#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1l5i s GLY 5 N 0.00 0.59 0.21 0.23 0.00 -1.26 -5.17 107.32 101.92 1l5i s GLY 5 Ca 0.00 -1.23 0.10 0.00 0.00 0.00 0.00 44.72 43.59 1l5i s GLY 5 CO 0.00 -1.27 -0.18 0.50 0.00 0.00 0.00 173.10 172.14 1l5i s ARG 6 N -3.95 1.44 -0.59 2.90 0.52 -1.26 -5.08 118.95 112.92 1l5i s ARG 6 Ca 0.12 -1.58 -0.27 0.00 -0.52 0.00 0.00 55.73 53.48 1l5i s ARG 6 Cb 0.07 -1.47 0.00 0.00 0.52 0.00 0.00 34.95 34.08 1l5i s ARG 6 CO -0.06 0.28 1.58 0.12 0.02 0.00 0.00 175.30 177.23 1l5i s PHE 7 N -2.39 2.03 -0.17 -0.53 5.36 -1.26 -4.95 117.98 116.06 1l5i s PHE 7 Ca 0.22 0.50 -0.02 0.00 -0.96 0.00 0.00 56.93 56.68 1l5i s PHE 7 Cb -0.04 -4.31 0.05 0.00 -0.34 0.00 0.00 43.02 38.38 1l5i s PHE 7 CO 0.10 -2.19 0.00 -1.54 -1.46 0.00 0.00 175.22 170.13 1l5i s SER 8 N 5.73 2.77 -0.12 6.13 1.04 -1.26 -4.12 113.70 123.86 1l5i s SER 8 Ca 0.57 -0.70 -0.03 0.00 0.48 0.00 0.00 55.95 56.26 1l5i s SER 8 Cb -0.12 -0.70 -0.03 0.00 0.10 0.00 0.00 66.02 65.27 1l5i s SER 8 CO 0.22 -0.25 -0.02 -0.63 0.98 0.00 0.00 173.24 173.54 1l5i s ILE 9 N 1.78 4.09 -0.20 -1.02 1.01 -1.14 -4.91 121.20 120.82 1l5i s ILE 9 Ca -0.00 -0.31 -0.03 0.00 0.00 0.00 0.00 60.65 60.31 1l5i s ILE 9 Cb -0.16 -2.76 0.06 0.00 0.01 0.00 0.00 42.46 39.61 1l5i s ILE 9 CO -0.07 0.54 0.04 -0.54 0.00 0.00 0.00 174.94 174.91 1l5i s LYS 10 N -0.18 0.61 0.15 2.79 -0.14 -1.26 0.90 119.74 122.62 1l5i s LYS 10 Ca 0.04 -0.42 -0.24 0.00 -1.36 0.00 0.00 55.97 53.99 1l5i s LYS 10 Cb -0.13 -2.08 0.06 0.00 -1.68 0.00 0.00 37.83 34.00 1l5i s LYS 10 CO 0.02 -0.66 0.74 0.00 -0.76 0.00 0.00 175.35 174.70 1l5i s ALA 11 N 1.87 -1.56 -0.21 5.17 0.00 -0.92 -4.96 121.76 121.16 1l5i s ALA 11 Ca -0.00 0.35 0.20 0.00 0.00 0.00 0.00 51.96 52.50 1l5i s ALA 11 Cb -0.17 0.75 0.00 0.00 0.00 0.00 0.00 23.12 23.70 1l5i s ALA 11 CO -0.09 -0.86 1.09 -0.22 0.00 0.00 0.00 175.76 175.68 1l5i h LYS 12 N 2.00 0.00 -5.96 0.00 3.64 -1.85 -0.65 116.57 113.75 1l5i h LYS 12 Ca -0.26 0.00 -0.68 0.00 -1.27 0.00 0.00 60.65 58.44 1l5i h LYS 12 Cb 1.27 0.00 -0.26 0.00 -0.41 0.00 0.00 32.23 32.83 1l5i h LYS 12 CO 0.31 0.17 -0.80 -0.80 -2.27 0.00 0.00 179.45 176.06 1l5i s ASN 13 N -5.75 3.78 -0.03 4.20 0.01 -1.26 -2.42 114.94 113.47 1l5i s ASN 13 Ca 0.00 -0.31 0.02 0.00 -0.71 0.00 0.00 52.86 51.86 1l5i s ASN 13 Cb 0.08 -1.06 0.01 0.00 0.41 0.00 0.00 41.25 40.69 1l5i s ASN 13 CO 0.78 0.27 -0.07 -0.31 -1.51 0.00 0.00 177.10 176.26 1l5i s TYR 14 N -0.28 0.80 -0.12 2.20 2.02 -0.95 -2.31 117.35 118.71 1l5i s TYR 14 Ca 0.01 -0.20 0.03 0.00 -0.37 0.00 0.00 57.07 56.55 1l5i s TYR 14 Cb -0.13 -0.60 0.01 0.00 -0.40 0.00 0.00 41.96 40.83 1l5i s TYR 14 CO 0.03 -0.11 -0.22 -0.06 -1.57 0.00 0.00 175.55 173.61 1l5i s PHE 15 N 0.35 2.59 -0.14 2.71 0.40 0.95 -2.28 117.98 122.55 1l5i s PHE 15 Ca -0.05 -1.21 -0.05 0.00 -0.60 0.00 0.00 56.93 55.02 1l5i s PHE 15 Cb -0.09 -1.75 -0.04 0.00 0.51 0.00 0.00 43.02 41.65 1l5i s PHE 15 CO 0.00 -0.53 0.04 -0.51 0.70 0.00 0.00 175.22 174.93 1l5i s LEU 16 N 0.63 3.76 -0.14 -0.37 2.01 -0.73 -1.32 118.68 122.52 1l5i s LEU 16 Ca -0.12 0.12 0.03 0.00 0.01 0.00 0.00 54.13 54.17 1l5i s LEU 16 Cb -0.16 -1.92 0.01 0.00 0.01 0.00 0.00 46.19 44.13 1l5i s LEU 16 CO 0.02 0.26 -0.22 -0.89 1.01 0.00 0.00 176.35 176.53 1l5i s THR 17 N -0.16 2.06 -0.35 5.49 2.01 -0.98 -2.20 115.64 121.51 1l5i s THR 17 Ca 0.06 -0.98 0.02 0.00 0.31 0.00 0.00 61.69 61.10 1l5i s THR 17 Cb -0.12 -1.81 0.10 0.00 0.01 0.00 0.00 72.50 70.67 1l5i s THR 17 CO 0.01 0.55 0.07 -0.31 -0.69 0.00 0.00 174.62 174.26 1l5i s TYR 18 N 0.77 3.64 0.27 4.92 1.51 -0.96 -1.38 117.35 126.13 1l5i s TYR 18 Ca -0.08 -2.71 -0.30 0.00 -1.01 0.00 0.00 57.07 52.97 1l5i s TYR 18 Cb -0.16 -2.87 -0.09 0.00 -0.11 0.00 0.00 