.00 175.29 172.95 1l5i s PHE 64 N 2.03 3.49 0.40 9.60 0.40 0.00 -2.32 117.98 131.58 1l5i s PHE 64 Ca 0.04 0.73 0.08 0.00 -0.60 0.00 0.00 56.93 57.17 1l5i s PHE 64 Cb -0.14 -2.19 0.82 0.00 0.51 0.00 0.00 43.02 42.02 1l5i s PHE 64 CO -0.06 0.04 1.99 1.49 0.70 0.00 0.00 175.22 179.39 1l5i h GLU 65 N 1.29 0.43 -6.19 0.44 4.22 -1.61 -3.43 114.58 109.71 1l5i h GLU 65 Ca -0.48 -0.05 -0.59 0.00 0.08 0.00 0.00 59.36 58.32 1l5i h GLU 65 Cb 1.19 -0.08 -0.16 0.00 0.50 0.00 0.00 28.75 30.21 1l5i h GLU 65 CO 0.64 0.38 -0.77 0.20 -2.18 0.00 0.00 179.01 177.28 1l5i s GLY 66 N -3.83 1.73 -0.16 1.92 0.00 -1.26 -5.04 107.32 100.67 1l5i s GLY 66 Ca -0.07 -1.75 -0.29 0.00 0.00 0.00 0.00 44.72 42.61 1l5i s GLY 66 CO 0.73 -1.82 2.16 0.28 0.00 0.00 0.00 173.10 174.45 1l5i n LYS 67 N -0.27 2.13 -3.21 2.90 5.02 -1.26 -4.66 118.16 118.80 1l5i n LYS 67 Ca -0.08 0.65 -0.39 0.00 -2.02 0.00 0.00 58.31 56.47 1l5i n LYS 67 Cb 0.59 -3.13 -0.06 0.00 -0.02 0.00 0.00 35.03 32.40 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 7.30 3.81 -0.41 2.13 5.04 0.67 -4.79 117.35 131.10 1l5i s TYR 68 Ca 0.98 1.33 -0.15 0.00 -2.44 0.00 0.00 57.07 56.80 1l5i s TYR 68 Cb -0.39 -2.56 0.03 0.00 0.35 0.00 0.00 41.96 39.38 1l5i s TYR 68 CO 0.38 0.54 0.30 1.21 -1.34 0.00 0.00 175.55 176.64 1l5i s ASN 69 N -0.98 6.07 -0.93 4.32 3.04 -1.26 -2.04 114.94 123.17 1l5i s ASN 69 Ca 0.30 -0.95 -0.01 0.00 0.04 0.00 0.00 52.86 52.25 1l5i s ASN 69 Cb -0.20 -2.15 0.29 0.00 -1.54 0.00 0.00 41.25 37.65 1l5i s ASN 69 CO 0.20 -0.46 1.24 0.00 -3.04 0.00 0.00 177.10 175.04 1l5i n THR 71 N 1.13 2.88 -3.62 0.00 5.66 -1.26 -2.79 114.28 116.28 1l5i n THR 71 Ca 0.28 -1.71 -0.04 0.00 -3.05 0.00 0.00 64.05 59.53 1l5i n THR 71 Cb 0.36 -0.67 -0.06 0.00 -1.55 0.00 0.00 70.33 68.40 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 -0.91 -0.88 -0.24 1.09 3.84 -1.26 -4.72 114.94 111.85 1l5i s ASN 72 Ca 0.47 1.34 -0.00 0.00 0.21 0.00 0.00 52.86 54.89 1l5i s ASN 72 Cb 0.39 1.58 0.21 0.00 -0.55 0.00 0.00 41.25 42.89 1l5i s ASN 72 CO 0.07 -0.20 1.81 0.00 -2.79 0.00 0.00 177.10 175.99 1l5i n GLN 73 N 4.51 1.63 -0.00 0.43 10.64 -1.26 -3.50 117.38 129.82 1l5i n GLN 73 Ca -0.17 -1.31 0.02 0.00 -1.83 0.00 0.00 57.00 53.71 1l5i n GLN 73 Cb 0.56 -1.51 -0.03 0.00 -0.86 0.00 0.00 30.24 28.40 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 0.29 3.45 0.07 2.61 5.12 -1.26 -4.45 116.66 122.50 1l5i n ARG 74 Ca 0.25 -0.02 -0.22 0.00 -1.93 0.00 0.00 