#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 1.75 3.60 0.23 0.00 -1.26 -5.11 105.19 104.40 1l5i n GLY 5 Ca 0.00 -1.21 -0.29 0.00 0.00 0.00 0.00 46.02 44.52 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 -3.64 2.19 -0.64 1.61 1.70 -1.26 -5.07 118.95 113.85 1l5i s ARG 6 Ca 0.00 -1.03 -0.27 0.00 -0.47 0.00 0.00 55.73 53.95 1l5i s ARG 6 Cb 0.00 -2.32 0.02 0.00 -0.57 0.00 0.00 34.95 32.08 1l5i s ARG 6 CO 0.00 0.50 1.36 0.12 -1.08 0.00 0.00 175.30 176.20 1l5i s PHE 7 N -1.32 2.29 -0.20 5.89 5.36 -1.26 -4.96 117.98 123.79 1l5i s PHE 7 Ca 0.23 0.29 -0.02 0.00 -0.96 0.00 0.00 56.93 56.47 1l5i s PHE 7 Cb -0.11 -4.48 0.06 0.00 -0.34 0.00 0.00 43.02 38.15 1l5i s PHE 7 CO 0.15 -1.97 0.01 0.45 -1.46 0.00 0.00 175.22 172.40 1l5i s SER 8 N 4.19 3.06 -0.14 6.13 0.15 -1.26 -4.21 113.70 121.61 1l5i s SER 8 Ca 0.45 -0.86 -0.06 0.00 0.70 0.00 0.00 55.95 56.18 1l5i s SER 8 Cb -0.09 -0.75 -0.04 0.00 -1.71 0.00 0.00 66.02 63.43 1l5i s SER 8 CO 0.21 -0.28 0.07 -0.63 1.20 0.00 0.00 173.24 173.82 1l5i s ILE 9 N 1.74 4.91 -0.20 6.45 1.01 -1.15 -4.90 121.20 129.06 1l5i s ILE 9 Ca -0.02 -0.00 -0.03 0.00 0.00 0.00 0.00 60.65 60.60 1l5i s ILE 9 Cb -0.17 -3.16 0.06 0.00 0.01 0.00 0.00 42.46 39.20 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 -0.31 0.58 0.15 2.79 1.02 -1.26 0.88 119.74 123.59 1l5i s LYS 10 Ca 0.09 -0.40 -0.24 0.00 0.02 0.00 0.00 55.97 55.44 1l5i s LYS 10 Cb -0.12 -2.07 0.06 0.00 -0.52 0.00 0.00 37.83 35.19 1l5i s LYS 10 CO 0.01 -0.66 0.75 0.00 -0.92 0.00 0.00 175.35 174.53 1l5i s ALA 11 N 1.89 -1.56 -0.19 5.17 0.00 -0.98 -4.95 121.76 121.14 1l5i s ALA 11 Ca -0.00 0.35 0.19 0.00 0.00 0.00 0.00 51.96 52.50 1l5i s ALA 11 Cb -0.17 0.74 -0.03 0.00 0.00 0.00 0.00 23.12 23.66 1l5i s ALA 11 CO -0.09 -0.86 1.03 1.57 0.00 0.00 0.00 175.76 177.41 1l5i h LYS 12 N 2.00 0.00 -6.06 0.00 5.09 -1.84 -0.76 116.57 114.99 1l5i h LYS 12 Ca -0.26 0.00 -0.68 0.00 0.09 0.00 0.00 60.65 59.79 1l5i h LYS 12 Cb 1.27 0.00 -0.25 0.00 0.10 0.00 0.00 32.23 33.35 1l5i h LYS 12 CO 0.31 0.17 -0.79 -0.80 -2.09 0.00 0.00 179.45 176.26 1l5i s ASN 13 N -5.71 3.88 -0.02 7.07 0.01 -1.26 -0.93 114.94 117.98 1l5i s ASN 13 Ca -0.01 -0.27 0.02 0.00 -0.71 0.00 0.00 52.86 51.89 1l5i s ASN 13 Cb 0.09 -1.01 0.00 0.00 0.41 0.00 0.00 41.25 40.74 1l5i s ASN 13 CO 0.79 0.29 -0.07 -0.31 -1.51 0.00 0.00 177.10 176.29 1l5i s TYR 14 N -0.41 0.74 -0.12 2.20 2.02 -0.82 -2.20 117.35 118.76 1l5i s TYR 14 Ca 0.04 -0.16 0.03 0.00 -0.37 0.00 0.00 57.07 56.61 1l5i s TYR 14 Cb -0.12 -0.53 0.01 0.00 -0.40 0.00 0.00 41.96 40.92 1l5i s TYR 14 CO 0.02 -0.07 -0.23 -0.06 -1.57 0.00 0.00 175.55 173.65 1l5i s PHE 15 N 0.13 2.56 -0.15 2.71 0.08 0.38 -1.99 117.98 121.70 1l5i s PHE 15 Ca -0.01 -1.17 -0.06 0.00 0.12 0.00 0.00 56.93 55.81 1l5i s PHE 15 Cb -0.06 -1.73 -0.04 0.00 -0.57 0.00 0.00 43.02 40.62 1l5i s PHE 15 CO -0.00 -0.51 0.04 -0.51 -0.10 0.00 0.00 175.22 174.15 1l5i s LEU 16 N 0.58 3.75 -0.16 -0.37 2.01 -0.82 -1.56 118.68 122.12 1l5i s LEU 16 Ca -0.13 0.11 0.01 0.00 0.01 0.00 0.00 54.13 54.13 1l5i s LEU 16 Cb -0.17 -1.92 0.02 0.00 0.01 0.00 0.00 46.19 44.13 1l5i s LEU 16 CO 0.04 0.24 -0.19 -0.89 1.01 0.00 0.00 176.35 176.56 1l5i s THR 17 N -0.04 1.92 -0.35 5.49 2.01 -0.98 -2.16 115.64 121.54 1l5i s THR 17 Ca 0.05 -0.86 -0.01 0.00 0.31 0.00 0.00 61.69 61.18 1l5i s THR 17 Cb -0.12 -1.74 0.08 0.00 0.01 0.00 0.00 72.50 70.73 1l5i s THR 17 CO 0.01 0.52 0.08 -0.31 -0.69 0.00 0.00 174.62 174.23 1l5i s TYR 18 N 1.23 3.49 0.29 4.92 1.51 -0.90 -1.50 117.35 126.40 1l5i s TYR 18 Ca 0.02 -2.33 -0.29 0.00 -1.01 0.00 0.00 57.07 53.46 1l5i s TYR 18 Cb -0.14 -2.70 -0.09 0.00 -0.11 0.00 0.00 41.96 38.92 1l5i s TYR 18 CO -0.10 -0.90 1.08 -1.25 -1.11 0.00 0.00 175.55 173.26 1l5i s PRO 19 N 1.13 4.59 -1.63 -1.71 0.04 -1.26 -1.83 135.00 134.34 1l5i s PRO 19 Ca 0.03 1.73 -0.18 0.00 0.04 0.00 0.00 61.00 62.62 1l5i s PRO 19 Cb -0.21 -3.11 0.18 0.00 0.04 0.00 0.00 34.50 31.41 1l5i s PRO 19 CO -0.04 0.19 0.46 0.36 0.04 0.00 0.00 177.00 178.01 1l5i n LYS 20 N 1.04 -0.77 -3.53 4.56 2.85 -0.34 -4.84 118.16 117.12 1l5i n LYS 20 Ca -0.00 0.12 -0.38 0.00 -1.05 0.00 0.00 58.31 56.99 1l5i n LYS 20 Cb 0.46 -4.04 -0.10 0.00 -0.65 0.00 0.00 35.03 30.70 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 5.03 2.01 -4.74 0.00 5.75 -1.26 -4.46 116.55 118.87 1l5i n ASP 22 Ca -0.12 -2.16 -0.41 0.00 -0.01 0.00 0.00 54.79 52.09 1l5i n ASP 22 Cb 0.52 -0.36 -0.03 0.00 -1.03 0.00 0.00 41.12 40.21 1l5i n ASP 22 CO 0.00 0.00 0.00 -0.22 -0.11 0.00 0.00 177.20 176.87 1l5i s LEU 23 N -0.99 4.45 0.55 -2.12 2.96 -1.26 -5.02 118.68 117.25 1l5i s LEU 23 Ca 0.18 2.37 -0.06 0.00 -0.22 0.00 0.00 54.13 56.41 1l5i s LEU 23 Cb 0.12 -3.62 -0.01 0.00 0.50 0.00 0.00 46.19 43.18 1l5i s LEU 23 CO 0.09 -0.43 