41.96 38.73 1l5i s TYR 18 CO -0.01 -0.94 1.08 -1.25 -1.11 0.00 0.00 175.55 173.32 1l5i s PRO 19 N 1.01 4.66 -1.64 -1.71 0.04 -1.26 -2.24 135.00 133.86 1l5i s PRO 19 Ca 0.07 1.77 -0.16 0.00 0.04 0.00 0.00 61.00 62.72 1l5i s PRO 19 Cb -0.20 -3.20 0.16 0.00 0.04 0.00 0.00 34.50 31.30 1l5i s PRO 19 CO -0.06 0.24 0.41 0.36 0.04 0.00 0.00 177.00 177.99 1l5i n LYS 20 N 1.29 -0.79 -3.56 4.56 2.85 -0.85 -4.85 118.16 116.81 1l5i n LYS 20 Ca -0.01 0.12 -0.38 0.00 -1.05 0.00 0.00 58.31 56.99 1l5i n LYS 20 Cb 0.45 -4.02 -0.10 0.00 -0.65 0.00 0.00 35.03 30.71 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 4.71 1.62 -4.74 0.00 8.00 -1.26 -4.49 116.55 120.38 1l5i n ASP 22 Ca -0.13 -2.07 -0.41 0.00 0.71 0.00 0.00 54.79 52.89 1l5i n ASP 22 Cb 0.52 -0.26 -0.03 0.00 -0.02 0.00 0.00 41.12 41.33 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 -0.98 4.43 0.53 0.64 2.96 -1.26 -5.02 118.68 119.98 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 -0.02 0.00 0.50 0.00 0.00 46.19 43.16 1l5i s LEU 23 CO 0.10 -0.45 0.84 0.42 -1.32 0.00 0.00 176.35 175.94 1l5i s THR 24 N 0.03 4.36 0.31 3.68 -4.23 -1.26 -4.92 115.64 113.61 1l5i s THR 24 Ca 0.55 0.13 0.13 0.00 -1.18 0.00 0.00 61.69 61.32 1l5i s THR 24 Cb -0.35 -3.69 0.07 0.00 1.34 0.00 0.00 72.50 69.87 1l5i s THR 24 CO 0.38 -0.69 1.75 0.07 -0.54 0.00 0.00 174.62 175.58 1l5i h LYS 25 N 0.04 0.00 -0.16 3.99 2.10 -1.97 -0.81 116.57 119.77 1l5i h LYS 25 Ca -0.46 0.00 -0.03 0.00 -2.00 0.00 0.00 60.65 58.16 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 0.45 -0.01 1.49 -2.00 0.00 0.00 179.45 179.99 1l5i h GLU 26 N 0.00 0.28 -0.35 0.07 4.81 -1.96 1.53 114.58 118.95 1l5i h GLU 26 Ca -0.00 -0.09 -0.07 0.00 -0.13 0.00 0.00 59.36 59.06 1l5i h GLU 26 Cb 0.83 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 30.18 1l5i h GLU 26 CO 0.06 0.51 -0.05 -0.91 -0.73 0.00 0.00 179.01 177.89 1l5i h ASN 27 N 0.02 0.66 -0.09 1.04 -0.26 -1.92 0.33 115.58 115.36 1l5i h ASN 27 Ca 0.04 -0.34 -0.12 0.00 -0.56 0.00 0.00 56.30 55.32 1l5i h ASN 27 Cb 0.39 -0.18 -0.01 0.00 -1.06 0.00 0.00 38.32 37.46 1l5i h ASN 27 CO 0.01 0.85 -0.33 0.00 -1.06 0.00 0.00 177.43 176.89 1l5i h ALA 28 N 0.83 0.92 -0.38 -0.83 0.00 -1.08 0.47 119.26 119.19 1l5i h ALA 28 Ca 0.09 -0.40 -0.10 0.00 0.00 0.00 0.00 54.91 54.50 1l5i h ALA 28 Cb 0.54 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.20 1l5i h ALA 28 CO 0.03 0.62 -0.16 1.25 0.00 0.00 0.00 179.25 180.99 1l5i h LEU 29 N 0.49 0.80 -0.36 0.00 7.12 0.24 0.59 115.31 124.19 1l5i h LEU 29 Ca 0.06 -0.39 -0.18 0.00 0.13 0.00 0.00 57.88 57.49 1l5i h LEU 29 Cb 0.82 -0.22 -0.00 0.00 -0.53 0.00 0.00 40.66 40.72 1l5i h LEU 29 CO 0.07 1.02 -0.54 0.28 -0.13 0.00 0.00 178.44 179.13 1l5i h SER 30 N 0.59 0.88 -0.01 1.25 0.02 -0.12 -2.31 113.55 113.84 1l5i h SER 30 Ca 0.09 -0.47 -0.15 0.00 -0.84 0.00 0.00 61.79 60.42 1l5i h SER 30 Cb 0.70 -0.25 -0.01 0.00 0.14 0.00 0.00 62.40 62.98 1l5i h SER 30 CO 0.05 1.25 -0.50 1.56 -1.14 0.00 0.00 176.83 178.05 1l5i h GLN 31 N 0.61 0.57 -0.48 3.45 4.20 0.06 -2.64 115.11 120.89 1l5i h GLN 31 Ca 0.02 -0.34 -0.05 0.00 0.06 0.00 0.00 58.65 58.34 1l5i h GLN 31 Cb 1.13 0.03 -0.02 0.00 0.30 0.00 0.00 27.48 28.92 1l5i h GLN 31 CO 0.12 0.94 0.09 0.82 -0.67 0.00 0.00 178.83 180.13 1l5i h ILE 32 N 0.45 1.21 -0.56 2.54 1.08 0.27 -0.85 117.51 121.66 1l5i h ILE 32 Ca 0.02 -0.79 -0.07 0.00 -0.39 0.00 0.00 64.86 63.63 1l5i h ILE 32 Cb 1.03 0.75 -0.02 0.00 -3.07 0.00 0.00 36.82 35.51 1l5i h ILE 32 CO 0.10 0.29 0.08 0.71 -0.69 0.00 0.00 178.15 178.63 1l5i h THR 33 N 0.70 1.26 0.00 -0.27 1.35 -1.19 -1.52 112.91 113.24 1l5i h THR 33 Ca 0.15 -0.99 0.00 0.00 -0.55 0.00 0.00 66.41 65.02 1l5i h THR 33 Cb 0.30 0.81 0.00 0.00 -1.73 0.00 0.00 68.15 