57.85 55.94 1l5i n ARG 74 Cb 0.70 -0.85 -0.12 0.00 -1.16 0.00 0.00 32.46 31.02 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 1.00 -0.35 -1.55 3.04 -2.01 -3.17 116.94 113.89 1l5i h PHE 75 Ca 0.00 -0.60 0.00 0.00 3.98 0.00 0.00 57.97 61.35 1l5i h PHE 75 Cb 0.13 -0.09 0.00 0.00 2.56 0.00 0.00 35.95 38.55 1l5i h PHE 75 CO 0.00 1.44 0.00 1.19 -2.02 0.00 0.00 178.31 178.92 1l5i n PHE 76 N -3.84 0.74 -1.87 0.41 3.72 -1.26 -4.87 117.46 110.49 1l5i n PHE 76 Ca -0.13 -0.30 -0.41 0.00 -0.05 0.00 0.00 57.45 56.56 1l5i n PHE 76 Cb 0.94 -0.13 -0.03 0.00 -0.94 0.00 0.00 39.48 39.33 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 -0.76 5.46 -0.10 4.37 1.01 -1.20 -4.45 116.67 120.99 1l5i s ASP 77 Ca 0.26 1.16 -0.01 0.00 0.71 0.00 0.00 52.55 54.67 1l5i s ASP 77 Cb 0.17 -2.52 -0.03 0.00 1.01 0.00 0.00 42.92 41.55 1l5i s ASP 77 CO 0.14 -2.08 -0.04 -0.76 0.21 0.00 0.00 175.17 172.64 1l5i s LEU 78 N 8.43 3.31 0.29 1.23 1.43 -0.90 -4.99 118.68 127.48 1l5i s LEU 78 Ca 0.83 -0.01 0.08 0.00 -1.03 0.00 0.00 54.13 54.00 1l5i s LEU 78 Cb -0.21 -1.75 -0.06 0.00 0.03 0.00 0.00 46.19 44.19 1l5i s LEU 78 CO 0.30 0.30 -0.09 0.68 0.23 0.00 0.00 176.35 177.77 1l5i s VAL 79 N -0.43 1.92 -0.26 -1.59 -7.23 -1.26 0.43 120.40 111.97 1l5i s VAL 79 Ca 0.07 -2.19 -0.24 0.00 -1.81 0.00 0.00 61.98 57.82 1l5i s VAL 79 Cb -0.12 -2.46 -0.01 0.00 0.56 0.00 0.00 36.38 34.35 1l5i s VAL 79 CO 0.02 -0.31 0.80 -0.55 -0.31 0.00 0.00 175.10 174.75 1l5i s SER 80 N -3.49 6.76 0.00 4.85 0.15 -0.19 -4.90 113.70 116.88 1l5i s SER 80 Ca 0.30 0.91 0.23 0.00 0.70 0.00 0.00 55.95 58.09 1l5i s SER 80 Cb 0.02 -2.42 1.21 0.00 -1.71 0.00 0.00 66.02 63.12 1l5i s SER 80 CO 0.13 -0.52 1.75 -0.81 1.20 0.00 0.00 173.24 174.99 1l5i n PRO 81 N 6.02 0.42 -0.01 5.44 -0.04 -1.26 -2.55 135.00 143.02 1l5i n PRO 81 Ca 0.04 0.06 0.04 0.00 -0.04 0.00 0.00 63.50 63.60 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 -2.37 -0.04 0.00 0.00 175.50 173.09 1l5i n THR 82 N -1.22 0.02 -4.26 0.52 5.66 -1.26 -5.00 114.28 108.73 1l5i n THR 82 Ca 0.12 -0.20 -0.17 0.00 -3.05 0.00 0.00 64.05 60.75 1l5i n THR 82 Cb 0.16 0.27 -0.14 0.00 -1.55 0.00 0.00 70.33 69.07 1l5i n THR 82 CO 0.00 0.00 0.00 -0.60 -3.05 0.00 0.00 175.07 171.42 1l5i s ARG 83 N -2.59 0.69 -0.69 1.09 3.52 -1.06 -5.03 118.95 114.87 1l5i s ARG 83 Ca -0.03 -0.51 -0.07 0.00 -0.13 0.00 0.00 55.73 54.99 1l5i s ARG 83 Cb 0.05 -0.63 -0.16 0.00 -1.56 0.00 0.00 34.95 32.66 1l5i