0.86 0.42 -1.32 0.00 0.00 176.35 175.98 1l5i s THR 24 N -0.29 4.14 0.28 3.68 -4.23 -1.26 -4.94 115.64 113.03 1l5i s THR 24 Ca 0.53 0.10 0.13 0.00 -1.18 0.00 0.00 61.69 61.27 1l5i s THR 24 Cb -0.35 -3.61 0.05 0.00 1.34 0.00 0.00 72.50 69.93 1l5i s THR 24 CO 0.40 -0.62 1.71 0.07 -0.54 0.00 0.00 174.62 175.64 1l5i h LYS 25 N -0.03 0.00 -0.13 3.99 2.10 -1.96 -1.23 116.57 119.31 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 1.24 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 32.56 1l5i h LYS 25 CO 0.61 0.48 0.00 1.49 -2.00 0.00 0.00 179.45 180.03 1l5i h GLU 26 N 0.00 0.23 -0.36 0.07 4.22 -1.96 1.59 114.58 118.36 1l5i h GLU 26 Ca -0.00 -0.07 -0.06 0.00 0.08 0.00 0.00 59.36 59.31 1l5i h GLU 26 Cb 0.91 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 30.12 1l5i h GLU 26 CO 0.06 0.46 0.01 -0.91 -2.18 0.00 0.00 179.01 176.46 1l5i h ASN 27 N -0.03 0.62 0.15 1.04 -0.26 -1.93 0.35 115.58 115.51 1l5i h ASN 27 Ca 0.04 -0.30 -0.12 0.00 -0.56 0.00 0.00 56.30 55.36 1l5i h ASN 27 Cb 0.36 -0.17 -0.01 0.00 -1.06 0.00 0.00 38.32 37.44 1l5i h ASN 27 CO 0.01 0.77 -0.42 0.00 -1.06 0.00 0.00 177.43 176.72 1l5i h ALA 28 N 0.87 1.01 -0.32 -0.83 0.00 -1.15 0.26 119.26 119.10 1l5i h ALA 28 Ca 0.10 -0.43 -0.11 0.00 0.00 0.00 0.00 54.91 54.48 1l5i h ALA 28 Cb 0.44 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 1l5i h ALA 28 CO 0.02 0.62 -0.22 1.25 0.00 0.00 0.00 179.25 180.92 1l5i h LEU 29 N 0.28 0.75 -0.23 0.00 7.12 0.27 0.59 115.31 124.09 1l5i h LEU 29 Ca 0.02 -0.43 -0.09 0.00 0.13 0.00 0.00 57.88 57.51 1l5i h LEU 29 Cb 0.86 -0.21 -0.00 0.00 -0.53 0.00 0.00 40.66 40.78 1l5i h LEU 29 CO 0.07 1.02 -0.20 0.28 -0.13 0.00 0.00 178.44 179.48 1l5i h SER 30 N 0.48 0.57 -0.15 1.25 0.02 -0.10 0.52 113.55 116.14 1l5i h SER 30 Ca 0.06 -0.46 -0.02 0.00 -0.84 0.00 0.00 61.79 60.53 1l5i h SER 30 Cb 0.77 -0.16 -0.01 0.00 0.14 0.00 0.00 62.40 63.14 1l5i h SER 30 CO 0.06 0.92 0.00 1.56 -1.14 0.00 0.00 176.83 178.23 1l5i h GLN 31 N 0.23 0.26 -0.29 3.45 4.20 -0.45 0.43 115.11 122.94 1l5i h GLN 31 Ca 0.04 -0.08 -0.03 0.00 0.06 0.00 0.00 58.65 58.63 1l5i h GLN 31 Cb 0.74 -0.02 -0.01 0.00 0.30 0.00 0.00 27.48 28.49 1l5i h GLN 31 CO 0.05 0.49 0.05 0.82 -0.67 0.00 0.00 178.83 179.57 1l5i h ILE 32 N 0.00 1.23 -0.32 2.54 1.08 0.18 0.34 117.51 122.58 1l5i h ILE 32 Ca 0.04 -0.79 -0.04 0.00 -0.39 0.00 0.00 64.86 63.68 1l5i h ILE 