67.53 1l5i h THR 33 CO 0.00 0.36 0.00 0.59 -0.25 0.00 0.00 175.52 176.22 1l5i n ASN 34 N -4.33 0.27 -4.63 5.36 3.02 -0.91 -4.66 115.26 109.39 1l5i n ASN 34 Ca 0.02 0.55 -0.43 0.00 -0.03 0.00 0.00 54.58 54.69 1l5i n ASN 34 Cb 0.28 -0.61 -0.02 0.00 -0.61 0.00 0.00 39.78 38.81 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 -3.57 3.86 0.58 3.41 1.02 -0.37 -5.00 118.68 118.62 1l5i s LEU 35 Ca 0.08 1.27 -0.07 0.00 0.02 0.00 0.00 54.13 55.44 1l5i s LEU 35 Cb 0.12 -3.54 -0.01 0.00 0.02 0.00 0.00 46.19 42.78 1l5i s LEU 35 CO 0.40 -1.14 0.91 -1.10 0.02 0.00 0.00 176.35 175.45 1l5i s GLN 36 N 4.32 3.15 0.07 1.70 -0.21 -1.26 -4.98 119.66 122.45 1l5i s GLN 36 Ca 0.60 0.20 -0.08 0.00 0.02 0.00 0.00 55.36 56.10 1l5i s GLN 36 Cb -0.18 -2.24 -0.00 0.00 1.00 0.00 0.00 33.01 31.59 1l5i s GLN 36 CO 0.25 -0.61 0.17 -0.08 -2.12 0.00 0.00 175.29 172.90 1l5i s THR 37 N -3.00 0.14 0.07 -0.19 -1.32 -1.26 -5.04 115.64 105.03 1l5i s THR 37 Ca 0.53 -1.13 0.17 0.00 -1.21 0.00 0.00 61.69 60.05 1l5i s THR 37 Cb -0.11 -1.19 0.09 0.00 -1.51 0.00 0.00 72.50 69.78 1l5i s THR 37 CO 0.47 -0.62 1.62 1.55 -2.21 0.00 0.00 174.62 175.42 1l5i h PRO 38 N 3.05 0.00 0.00 7.08 0.13 -1.98 -3.42 132.00 136.86 1l5i h PRO 38 Ca -0.33 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.80 1l5i h PRO 38 Cb 1.19 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 1l5i h PRO 38 CO 0.54 0.46 0.00 -2.37 -0.23 0.00 0.00 178.00 176.40 1l5i n THR 39 N -3.43 0.00 -3.64 1.56 5.66 -1.26 -5.12 114.28 108.05 1l5i n THR 39 Ca 0.00 0.00 -0.05 0.00 -3.05 0.00 0.00 64.05 60.95 1l5i n THR 39 Cb 0.61 0.00 -0.07 0.00 -1.55 0.00 0.00 70.33 69.32 1l5i n THR 39 CO 0.00 0.00 0.00 0.21 -3.05 0.00 0.00 175.07 172.23 1l5i s ASN 40 N -1.00 -0.26 0.41 1.09 3.04 -1.26 -4.95 114.94 112.00 1l5i s ASN 40 Ca 0.00 0.48 -0.14 0.00 0.04 0.00 0.00 52.86 53.24 1l5i s ASN 40 Cb 0.00 0.60 -0.08 0.00 -1.54 0.00 0.00 41.25 40.23 1l5i s ASN 40 CO 0.00 -0.08 0.83 -0.54 -3.04 0.00 0.00 177.10 174.27 1l5i s LYS 41 N 0.32 3.93 0.00 0.43 1.02 -1.26 -1.43 119.74 122.75 1l5i s LYS 41 Ca 0.03 0.71 0.00 0.00 0.02 0.00 0.00 55.97 56.73 1l5i s LYS 41 Cb -0.05 -2.32 0.00 0.00 -0.52 0.00 0.00 37.83 34.94 1l5i s LYS 41 CO -0.11 -0.03 0.00 1.28 -0.92 0.00 0.00 175.35 175.56 1l5i n LEU 42 N -1.02 0.00 -4.86 3.17 4.32 -0.43 -4.75 117.00 113.44 1l5i n LEU 42 Ca 0.04 0.00 -0.28 0.00 -0.02 0.00 0.00 56.01 55.75 1l5i n LEU 42 Cb 0.54 0.00 -0.05 0.00 -1.62 0.00 0.00 43.42 42.29 1l5i n LEU 42 CO 0.44 0.00 -0.18 0.12 -1.22 0.00 0.00 177.39 176.55 1l5i s PHE 43 N 0.00 3.33 -0.11 -1.77 5.36 -1.24 -3.46 117.98 120.09 1l5i s PHE 43 Ca 0.00 0.10 -0.03 0.00 -0.96 0.00 0.00 56.93 56.04 1l5i s PHE 43 Cb 0.00 -1.63 0.04 0.00 -0.34 0.00 0.00 43.02 41.09 1l5i s PHE 43 CO 0.00 0.53 0.05 0.42 -1.46 0.00 0.00 175.22 174.76 1l5i s ILE 44 N -1.62 0.12 -0.17 3.12 1.01 0.90 -2.47 121.20 122.09 1l5i s ILE 44 Ca 0.32 0.03 0.01 0.00 0.00 0.00 0.00 60.65 61.01 1l5i s ILE 44 Cb -0.11 -0.51 0.02 0.00 0.01 0.00 0.00 42.46 41.87 1l5i s ILE 44 CO 0.26 0.01 -0.20 -0.75 0.00 0.00 0.00 174.94 174.26 1l5i s LYS 45 N 2.06 3.02 -0.24 2.79 2.36 0.38 -0.74 119.74 129.36 1l5i s LYS 45 Ca 0.03 -0.83 0.00 0.00 -2.55 0.00 0.00 55.97 52.63 1l5i s LYS 45 Cb -0.14 -2.56 0.04 0.00 -1.05 0.00 0.00 37.83 34.12 1l5i s LYS 45 CO -0.06 -0.16 -0.10 0.42 1.55 0.00 0.00 175.35 177.00 1l5i s ILE 46 N 1.18 2.53 -0.06 5.43 1.01 -0.85 0.10 121.20 130.54 1l5i s ILE 46 Ca 0.02 -1.21 0.03 0.00 0.00 0.00 0.00 60.65 59.49 1l5i s ILE 46 Cb -0.14 -2.32 -0.02 0.00 0.01 0.00 0.00 42.46 39.99 1l5i s ILE 46 CO -0.10 0.17 -0.14 0.00 0.00 0.00 0.00 174.94 174.88 1l5i s ARG 48 N -0.61 3.56 -0.12 0.00 3.52 -1.26 -0.33 118.95 123.72 1l5i s ARG 48 Ca 0.09 -0.07 -0.08 