s ARG 83 CO 0.36 0.16 2.95 0.43 -0.81 0.00 0.00 175.30 178.39 1l5i n SER 84 N 2.32 6.03 -4.06 -2.12 7.64 -1.26 -3.81 113.62 118.35 1l5i n SER 84 Ca -0.17 -2.42 -0.23 0.00 1.01 0.00 0.00 58.87 57.06 1l5i n SER 84 Cb 0.56 -1.32 -0.16 0.00 -1.01 0.00 0.00 64.21 62.28 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 1.91 1.21 0.01 -0.43 0.00 -1.26 -5.04 121.76 118.16 1l5i s ALA 85 Ca 0.59 -0.50 -0.01 0.00 0.00 0.00 0.00 51.96 52.04 1l5i s ALA 85 Cb 0.22 -0.44 -0.04 0.00 0.00 0.00 0.00 23.12 22.86 1l5i s ALA 85 CO -0.03 0.19 0.14 -1.01 0.00 0.00 0.00 175.76 175.06 1l5i s HIS 86 N 0.20 3.42 -0.06 0.00 3.76 -1.26 -1.02 115.29 120.33 1l5i s HIS 86 Ca -0.05 0.27 0.03 0.00 -0.15 0.00 0.00 55.06 55.16 1l5i s HIS 86 Cb -0.11 -1.77 0.00 0.00 1.11 0.00 0.00 32.58 31.82 1l5i s HIS 86 CO 0.02 0.60 -0.16 -0.06 -0.85 0.00 0.00 174.74 174.28 1l5i s PHE 87 N -1.31 1.71 -0.41 1.40 0.08 0.17 -4.97 117.98 114.64 1l5i s PHE 87 Ca 0.27 -0.58 -0.04 0.00 0.12 0.00 0.00 56.93 56.69 1l5i s PHE 87 Cb -0.12 -1.19 0.10 0.00 -0.57 0.00 0.00 43.02 41.24 1l5i s PHE 87 CO 0.19 -0.25 0.22 -1.58 -0.10 0.00 0.00 175.22 173.70 1l5i s HIS 88 N 0.35 3.52 0.74 0.36 5.65 -1.26 -2.12 115.29 122.52 1l5i s HIS 88 Ca -0.11 -2.22 -0.11 0.00 0.25 0.00 0.00 55.06 52.88 1l5i s HIS 88 Cb -0.14 -3.17 0.03 0.00 -1.18 0.00 0.00 32.58 28.12 1l5i s HIS 88 CO 0.04 -0.95 1.08 -1.25 -0.65 0.00 0.00 174.74 173.00 1l5i s PRO 89 N 1.21 2.59 -0.19 2.88 0.04 -1.26 -4.92 135.00 135.36 1l5i s PRO 89 Ca 0.06 0.82 -0.22 0.00 0.04 0.00 0.00 61.00 61.70 1l5i s PRO 89 Cb -0.23 -1.96 -0.02 0.00 0.04 0.00 0.00 34.50 32.33 1l5i s PRO 89 CO -0.03 -1.31 0.70 1.21 0.04 0.00 0.00 177.00 177.62 1l5i s ASN 90 N -3.84 6.79 -0.09 6.66 3.84 -0.35 -4.83 114.94 123.11 1l5i s ASN 90 Ca 0.59 0.96 -0.23 0.00 0.21 0.00 0.00 52.86 54.40 1l5i s ASN 90 Cb -0.14 -2.39 -0.03 0.00 -0.55 0.00 0.00 41.25 38.14 1l5i s ASN 90 CO 0.55 -0.32 0.68 -0.63 -2.79 0.00 0.00 177.10 174.59 1l5i s ILE 91 N 1.98 5.05 -0.03 -5.21 1.01 -1.26 -2.32 121.20 120.42 1l5i s ILE 91 Ca 0.32 1.39 0.01 0.00 0.00 0.00 0.00 60.65 62.37 1l5i s ILE 91 Cb -0.16 -4.02 0.02 0.00 0.01 0.00 0.00 42.46 38.31 1l5i s ILE 91 CO 0.11 0.24 -0.04 -1.10 0.00 0.00 0.00 174.94 174.15 1l5i s GLN 92 N 0.94 0.64 -0.37 2.79 -0.21 -0.60 -4.98 119.66 117.87 1l5i s GLN 92 Ca 0.36 -0.11 -0.18 0.00 0.02 0.00 0.00 55.36 55.45 1l5i s GLN 92 Cb -0.17 -0.67 0.00 0.00 1.00 0.00 0.00 33.01 33.17 1l5i s GLN 92 