32 Cb 0.37 1.18 -0.02 0.00 -3.07 0.00 0.00 36.82 35.29 1l5i h ILE 32 CO 0.01 0.26 0.02 0.74 -0.69 0.00 0.00 178.15 178.48 1l5i h THR 33 N 0.31 1.18 0.00 -0.27 2.02 0.13 -0.15 112.91 116.12 1l5i h THR 33 Ca 0.09 -0.69 0.00 0.00 0.77 0.00 0.00 66.41 66.58 1l5i h THR 33 Cb 0.34 0.92 0.00 0.00 -1.74 0.00 0.00 68.15 67.67 1l5i h THR 33 CO 0.01 0.24 -0.20 0.59 0.37 0.00 0.00 175.52 176.53 1l5i n ASN 34 N -4.31 0.22 -4.64 4.18 5.03 0.15 -4.77 115.26 111.11 1l5i n ASN 34 Ca 0.01 0.22 -0.43 0.00 0.87 0.00 0.00 54.58 55.26 1l5i n ASN 34 Cb 0.22 -0.22 -0.02 0.00 -1.02 0.00 0.00 39.78 38.74 1l5i n ASN 34 CO 0.00 0.00 0.00 -0.76 -1.83 0.00 0.00 177.26 174.67 1l5i s LEU 35 N -3.07 4.04 0.66 3.41 1.02 0.12 -5.00 118.68 119.85 1l5i s LEU 35 Ca 0.13 1.52 -0.11 0.00 0.02 0.00 0.00 54.13 55.69 1l5i s LEU 35 Cb 0.18 -3.54 -0.02 0.00 0.02 0.00 0.00 46.19 42.84 1l5i s LEU 35 CO 0.60 -0.96 1.05 -1.10 0.02 0.00 0.00 176.35 175.97 1l5i s GLN 36 N 3.93 3.29 0.03 1.70 -0.21 -1.26 -4.96 119.66 122.17 1l5i s GLN 36 Ca 0.58 0.67 -0.12 0.00 0.02 0.00 0.00 55.36 56.52 1l5i s GLN 36 Cb -0.21 -2.05 0.01 0.00 1.00 0.00 0.00 33.01 31.76 1l5i s GLN 36 CO 0.20 -0.78 0.26 -0.08 -2.12 0.00 0.00 175.29 172.77 1l5i s THR 37 N -3.22 0.09 -1.95 -0.19 -1.32 -1.26 -5.02 115.64 102.76 1l5i s THR 37 Ca 0.56 -0.72 0.24 0.00 -1.21 0.00 0.00 61.69 60.57 1l5i s THR 37 Cb -0.11 -0.84 0.66 0.00 -1.51 0.00 0.00 72.50 70.70 1l5i s THR 37 CO 0.53 -0.40 1.80 -0.81 -2.21 0.00 0.00 174.62 173.54 1l5i n PRO 38 N 0.80 0.72 0.00 7.08 -0.04 -1.26 -4.54 135.00 137.75 1l5i n PRO 38 Ca -0.19 0.01 0.00 0.00 -0.04 0.00 0.00 63.50 63.27 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 -1.02 0.00 -3.64 0.52 5.66 -1.26 -5.09 114.28 109.45 1l5i n THR 39 Ca 0.18 0.00 -0.04 0.00 -3.05 0.00 0.00 64.05 61.14 1l5i n THR 39 Cb 0.09 0.00 -0.07 0.00 -1.55 0.00 0.00 70.33 68.80 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 0.37 -0.34 -0.15 1.09 2.47 -1.26 -4.97 114.94 112.14 1l5i s ASN 40 Ca 0.00 0.60 -0.19 0.00 0.42 0.00 0.00 52.86 53.69 1l5i s ASN 40 Cb 0.00 0.89 -0.04 0.00 -1.45 0.00 0.00 41.25 40.65 1l5i s ASN 40 CO 0.00 -0.10 0.54 -0.54 -3.72 0.00 0.00 177.10 173.28 1l5i s LYS 41 N 0.73 4.28 0.00 0.43 1.02 -1.26 -2.31 119.74 122.63 1l5i s LYS 41 Ca -0.02 0.51 0.00 0.00 0.02 0.00 0.00 55.97 56.47 1l5i s LYS 41 Cb -0.04 -3.50 0.00 0.00 -0.52 0.00 0.00 37.83 