0.00 -0.13 0.00 0.00 55.73 55.55 1l5i s ARG 48 Cb -0.11 -3.13 0.04 0.00 -1.56 0.00 0.00 34.95 30.19 1l5i s ARG 48 CO 0.01 0.70 0.29 -2.00 -0.81 0.00 0.00 175.30 173.49 1l5i s GLU 49 N -1.46 0.28 -0.14 5.12 2.12 -0.99 -4.91 118.70 118.73 1l5i s GLU 49 Ca 0.23 0.54 -0.10 0.00 0.36 0.00 0.00 54.97 56.00 1l5i s GLU 49 Cb -0.13 -0.01 -0.05 0.00 0.26 0.00 0.00 34.13 34.20 1l5i s GLU 49 CO 0.12 -0.12 0.19 -0.51 -0.54 0.00 0.00 175.26 174.40 1l5i s LEU 50 N 0.93 4.31 0.39 2.70 2.01 -1.26 -0.88 118.68 126.88 1l5i s LEU 50 Ca -0.06 0.45 -0.21 0.00 0.01 0.00 0.00 54.13 54.31 1l5i s LEU 50 Cb -0.07 -2.18 -0.11 0.00 0.01 0.00 0.00 46.19 43.84 1l5i s LEU 50 CO -0.06 0.27 0.92 -1.00 1.01 0.00 0.00 176.35 177.48 1l5i s HIS 51 N -0.31 3.39 -1.31 0.29 3.76 0.10 -4.87 115.29 116.34 1l5i s HIS 51 Ca 0.14 1.58 0.16 0.00 -0.15 0.00 0.00 55.06 56.79 1l5i s HIS 51 Cb -0.12 -2.82 0.76 0.00 1.11 0.00 0.00 32.58 31.51 1l5i s HIS 51 CO 0.03 -0.02 1.46 0.39 -0.85 0.00 0.00 174.74 175.74 1l5i n GLU 52 N -0.39 0.16 -0.01 1.40 1.02 -1.26 -1.60 120.64 119.97 1l5i n GLU 52 Ca 0.06 0.16 0.13 0.00 -0.02 0.00 0.00 57.16 57.49 1l5i n GLU 52 Cb 0.53 -1.50 0.65 0.00 -0.02 0.00 0.00 31.44 31.10 1l5i n GLU 52 CO 0.00 0.00 0.00 -1.71 1.18 0.00 0.00 177.13 176.60 1l5i n ASN 53 N -1.34 0.62 0.00 1.62 2.85 -1.26 -4.85 115.26 112.90 1l5i n ASN 53 Ca 0.06 -1.35 0.00 0.00 -0.11 0.00 0.00 54.58 53.19 1l5i n ASN 53 Cb 0.14 -0.02 0.00 0.00 1.24 0.00 0.00 39.78 41.14 1l5i n ASN 53 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1l5i n GLY 54 N 1.01 0.83 3.81 8.20 0.00 -0.62 -5.03 105.19 113.38 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 -0.22 3.91 -0.08 1.61 -1.05 -1.24 -4.93 118.70 116.70 1l5i s GLU 55 Ca 0.00 0.11 -0.30 0.00 -0.15 0.00 0.00 54.97 54.63 1l5i s GLU 55 Cb 0.00 -3.29 -0.03 0.00 -0.44 0.00 0.00 34.13 30.37 1l5i s GLU 55 CO 0.00 0.54 1.23 -1.25 0.95 0.00 0.00 175.26 176.73 1l5i s PRO 56 N -0.45 4.32 0.18 -4.83 0.04 -1.26 -0.72 135.00 132.27 1l5i s PRO 56 Ca 0.18 1.69 0.08 0.00 0.04 0.00 0.00 61.00 62.99 1l5i s PRO 56 Cb -0.14 -3.60 -0.04 0.00 0.04 0.00 0.00 34.50 30.76 1l5i s PRO 56 CO 0.07 -0.51 -0.04 -1.58 0.04 0.00 0.00 177.00 174.97 1l5i s HIS 57 N 2.51 2.76 0.00 0.56 2.46 -0.06 -0.27 115.29 123.25 1l5i s HIS 57 Ca 0.56 -0.17 0.04 0.00 0.47 0.00 0.00 55.06 55.96 1l5i s HIS 57 Cb -0.24 -1.34 -0.01 0.00 -0.13 0.00 0.00 32.58 30.85 1l5i s HIS 57 CO 0.21 0.52 -0.11 -1.17 -2.47 0.00 0.00 174.74 171.71 1l5i s LEU 58 N -2.90 2.05 0.05 8.88 1.98 -0.95 -2.33 118.68 125.45 1l5i s LEU 58 Ca 0.26 -0.25 0.09 0.00 -2.89 0.00 0.00 54.13 51.35 1l5i s LEU 58 Cb -0.09 -0.56 -0.03 0.00 0.66 0.00 0.00 46.19 46.17 1l5i s LEU 58 CO 0.17 0.11 -0.26 -1.00 -1.89 0.00 0.00 176.35 173.48 1l5i s HIS 59 N -0.39 2.31 -0.02 5.38 3.76 0.55 -2.26 115.29 124.63 1l5i s HIS 59 Ca 0.03 -0.41 -0.01 0.00 -0.15 0.00 0.00 55.06 54.52 1l5i s HIS 59 Cb -0.05 -1.38 0.01 0.00 1.11 0.00 0.00 32.58 32.27 1l5i s HIS 59 CO -0.00 0.13 0.04 0.42 -0.85 0.00 0.00 174.74 174.47 1l5i s ILE 60 N -0.81 -0.01 -0.16 0.60 1.01 -0.94 -1.71 121.20 119.19 1l5i s ILE 60 Ca 0.12 0.04 -0.04 0.00 0.00 0.00 0.00 60.65 60.77 1l5i s ILE 60 Cb -0.10 -0.06 0.06 0.00 0.01 0.00 0.00 42.46 42.36 1l5i s ILE 60 CO 0.02 0.02 0.07 -0.22 0.00 0.00 0.00 174.94 174.83 1l5i s LEU 61 N 0.22 0.53 0.14 2.97 1.98 0.12 -1.78 118.68 122.85 1l5i s LEU 61 Ca -0.02 -0.56 0.10 0.00 -2.89 0.00 0.00 54.13 50.76 1l5i s LEU 61 Cb -0.02 -0.33 -0.04 0.00 0.66 0.00 0.00 46.19 46.46 1l5i s LEU 61 CO -0.01 -0.32 -0.23 -0.63 -1.89 0.00 0.00 176.35 173.27 1l5i s ILE 62 N 2.07 2.04 0.03 6.68 1.01 -0.96 -0.47 121.20 131.59 1l5i s ILE 62 Ca 0.02 -1.78 0.04 0.00 0.00 0.00 0.00 60.65 58.93 1l5i s ILE 62 Cb -0.16 -1.87 -0.02 0.00 0.01 0.00 0.00 42.46 40.43 1l5i s ILE 62 CO -0.08 -0.06 -0.11 0.00 0.00 0.00 0.00 174.94 174.68 1l5i s GLN 63 N -2.26 0.77 0.23 2.79 -2.07 -1.03 -2.24 119.66 115.85 1l5i s GLN 63 Ca 0.13 -0.66 0.12 0.00 -1.82 0.00 0.00 55.36 53.13 1l5i s GLN 63 Cb -0.09 -0.72 -0.05 0.00 -1.09 0.00 0.00 33.01 31.06 1l5i s GLN 63 CO 0.06 0.18 -0.22 -0.06 -1.32 0.00 0.00 175.29 173.93 1l5i s PHE 64 N -0.83 2.30 0.41 9.60 0.40 -1.01 -1.31 117.98 127.54 1l5i s PHE 64 Ca -0.01 -0.34 0.08 0.00 -0.60 0.00 0.00 56.93 56.05 1l5i s PHE 64 Cb -0.07 -1.08 0.85 0.00 0.51 0.00 0.00 43.02 43.23 1l5i s PHE 64 CO 0.01 0.59 2.04 1.49 0.70 0.00 0.00 175.22 180.04 1l5i h GLU 65 N 2.81 0.48 -5.54 0.44 4.81 -1.54 -3.43 114.58 112.61 1l5i h GLU 65 Ca -0.44 -0.04 -0.45 0.00 -0.13 0.00 0.00 59.36 58.30 1l5i h GLU 65 Cb 1.23 -0.10 -0.14 0.00 0.63 0.00 0.00 28.75 30.36 1l5i h GLU 65 CO 0.53 0.36 -0.73 0.20 -0.73 0.00 0.00 179.01 178.64 1l5i s GLY 66 N -3.75 1.44 -0.03 1.92 0.00 -1.26 -5.03 107.32 100.59 1l5i s GLY 66 Ca -0.08 -1.67 -0.30 0.00 0.00 0.00 0.00 44.72 42.67 1l5i s GLY 66 CO 0.73 -1.76 2.01 0.28 0.00 0.00 0.00 173.10 174.37 1l5i n LYS 67 N -0.39 2.59 -3.54 2.90 5.02 -1.26 -4.74 118.16 118.74 1l5i n LYS 67 Ca -0.08 0.91 -0.37 0.00 -2.02 0.00 0.00 58.31 56.75 1l5i n LYS 67 Cb 0.61 -2.99 -0.06 0.00 -0.02 0.00 0.00 35.03 32.56 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 5.16 3.70 -0.38 2.13 5.04 -0.25 -4.83 117.35 127.91 1l5i s TYR 68 Ca 0.92 0.93 -0.13 0.00 -2.44 0.00 0.00 57.07 56.35 1l5i s TYR 68 Cb -0.46 -2.25 0.01 0.00 0.35 0.00 0.00 41.96 39.62 1l5i s TYR 68 CO 0.42 0.63 0.25 1.21 -1.34 0.00 0.00 175.55 176.73 1l5i s ASN 69 N -1.18 5.97 -0.92 4.32 3.04 -1.26 -2.16 114.94 122.76 1l5i s ASN 69 Ca 0.25 -0.78 -0.00 0.00 0.04 0.00 0.00 52.86 52.36 1l5i s ASN 69 Cb -0.16 -2.11 0.29 0.00 -1.54 0.00 0.00 41.25 37.73 1l5i s ASN 69 CO 0.13 -0.37 1.25 0.00 -3.04 0.00 0.00 177.10 175.07 1l5i n THR 71 N 1.02 2.71 -3.39 0.00 5.66 -1.26 -2.86 114.28 116.16 1l5i n THR 71 Ca 0.29 -1.53 0.02 0.00 -3.05 0.00 0.00 64.05 59.78 1l5i n THR 71 Cb 0.35 -0.68 -0.03 0.00 -1.55 0.00 0.00 70.33 68.43 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 -0.73 -0.96 -0.09 1.09 2.47 -1.26 -4.73 114.94 110.74 1l5i s ASN 72 Ca 0.43 1.02 -0.03 0.00 0.42 0.00 0.00 52.86 54.69 1l5i s ASN 72 Cb 0.36 1.97 -0.10 0.00 -1.45 0.00 0.00 41.25 42.03 1l5i s ASN 72 CO 0.07 -0.18 2.89 0.00 -3.72 0.00 0.00 177.10 176.16 1l5i n GLN 73 N 5.32 1.74 -0.00 0.43 6.02 -1.26 -3.39 117.38 126.23 1l5i n GLN 73 Ca -0.08 -0.92 0.00 0.00 -0.01 0.00 0.00 57.00 55.99 1l5i n GLN 73 Cb 0.51 -1.69 -0.01 0.00 1.02 0.00 0.00 30.24 30.08 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 1.81 0.84 0.08 -1.09 5.12 -1.26 -4.49 116.66 117.66 1l5i n ARG 74 Ca 0.30 -0.01 -0.17 0.00 -1.93 0.00 0.00 57.85 56.04 1l5i n ARG 74 Cb 0.72 -0.96 -0.09 0.00 -1.16 0.00 0.00 32.46 30.96 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 0.78 -0.38 -1.55 3.57 -1.98 -3.14 116.94 114.24 1l5i h PHE 75 Ca 0.00 -0.46 0.00 0.00 3.53 0.00 0.00 57.97 61.04 1l5i h PHE 75 Cb 0.04 -0.07 0.00 0.00 2.79 0.00 0.00 35.95 38.71 1l5i h PHE 75 CO 0.00 1.30 0.00 1.19 -2.23 0.00 0.00 178.31 178.57 1l5i n PHE 76 N -3.74 0.69 -1.94 0.41 3.72 -1.26 -4.86 117.46 110.48 1l5i n PHE 76 Ca -0.10 -0.30 -0.41 0.00 -0.05 0.00 0.00 57.45 56.59 1l5i n PHE 76 Cb 0.91 -0.09 -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 -0.84 5.57 -0.10 4.37 1.01 -1.19 -4.45 116.67 121.03 1l5i s ASP 77 Ca 0.27 1.09 -0.01 0.00 0.71 0.00 0.00 52.55 54.61 1l5i s ASP 77 Cb 0.16 -2.52 -0.03 0.00 1.01 0.00 0.00 42.92 41.54 1l5i s ASP 77 CO 0.16 -2.00 -0.04 -0.76 0.21 0.00 0.00 175.17 172.73 1l5i s LEU 78 N 8.04 3.32 0.32 1.23 1.43 -0.89 -4.98 118.68 127.14 1l5i s LEU 78 Ca 0.80 -0.01 0.09 0.00 -1.03 0.00 0.00 54.13 53.98 1l5i s LEU 78 Cb -0.20 -1.76 -0.06 0.00 0.03 0.00 0.00 46.19 44.20 1l5i s LEU 78 CO 0.30 0.30 -0.10 0.68 0.23 0.00 0.00 176.35 177.76 1l5i s VAL 79 N -0.45 2.11 -0.28 -1.59 -7.23 -1.26 0.41 120.40 112.11 1l5i s VAL 79 Ca 0.07 -2.21 -0.24 0.00 -1.81 0.00 0.00 61.98 57.79 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 0.81 -0.55 -0.31 0.00 0.00 175.10 174.81 1l5i s SER 80 N -3.55 6.74 0.00 4.85 0.15 -0.18 -4.90 113.70 116.81 1l5i s SER 80 Ca 0.31 0.83 0.23 0.00 0.70 0.00 0.00 55.95 58.03 1l5i s SER 80 Cb 0.02 -2.42 1.29 0.00 -1.71 0.00 0.00 66.02 63.19 1l5i s SER 80 CO 0.15 -0.57 1.77 -0.81 1.20 0.00 0.00 173.24 174.97 1l5i n PRO 81 N 6.13 0.54 -0.01 5.44 -0.04 -1.26 -2.51 135.00 143.29 1l5i n PRO 81 Ca 0.05 0.04 0.03 0.00 -0.04 0.00 0.00 63.50 63.58 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 -1.14 0.03 -4.24 0.52 -2.24 -1.26 -5.01 114.28 100.94 1l5i n THR 82 Ca 0.14 -0.19 -0.17 0.00 -2.27 0.00 0.00 64.05 61.57 1l5i n THR 82 Cb 0.13 0.25 -0.14 0.00 -2.10 0.00 0.00 70.33 68.47 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 0.66 -0.85 -0.78 3.52 -1.05 -5.03 118.95 112.90 1l5i s ARG 83 Ca -0.03 -0.49 -0.07 0.00 -0.13 0.00 0.00 55.73 55.01 1l5i s ARG 83 Cb 0.05 -0.60 -0.13 0.00 -1.56 0.00 0.00 34.95 32.71 1l5i s ARG 83 CO 0.33 0.15 2.79 0.45 -0.81 0.00 0.00 175.30 178.21 1l5i n SER 84 N 2.33 6.17 -4.06 -2.12 2.88 -1.26 -3.86 113.62 113.71 1l5i n SER 84 Ca -0.16 -2.41 -0.21 0.00 -1.33 0.00 0.00 58.87 54.75 1l5i n SER 84 Cb 0.56 -1.30 -0.15 0.00 -0.75 0.00 0.00 64.21 62.57 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 2.19 1.02 0.03 -1.46 0.00 -1.26 -5.04 121.76 117.23 1l5i s ALA 85 Ca 0.57 -0.48 0.00 0.00 0.00 0.00 0.00 51.96 52.05 1l5i s ALA 85 Cb 0.19 -0.31 -0.04 0.00 0.00 0.00 0.00 23.12 22.96 1l5i s ALA 85 CO -0.03 0.21 0.13 -1.01 0.00 0.00 0.00 175.76 175.07 1l5i s HIS 86 N -0.08 3.37 -0.08 0.00 3.76 -1.26 -1.01 115.29 119.98 1l5i s HIS 86 Ca 0.01 0.22 0.02 0.00 -0.15 0.00 0.00 55.06 55.16 1l5i s HIS 86 Cb -0.07 -1.73 0.01 0.00 1.11 0.00 0.00 32.58 31.90 1l5i s HIS 86 CO 0.00 0.57 -0.15 -0.06 -0.85 0.00 0.00 174.74 174.26 1l5i s PHE 87 N -1.35 1.79 -0.44 1.40 0.08 0.16 -4.96 117.98 114.67 1l5i s PHE 87 Ca 0.28 -0.74 -0.07 0.00 0.12 0.00 0.00 56.93 56.52 1l5i s PHE 87 Cb -0.12 -1.28 0.11 0.00 -0.57 0.00 0.00 43.02 41.15 1l5i s PHE 87 CO 0.20 -0.36 0.27 -1.58 -0.10 0.00 0.00 175.22 173.65 1l5i s HIS 88 N 0.74 3.45 0.80 0.36 5.65 -1.26 -2.09 115.29 122.94 1l5i s HIS 88 Ca -0.12 -1.96 -0.11 0.00 0.25 0.00 0.00 55.06 53.11 1l5i s HIS 88 Cb -0.16 -3.25 0.07 0.00 -1.18 0.00 0.00 32.58 28.06 1l5i s HIS 88 CO 0.03 -0.95 1.10 -1.25 -0.65 0.00 0.00 174.74 173.01 1l5i s PRO 89 N 1.31 2.07 -0.22 2.88 0.04 -1.26 -4.92 135.00 134.90 1l5i s PRO 89 Ca 0.05 0.64 -0.14 0.00 0.04 0.00 0.00 61.00 61.59 1l5i s PRO 89 Cb -0.24 -1.92 -0.04 0.00 0.04 0.00 0.00 34.50 32.34 1l5i s PRO 89 CO -0.01 -1.63 0.31 -0.80 0.04 0.00 0.00 177.00 174.91 1l5i s ASN 90 N -3.90 6.32 -0.07 6.66 0.01 -0.48 -4.80 114.94 118.68 1l5i s ASN 90 Ca 0.61 0.37 -0.25 0.00 -0.71 0.00 0.00 52.86 52.88 1l5i s ASN 90 Cb -0.14 -2.19 -0.03 0.00 0.41 0.00 0.00 41.25 39.30 1l5i s ASN 90 CO 0.54 -0.03 0.76 -0.63 -1.51 0.00 0.00 177.10 176.23 1l5i s ILE 91 N 1.23 5.00 -0.03 0.60 1.01 -1.26 -2.31 121.20 125.45 1l5i s ILE 91 Ca 0.15 1.55 0.01 0.00 0.00 0.00 0.00 60.65 62.36 1l5i s ILE 91 Cb -0.14 -4.09 0.01 0.00 0.01 0.00 0.00 42.46 38.25 1l5i s ILE 91 CO 0.07 0.21 -0.04 -1.58 0.00 0.00 0.00 174.94 173.59 1l5i s GLN 92 N 0.99 0.66 -0.23 2.79 0.74 -0.43 -4.95 119.66 119.22 1l5i s GLN 92 Ca 0.40 -0.12 -0.10 0.00 0.05 0.00 0.00 55.36 55.59 