CO 0.16 -0.03 0.48 0.20 -2.12 0.00 0.00 175.29 173.99 1l5i s GLY 93 N 0.62 1.84 -0.38 3.09 0.00 -1.26 -0.23 107.32 111.00 1l5i s GLY 93 Ca -0.08 -1.19 -0.24 0.00 0.00 0.00 0.00 44.72 43.22 1l5i s GLY 93 CO -0.00 1.22 0.83 0.00 0.00 0.00 0.00 173.10 175.15 1l5i s ALA 94 N 2.31 3.40 0.00 3.20 0.00 0.50 -4.99 121.76 126.17 1l5i s ALA 94 Ca 0.16 -0.64 0.00 0.00 0.00 0.00 0.00 51.96 51.48 1l5i s ALA 94 Cb -0.16 -3.44 0.00 0.00 0.00 0.00 0.00 23.12 19.52 1l5i s ALA 94 CO 0.14 -1.60 0.00 1.17 0.00 0.00 0.00 175.76 175.46 1l5i n LYS 95 N 6.60 2.85 -3.73 0.00 4.81 -1.26 -3.85 118.16 123.57 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 35.48 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 -1.73 6.53 0.00 3.14 0.15 -1.26 -4.80 113.70 115.73 1l5i s SER 96 Ca 0.00 0.62 0.00 0.00 0.70 0.00 0.00 55.95 57.27 1l5i s SER 96 Cb 0.00 -2.12 0.00 0.00 -1.71 0.00 0.00 66.02 62.19 1l5i s SER 96 CO 0.00 0.30 0.00 -0.24 1.20 0.00 0.00 173.24 174.50 1l5i n SER 97 N 1.44 0.00 -0.00 5.45 2.88 -1.26 -4.97 113.62 117.16 1l5i n SER 97 Ca -0.14 0.00 0.15 0.00 -1.33 0.00 0.00 58.87 57.55 1l5i n SER 97 Cb 0.53 0.00 0.75 0.00 -0.75 0.00 0.00 64.21 64.74 1l5i n SER 97 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 1l5i n SER 98 N 0.00 0.02 -0.18 -3.46 7.64 -1.26 -3.70 113.62 112.68 1l5i n SER 98 Ca 0.00 -0.13 0.29 0.00 1.01 0.00 0.00 58.87 60.04 1l5i n SER 98 Cb 0.00 -0.29 0.59 0.00 -1.01 0.00 0.00 64.21 63.50 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 0.02 0.00 -0.37 6.43 3.58 -2.00 2.11 116.42 126.19 1l5i h ASP 99 Ca 0.00 0.00 -0.08 0.00 0.42 0.00 0.00 57.03 57.37 1l5i h ASP 99 Cb 0.30 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 41.34 1l5i h ASP 99 CO 0.00 0.00 -0.10 -0.37 -2.88 0.00 0.00 179.24 175.89 1l5i h VAL 100 N 0.00 1.28 -0.46 2.25 -1.51 -1.99 -1.92 116.25 113.89 1l5i h VAL 100 Ca 0.45 -1.18 0.04 0.00 -1.23 0.00 0.00 66.70 64.78 1l5i h VAL 100 Cb 2.42 1.28 -0.04 0.00 -2.13 0.00 0.00 31.29 32.82 1l5i h VAL 100 CO -0.00 0.39 0.23 0.50 -1.23 0.00 0.00 177.57 177.46 1l5i h LYS 101 N 0.52 0.45 -0.85 5.19 3.11 0.32 0.56 116.57 125.86 1l5i h LYS 101 Ca 0.09 -0.03 0.04 0.00 -2.81 0.00 0.00 60.65 57.94 1l5i h LYS 101 Cb 0.61 -0.10 -0.05 0.00 -1.00 0.00 0.00 32.23 31.69 1l5i h LYS 101 CO 0.04 0.30 0.54 0.77 -2.81 0.00 0.00 179.45 178.28 1l5i h SER 102 N 0.46 0.89 0.01 4.20 0.02 -1.31 -0.41 113.55 117.41 1l5i h SER 102 Ca 0.20 -0.00 -0.14 0.00 -0.84 0.00 