33.77 1l5i s LYS 41 CO -0.12 -0.01 0.00 1.28 -0.92 0.00 0.00 175.35 175.59 1l5i n LEU 42 N 4.24 0.00 -4.86 3.17 4.32 -0.81 -4.98 117.00 118.07 1l5i n LEU 42 Ca -0.05 0.00 -0.28 0.00 -0.02 0.00 0.00 56.01 55.67 1l5i n LEU 42 Cb 0.51 0.00 -0.05 0.00 -1.62 0.00 0.00 43.42 42.26 1l5i n LEU 42 CO 0.43 0.00 -0.17 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 -1.25 -3.37 117.98 120.17 1l5i s PHE 43 Ca 0.00 0.08 -0.03 0.00 -0.96 0.00 0.00 56.93 56.02 1l5i s PHE 43 Cb 0.00 -1.62 0.05 0.00 -0.34 0.00 0.00 43.02 41.11 1l5i s PHE 43 CO 0.00 0.53 0.12 0.42 -1.46 0.00 0.00 175.22 174.83 1l5i s ILE 44 N -1.65 -0.17 -0.12 3.12 1.01 0.27 -2.55 121.20 121.10 1l5i s ILE 44 Ca 0.33 0.17 0.03 0.00 0.00 0.00 0.00 60.65 61.18 1l5i s ILE 44 Cb -0.11 -0.37 -0.00 0.00 0.01 0.00 0.00 42.46 41.98 1l5i s ILE 44 CO 0.26 -0.01 -0.21 -0.75 0.00 0.00 0.00 174.94 174.23 1l5i s LYS 45 N 2.21 3.12 -0.16 2.79 2.36 0.11 0.28 119.74 130.46 1l5i s LYS 45 Ca 0.04 -0.83 0.00 0.00 -2.55 0.00 0.00 55.97 52.64 1l5i s LYS 45 Cb -0.14 -2.42 0.03 0.00 -1.05 0.00 0.00 37.83 34.26 1l5i s LYS 45 CO -0.07 0.13 -0.11 0.42 1.55 0.00 0.00 175.35 177.28 1l5i s ILE 46 N 0.48 1.49 -0.03 5.43 1.01 -0.41 0.10 121.20 129.28 1l5i s ILE 46 Ca -0.14 -0.73 0.06 0.00 0.00 0.00 0.00 60.65 59.84 1l5i s ILE 46 Cb -0.17 -1.50 -0.01 0.00 0.01 0.00 0.00 42.46 40.79 1l5i s ILE 46 CO 0.05 0.31 -0.22 0.00 0.00 0.00 0.00 174.94 175.09 1l5i s ARG 48 N -0.34 3.46 -0.04 0.00 3.52 -1.26 -0.15 118.95 124.14 1l5i s ARG 48 Ca 0.04 -0.22 -0.02 0.00 -0.13 0.00 0.00 55.73 55.40 1l5i s ARG 48 Cb -0.10 -3.12 0.02 0.00 -1.56 0.00 0.00 34.95 30.19 1l5i s ARG 48 CO 0.01 0.70 0.09 -2.00 -0.81 0.00 0.00 175.30 173.29 1l5i s GLU 49 N -1.63 0.06 -0.14 5.12 2.56 -0.69 -4.92 118.70 119.07 1l5i s GLU 49 Ca 0.24 0.21 -0.10 0.00 0.00 0.00 0.00 54.97 55.31 1l5i s GLU 49 Cb -0.13 -0.09 -0.05 0.00 2.00 0.00 0.00 34.13 35.87 1l5i s GLU 49 CO 0.14 -0.09 0.21 -0.51 -0.56 0.00 0.00 175.26 174.44 1l5i s LEU 50 N 0.62 4.32 0.32 2.70 2.01 -1.26 -0.10 118.68 127.28 1l5i s LEU 50 Ca -0.05 0.47 -0.15 0.00 0.01 0.00 0.00 54.13 54.42 1l5i s LEU 50 Cb -0.07 -2.21 -0.09 0.00 0.01 0.00 0.00 46.19 43.83 1l5i s LEU 50 CO -0.02 0.26 0.73 -1.00 1.01 0.00 0.00 176.35 177.32 1l5i s HIS 51 N -0.29 3.37 -1.29 0.29 3.76 -0.15 -4.89 115.29 116.10 1l5i s HIS 51 Ca 0.15 1.20 0.14 0.00 -0.15 0.00 0.00 55.06 56.40 1l5i