1l5i s GLN 92 Cb -0.18 -0.68 -0.05 0.00 1.10 0.00 0.00 33.01 33.21 1l5i s GLN 92 CO 0.19 -0.02 0.13 0.20 -0.55 0.00 0.00 175.29 175.24 1l5i s GLY 93 N 0.58 1.94 -0.33 2.59 0.00 -1.26 -0.04 107.32 110.80 1l5i s GLY 93 Ca -0.07 -0.91 -0.29 0.00 0.00 0.00 0.00 44.72 43.45 1l5i s GLY 93 CO -0.00 0.36 1.25 0.00 0.00 0.00 0.00 173.10 174.71 1l5i s ALA 94 N 1.04 3.34 -0.64 3.20 0.00 -0.98 -4.85 121.76 122.88 1l5i s ALA 94 Ca 0.06 -0.01 0.14 0.00 0.00 0.00 0.00 51.96 52.15 1l5i s ALA 94 Cb -0.14 -3.78 0.66 0.00 0.00 0.00 0.00 23.12 19.86 1l5i s ALA 94 CO 0.04 -1.82 1.42 1.63 0.00 0.00 0.00 175.76 177.03 1l5i n LYS 95 N 7.34 0.08 -4.48 0.00 5.02 -1.26 -4.61 118.16 120.26 1l5i n LYS 95 Ca 0.14 0.50 -0.24 0.00 -2.02 0.00 0.00 58.31 56.69 1l5i n LYS 95 Cb 0.47 -1.72 -0.10 0.00 -0.02 0.00 0.00 35.03 33.66 1l5i n LYS 95 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 1l5i s SER 96 N -3.56 3.52 -0.16 4.39 0.15 -1.26 -5.05 113.70 111.73 1l5i s SER 96 Ca 0.01 -1.08 0.14 0.00 0.70 0.00 0.00 55.95 55.73 1l5i s SER 96 Cb 0.05 -0.29 -0.20 0.00 -1.71 0.00 0.00 66.02 63.86 1l5i s SER 96 CO 0.17 -0.05 0.05 -1.54 1.20 0.00 0.00 173.24 173.08 1l5i n SER 97 N -0.64 0.96 0.06 5.45 3.41 -1.26 -4.41 113.62 117.19 1l5i n SER 97 Ca -0.05 -0.00 -0.06 0.00 -0.26 0.00 0.00 58.87 58.49 1l5i n SER 97 Cb 0.61 0.89 -0.11 0.00 -0.26 0.00 0.00 64.21 65.34 1l5i n SER 97 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 1l5i h SER 98 N 0.00 0.00 -0.64 4.04 0.02 -1.97 -3.22 113.55 111.77 1l5i h SER 98 Ca -0.45 0.00 0.19 0.00 -0.84 0.00 0.00 61.79 60.69 1l5i h SER 98 Cb 2.01 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 64.53 1l5i h SER 98 CO 0.02 0.95 0.84 -2.24 -1.14 0.00 0.00 176.83 175.26 1l5i h ASP 99 N 0.00 0.00 -0.43 3.07 3.04 -1.99 1.88 116.42 121.99 1l5i h ASP 99 Ca -0.03 0.00 -0.11 0.00 -3.24 0.00 0.00 57.03 53.65 1l5i h ASP 99 Cb 1.75 0.00 -0.01 0.00 -1.04 0.00 0.00 39.33 40.03 1l5i h ASP 99 CO 0.12 0.00 -0.16 -0.37 -2.04 0.00 0.00 179.24 176.79 1l5i h VAL 100 N 0.00 1.28 -0.96 4.15 -1.51 -1.82 -2.54 116.25 114.84 1l5i h VAL 100 Ca 0.30 -1.29 0.01 0.00 -1.23 0.00 0.00 66.70 64.49 1l5i h VAL 100 Cb 1.99 1.21 -0.05 0.00 -2.13 0.00 0.00 31.29 32.31 1l5i h VAL 100 CO -0.00 0.44 0.64 0.50 -1.23 0.00 0.00 177.57 177.91 1l5i h LYS 101 N 0.68 1.27 -0.37 5.19 3.11 0.27 0.51 116.57 127.23 1l5i h LYS 101 Ca 0.10 -0.08 0.03 0.00 -2.81 0.00 0.00 60.65 57.89 1l5i h LYS 101 Cb 0.71 -0.29 -0.03 0.00 -1.00 0.00 0.00 32.23 31.62 1l5i h LYS 101 CO 0.05 0.84 0.17 0.77 -2.81 0.00 0.00 179.45 178.47 1l5i h SER 102 N 1.30 0.23 0.25 4.20 0.02 -1.22 -0.32 113.55 118.01 1l5i h SER 102 Ca 0.35 0.02 -0.15 0.00 -0.84 0.00 0.00 61.79 61.18 1l5i h SER 102 Cb -0.15 -0.02 -0.01 0.00 0.14 0.00 0.00 62.40 62.36 1l5i h SER 102 CO -0.08 0.17 -0.58 0.22 -1.14 0.00 0.00 176.83 175.43 1l5i h TYR 103 N 0.35 0.43 -0.45 3.45 3.20 -0.97 -2.89 116.97 120.08 1l5i h TYR 103 Ca 0.16 -0.16 -0.01 0.00 3.14 0.00 0.00 58.73 61.86 1l5i h TYR 103 Cb 0.09 -0.08 -0.02 0.00 1.54 0.00 0.00 36.73 38.26 1l5i h TYR 103 CO -0.11 0.84 0.23 0.82 -1.64 0.00 0.00 178.16 178.30 1l5i h ILE 104 N 0.25 1.15 0.00 1.81 2.04 0.69 0.90 117.51 124.36 1l5i h ILE 104 Ca -0.00 -0.39 -0.04 0.00 1.00 0.00 0.00 64.86 65.43 1l5i h ILE 104 Cb 1.09 0.55 -0.01 0.00 -0.74 0.00 0.00 36.82 37.72 1l5i h ILE 104 CO 0.10 0.16 -0.20 -0.78 0.00 0.00 0.00 178.15 177.43 1l5i h ASP 105 N 0.62 0.00 0.00 1.72 3.58 -0.86 -3.33 116.42 118.15 1l5i h ASP 105 Ca 0.16 0.00 -0.68 0.00 0.42 0.00 0.00 57.03 56.93 1l5i h ASP 105 Cb 0.04 0.00 0.01 0.00 1.72 0.00 0.00 39.33 41.10 1l5i h ASP 105 CO -0.02 0.20 2.70 0.29 -2.88 0.00 0.00 179.24 179.52 1l5i n LYS 106 N -3.58 2.14 -1.14 0.28 5.02 0.31 -4.89 118.16 116.30 