0.00 61.79 61.01 1l5i h SER 102 Cb 0.11 -0.19 -0.01 0.00 0.14 0.00 0.00 62.40 62.45 1l5i h SER 102 CO -0.14 0.60 -0.46 0.22 -1.14 0.00 0.00 176.83 175.91 1l5i h TYR 103 N 1.04 0.65 0.00 3.45 3.20 -0.45 -2.47 116.97 122.37 1l5i h TYR 103 Ca 0.34 -0.20 -0.04 0.00 3.14 0.00 0.00 58.73 61.98 1l5i h TYR 103 Cb 0.04 -0.13 -0.01 0.00 1.54 0.00 0.00 36.73 38.18 1l5i h TYR 103 CO -0.02 0.90 -0.17 0.82 -1.64 0.00 0.00 178.16 178.04 1l5i h ILE 104 N 0.43 0.68 0.00 1.81 2.04 0.10 -1.49 117.51 121.08 1l5i h ILE 104 Ca 0.03 -0.74 -0.19 0.00 1.00 0.00 0.00 64.86 64.96 1l5i h ILE 104 Cb 0.97 1.46 -0.03 0.00 -0.74 0.00 0.00 36.82 38.49 1l5i h ILE 104 CO 0.09 0.17 -0.91 -0.78 0.00 0.00 0.00 178.15 176.72 1l5i h ASP 105 N 0.00 0.00 0.00 1.72 3.58 -0.70 -3.35 116.42 117.67 1l5i h ASP 105 Ca -0.00 0.00 -0.38 0.00 0.42 0.00 0.00 57.03 57.07 1l5i h ASP 105 Cb 0.45 0.00 0.01 0.00 1.72 0.00 0.00 39.33 41.51 1l5i h ASP 105 CO 0.02 0.91 2.45 2.29 -2.88 0.00 0.00 179.24 182.03 1l5i n LYS 106 N -3.42 2.16 -2.07 0.28 2.85 -0.56 -4.85 118.16 112.55 1l5i n LYS 106 Ca -0.00 -1.44 -0.28 0.00 -1.05 0.00 0.00 58.31 55.53 1l5i n LYS 106 Cb 0.87 -2.42 0.19 0.00 -0.65 0.00 0.00 35.03 33.03 1l5i n LYS 106 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 177.40 177.10 1l5i n ASP 107 N 3.96 0.38 0.00 -5.58 9.92 -1.26 -5.02 116.55 118.95 1l5i n ASP 107 Ca 0.46 -1.63 0.00 0.00 -0.53 0.00 0.00 54.79 53.09 1l5i n ASP 107 Cb 0.19 -0.95 0.00 0.00 -0.64 0.00 0.00 41.12 39.72 1l5i n ASP 107 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1l5i n GLY 108 N -3.59 2.09 2.69 0.44 0.00 -1.26 -4.95 105.19 100.61 1l5i n GLY 108 Ca 0.17 -0.10 -0.18 0.00 0.00 0.00 0.00 46.02 45.90 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 -5.33 -4.64 1.61 8.00 -1.26 -4.90 116.55 110.02 1l5i n ASP 109 Ca 0.00 -0.18 -0.26 0.00 0.71 0.00 0.00 54.79 55.06 1l5i n ASP 109 Cb 0.00 -4.23 -0.09 0.00 -0.02 0.00 0.00 41.12 36.77 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 -3.03 2.28 -0.13 2.53 -7.23 -1.26 -4.72 120.40 108.85 1l5i s VAL 110 Ca 0.19 -1.94 -0.05 0.00 -1.81 0.00 0.00 61.98 58.37 1l5i s VAL 110 Cb -0.08 -2.90 -0.04 0.00 0.56 0.00 0.00 36.38 33.92 1l5i s VAL 110 CO 0.24 -0.08 0.05 -0.22 -0.31 0.00 0.00 175.10 174.78 1l5i s LEU 111 N -3.75 3.84 -0.07 1.32 0.20 -0.58 -5.02 118.68 114.61 1l5i s LEU 111 Ca 0.36 0.19 0.05 0.00 0.69 0.00 0.00 54.13 55.42 1l5i s LEU 111 Cb 0.05 -1.93 -0.01 0.00 -0.43 0.00 0.00 