s HIS 51 Cb -0.13 -2.52 0.69 0.00 1.11 0.00 0.00 32.58 31.73 1l5i s HIS 51 CO 0.03 0.10 1.41 0.39 -0.85 0.00 0.00 174.74 175.83 1l5i n GLU 52 N -0.37 0.14 -0.01 1.40 1.02 -1.26 -1.39 120.64 120.17 1l5i n GLU 52 Ca 0.03 0.18 0.14 0.00 -0.02 0.00 0.00 57.16 57.50 1l5i n GLU 52 Cb 0.53 -1.50 0.69 0.00 -0.02 0.00 0.00 31.44 31.14 1l5i n GLU 52 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 1l5i n ASN 53 N -1.35 0.74 0.00 1.62 4.13 -1.26 -4.86 115.26 114.27 1l5i n ASN 53 Ca 0.06 -1.30 0.00 0.00 1.68 0.00 0.00 54.58 55.02 1l5i n ASN 53 Cb 0.13 -0.01 0.00 0.00 -1.54 0.00 0.00 39.78 38.36 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 1.06 0.81 3.74 7.41 0.00 -0.49 -5.02 105.19 112.70 1l5i n GLY 54 Ca 0.20 0.00 -0.36 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 -0.21 4.19 -0.04 1.61 -1.05 -1.24 -4.92 118.70 117.03 1l5i s GLU 55 Ca 0.00 0.07 -0.30 0.00 -0.15 0.00 0.00 54.97 54.60 1l5i s GLU 55 Cb 0.00 -3.40 -0.04 0.00 -0.44 0.00 0.00 34.13 30.25 1l5i s GLU 55 CO 0.00 0.30 1.22 -1.25 0.95 0.00 0.00 175.26 176.47 1l5i s PRO 56 N 0.29 4.36 0.18 -4.83 0.04 -1.26 -0.97 135.00 132.81 1l5i s PRO 56 Ca 0.16 1.71 0.08 0.00 0.04 0.00 0.00 61.00 62.99 1l5i s PRO 56 Cb -0.13 -3.54 -0.04 0.00 0.04 0.00 0.00 34.50 30.83 1l5i s PRO 56 CO 0.04 -0.43 -0.03 -1.58 0.04 0.00 0.00 177.00 175.04 1l5i s HIS 57 N 2.10 2.77 -0.00 0.56 2.46 0.85 0.24 115.29 124.27 1l5i s HIS 57 Ca 0.57 -0.17 0.04 0.00 0.47 0.00 0.00 55.06 55.97 1l5i s HIS 57 Cb -0.26 -1.34 -0.01 0.00 -0.13 0.00 0.00 32.58 30.84 1l5i s HIS 57 CO 0.23 0.52 -0.12 -1.17 -2.47 0.00 0.00 174.74 171.73 1l5i s LEU 58 N -2.95 2.04 0.03 8.88 1.98 -0.76 -1.70 118.68 126.21 1l5i s LEU 58 Ca 0.27 -0.25 0.08 0.00 -2.89 0.00 0.00 54.13 51.34 1l5i s LEU 58 Cb -0.09 -0.60 -0.02 0.00 0.66 0.00 0.00 46.19 46.13 1l5i s LEU 58 CO 0.18 0.13 -0.22 -1.00 -1.89 0.00 0.00 176.35 173.54 1l5i s HIS 59 N -0.36 1.98 -0.02 5.38 3.76 0.78 -2.11 115.29 124.70 1l5i s HIS 59 Ca 0.04 -0.38 -0.02 0.00 -0.15 0.00 0.00 55.06 54.54 1l5i s HIS 59 Cb -0.05 -1.20 0.01 0.00 1.11 0.00 0.00 32.58 32.45 1l5i s HIS 59 CO -0.00 0.08 0.07 0.42 -0.85 0.00 0.00 174.74 174.45 1l5i s ILE 60 N -0.75 0.01 -0.16 0.60 1.01 -0.92 -1.41 121.20 119.59 1l5i s ILE 60 Ca 0.09 -0.05 -0.04 0.00 0.00 0.00 0.00 60.65 60.64 1l5i s ILE 60 Cb -0.09 -0.12 0.06 0.00 0.01 0.00 0.00 42.46 42.32 1l5i s ILE 60 CO 