1l5i n LYS 106 Ca -0.01 -2.20 -0.14 0.00 -2.02 0.00 0.00 58.31 53.94 1l5i n LYS 106 Cb 0.34 -3.09 0.10 0.00 -0.02 0.00 0.00 35.03 32.35 1l5i n LYS 106 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 1l5i n ASP 107 N 6.81 0.21 0.00 4.39 9.92 -1.25 -5.01 116.55 131.62 1l5i n ASP 107 Ca 0.51 -1.33 0.00 0.00 -0.53 0.00 0.00 54.79 53.44 1l5i n ASP 107 Cb 0.40 -0.48 0.00 0.00 -0.64 0.00 0.00 41.12 40.40 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 0.64 2.23 3.42 0.44 0.00 -1.26 -4.96 105.19 105.69 1l5i n GLY 108 Ca 0.09 -0.67 -0.15 0.00 0.00 0.00 0.00 46.02 45.29 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 -6.33 -4.11 1.61 9.92 -1.26 -4.75 116.55 111.63 1l5i n ASP 109 Ca 0.00 -0.57 -0.09 0.00 -0.53 0.00 0.00 54.79 53.60 1l5i n ASP 109 Cb 0.00 -3.76 -0.10 0.00 -0.64 0.00 0.00 41.12 36.63 1l5i n ASP 109 CO 0.00 0.00 0.00 0.68 0.13 0.00 0.00 177.20 178.01 1l5i s VAL 110 N -3.10 0.12 0.03 2.53 -7.23 -1.26 -4.20 120.40 107.28 1l5i s VAL 110 Ca 0.11 -1.82 0.01 0.00 -1.81 0.00 0.00 61.98 58.48 1l5i s VAL 110 Cb -0.03 -1.93 -0.04 0.00 0.56 0.00 0.00 36.38 34.94 1l5i s VAL 110 CO 0.82 -0.53 0.07 -0.22 -0.31 0.00 0.00 175.10 174.93 1l5i s LEU 111 N -3.02 3.80 -0.07 1.32 0.20 -0.26 -5.01 118.68 115.64 1l5i s LEU 111 Ca 0.20 0.06 -0.00 0.00 0.69 0.00 0.00 54.13 55.08 1l5i s LEU 111 Cb 0.07 -2.32 0.02 0.00 -0.43 0.00 0.00 46.19 43.53 1l5i s LEU 111 CO -0.00 0.23 -0.04 -1.61 -0.29 0.00 0.00 176.35 174.64 1l5i s GLU 112 N -1.98 1.00 0.07 1.98 8.01 -1.26 -2.01 118.70 124.51 1l5i s GLU 112 Ca 0.25 -0.09 0.02 0.00 0.01 0.00 0.00 54.97 55.17 1l5i s GLU 112 Cb -0.12 -1.14 -0.03 0.00 -4.31 0.00 0.00 34.13 28.53 1l5i s GLU 112 CO 0.17 -0.21 -0.08 -0.46 0.01 0.00 0.00 175.26 174.69 1l5i s TRP 113 N 1.52 0.83 0.31 1.61 -0.00 0.08 -5.03 118.94 118.25 1l5i s TRP 113 Ca -0.01 -0.68 0.00 0.00 -0.00 0.00 0.00 56.10 55.41 1l5i s TRP 113 Cb -0.13 -0.48 0.00 0.00 -0.00 0.00 0.00 33.47 32.86 1l5i s TRP 113 CO -0.04 -0.09 0.00 0.41 -0.00 0.00 0.00 176.95 177.23 1l5i n GLY 114 N 0.73 -2.17 3.04 5.86 0.00 -1.26 -0.07 105.19 111.32 1l5i n GLY 114 Ca -0.18 -1.23 -0.30 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 -2.51 1.61 0.40 2.61 2.01 -1.23 -4.60 115.64 113.94 1l5i s THR 115 Ca 0.00 -0.67 -0.22 0.00 0.31 0.00 0.00 61.69 61.11 1l5i s THR 115 Cb 0.00 -1.49 -0.11 0.00 0.01 0.00 0.00 72.50 70.91 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 1.33 3.40 -0.25 4.92 2.19 -1.26 -4.02 117.98 124.29 1l5i s PHE 116 Ca 0.02 1.65 -0.04 0.00 0.33 0.00 0.00 56.93 58.89 1l5i s PHE 116 Cb -0.13 -2.87 0.10 0.00 -1.31 0.00 0.00 43.02 38.80 1l5i s PHE 116 CO -0.08 -0.04 0.16 1.14 1.83 0.00 0.00 175.22 178.23 1l5i s GLN 117 N -2.91 0.18 0.33 10.12 -2.07 -1.26 -5.02 119.66 119.03 1l5i s GLN 117 Ca 0.59 -0.24 -0.23 0.00 -1.82 0.00 0.00 55.36 53.67 1l5i s GLN 117 Cb -0.11 -1.24 -0.10 0.00 -1.09 0.00 0.00 33.01 30.47 1l5i s GLN 117 CO 0.16 -0.88 0.90 0.42 -1.32 0.00 0.00 175.29 174.56 1l5i s ILE 118 N 2.19 4.35 -0.05 3.63 1.01 -1.26 -5.02 121.20 126.05 1l5i s ILE 118 Ca 0.07 1.59 -0.28 0.00 0.00 0.00 0.00 60.65 62.03 1l5i s ILE 118 Cb -0.16 -3.85 -0.03 0.00 0.01 0.00 0.00 42.46 38.44 1l5i s ILE 118 CO -0.26 0.01 0.89 -0.62 0.00 0.00 0.00 174.94 174.96 1l5i s ASP 119 N -1.82 7.21 0.00 3.58 2.15 -1.26 -4.97 116.67 121.57 1l5i s ASP 119 Ca 0.52 1.47 0.00 0.00 0.43 0.00 0.00 52.55 54.98 1l5i s ASP 119 Cb -0.15 -2.51 0.00 0.00 -0.30 0.00 0.00 42.92 39.95 1l5i s ASP 119 CO 0.20 -0.26 0.00 0.61 -0.17 0.00 0.00 175.17 175.55 1l5i n GLY 120 N 3.03 3.69 2.59 2.66 0.00 -1.26 -5.16 105.19 110.74 1l5i n GLY 120 Ca 0.04 -0.64 0.00 0.00 0.00 0.00 0.00 46.02 45.42 1l5i n GLY 120 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19