46.19 43.88 1l5i s LEU 111 CO 0.19 0.31 -0.23 -0.70 -0.29 0.00 0.00 176.35 175.63 1l5i s GLU 112 N -0.44 2.52 0.03 1.98 2.12 -1.26 -2.32 118.70 121.32 1l5i s GLU 112 Ca 0.09 -0.83 -0.02 0.00 0.36 0.00 0.00 54.97 54.58 1l5i s GLU 112 Cb -0.12 -2.06 -0.02 0.00 0.26 0.00 0.00 34.13 32.19 1l5i s GLU 112 CO 0.02 0.29 0.02 -0.46 -0.54 0.00 0.00 175.26 174.59 1l5i s TRP 113 N 0.05 0.28 0.27 5.30 -0.00 -0.52 -5.04 118.94 119.28 1l5i s TRP 113 Ca -0.08 -0.61 0.00 0.00 -0.00 0.00 0.00 56.10 55.40 1l5i s TRP 113 Cb -0.15 -0.21 0.00 0.00 -0.00 0.00 0.00 33.47 33.11 1l5i s TRP 113 CO 0.05 -0.29 0.00 0.41 -0.00 0.00 0.00 176.95 177.12 1l5i n GLY 114 N 1.01 -1.58 3.14 5.86 0.00 -1.26 -1.22 105.19 111.15 1l5i n GLY 114 Ca -0.20 -0.98 -0.28 0.00 0.00 0.00 0.00 46.02 44.56 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 -1.94 1.63 0.45 2.61 2.01 -1.24 -4.65 115.64 114.51 1l5i s THR 115 Ca 0.00 -0.79 -0.20 0.00 0.31 0.00 0.00 61.69 61.01 1l5i s THR 115 Cb 0.00 -1.43 -0.10 0.00 0.01 0.00 0.00 72.50 70.98 1l5i s THR 115 CO 0.00 0.47 0.96 0.12 -0.69 0.00 0.00 174.62 175.48 1l5i s PHE 116 N 0.33 3.33 -0.31 4.92 5.36 -1.26 -3.85 117.98 126.50 1l5i s PHE 116 Ca -0.13 1.58 -0.09 0.00 -0.96 0.00 0.00 56.93 57.33 1l5i s PHE 116 Cb -0.16 -2.85 -0.00 0.00 -0.34 0.00 0.00 43.02 39.67 1l5i s PHE 116 CO 0.05 -0.19 0.14 -0.65 -1.46 0.00 0.00 175.22 173.12 1l5i s GLN 117 N -3.36 3.30 -0.23 10.12 -1.52 -1.26 -5.05 119.66 121.66 1l5i s GLN 117 Ca 0.62 -0.74 -0.14 0.00 -1.95 0.00 0.00 55.36 53.15 1l5i s GLN 117 Cb -0.09 -3.54 -0.04 0.00 -0.22 0.00 0.00 33.01 29.11 1l5i s GLN 117 CO 0.17 -0.42 0.30 0.42 -0.25 0.00 0.00 175.29 175.50 1l5i s ILE 118 N 1.60 5.26 0.00 1.08 -1.09 -1.26 -4.65 121.20 122.14 1l5i s ILE 118 Ca 0.04 0.47 0.00 0.00 -2.23 0.00 0.00 60.65 58.93 1l5i s ILE 118 Cb -0.17 -3.63 0.00 0.00 -1.58 0.00 0.00 42.46 37.08 1l5i s ILE 118 CO 0.06 0.27 0.00 0.47 -1.23 0.00 0.00 174.94 174.51 1l5i n ASP 119 N 4.56 0.00 0.00 3.58 8.00 -1.26 -4.49 116.55 126.94 1l5i n ASP 119 Ca -0.11 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.39 1l5i n ASP 119 Cb 0.51 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.61 1l5i n ASP 119 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1l5i n GLY 120 N 0.00 -0.60 0.00 0.44 0.00 -1.26 -5.25 105.19 98.52 1l5i n GLY 120 Ca 0.00 0.23 0.00 0.00 0.00 0.00 0.00 46.02 46.25 1l5i n GLY 120 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19