0.01 -0.03 0.07 -0.22 0.00 0.00 0.00 174.94 174.77 1l5i s LEU 61 N -0.06 0.55 0.20 2.97 1.98 0.12 -1.94 118.68 122.49 1l5i s LEU 61 Ca -0.01 -0.57 0.11 0.00 -2.89 0.00 0.00 54.13 50.78 1l5i s LEU 61 Cb -0.01 -0.33 -0.04 0.00 0.66 0.00 0.00 46.19 46.46 1l5i s LEU 61 CO 0.00 -0.32 -0.24 -0.63 -1.89 0.00 0.00 176.35 173.27 1l5i s ILE 62 N 2.06 2.36 0.04 6.68 1.01 -0.84 -0.71 121.20 131.80 1l5i s ILE 62 Ca 0.02 -2.05 0.04 0.00 0.00 0.00 0.00 60.65 58.66 1l5i s ILE 62 Cb -0.16 -2.14 -0.02 0.00 0.01 0.00 0.00 42.46 40.16 1l5i s ILE 62 CO -0.08 -0.13 -0.13 0.00 0.00 0.00 0.00 174.94 174.61 1l5i s GLN 63 N -2.70 0.85 0.16 2.79 -2.07 -1.06 -1.93 119.66 115.70 1l5i s GLN 63 Ca 0.21 -0.72 0.10 0.00 -1.82 0.00 0.00 55.36 53.13 1l5i s GLN 63 Cb -0.08 -0.83 -0.04 0.00 -1.09 0.00 0.00 33.01 30.97 1l5i s GLN 63 CO 0.10 0.20 -0.22 -0.06 -1.32 0.00 0.00 175.29 173.99 1l5i s PHE 64 N -0.87 2.06 0.33 9.60 0.40 -0.11 -1.93 117.98 127.47 1l5i s PHE 64 Ca 0.00 -0.41 0.06 0.00 -0.60 0.00 0.00 56.93 55.99 1l5i s PHE 64 Cb -0.08 -1.05 0.58 0.00 0.51 0.00 0.00 43.02 42.98 1l5i s PHE 64 CO 0.01 0.38 1.81 1.49 0.70 0.00 0.00 175.22 179.61 1l5i h GLU 65 N 3.45 0.36 -5.90 0.44 4.22 -1.78 -3.44 114.58 111.93 1l5i h GLU 65 Ca -0.46 -0.11 -0.52 0.00 0.08 0.00 0.00 59.36 58.35 1l5i h GLU 65 Cb 1.20 -0.04 -0.16 0.00 0.50 0.00 0.00 28.75 30.26 1l5i h GLU 65 CO 0.46 0.54 -0.76 0.20 -2.18 0.00 0.00 179.01 177.28 1l5i s GLY 66 N -4.03 1.55 -0.21 1.92 0.00 -1.26 -5.05 107.32 100.24 1l5i s GLY 66 Ca -0.06 -1.66 -0.29 0.00 0.00 0.00 0.00 44.72 42.71 1l5i s GLY 66 CO 0.76 -1.74 2.21 0.28 0.00 0.00 0.00 173.10 174.61 1l5i n LYS 67 N -0.20 1.95 -3.19 2.90 5.02 -1.26 -4.67 118.16 118.71 1l5i n LYS 67 Ca -0.09 0.54 -0.39 0.00 -2.02 0.00 0.00 58.31 56.35 1l5i n LYS 67 Cb 0.59 -3.19 -0.06 0.00 -0.02 0.00 0.00 35.03 32.35 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 8.12 3.66 -0.36 2.13 5.04 -0.29 -4.80 117.35 130.85 1l5i s TYR 68 Ca 1.01 1.19 -0.16 0.00 -2.44 0.00 0.00 57.07 56.67 1l5i s TYR 68 Cb -0.37 -2.63 -0.00 0.00 0.35 0.00 0.00 41.96 39.31 1l5i s TYR 68 CO 0.36 0.31 0.42 1.21 -1.34 0.00 0.00 175.55 176.51 1l5i s ASN 69 N -0.03 6.22 -0.83 4.32 3.04 -1.26 -2.31 114.94 124.09 1l5i s ASN 69 Ca 0.32 -0.27 0.02 0.00 0.04 0.00 0.00 52.86 52.96 1l5i s ASN 69 Cb -0.18 -2.22 0.28 0.00 -1.54 0.00 0.00 41.25 37.59 1l5i s ASN 69 CO 0.17 -0.42 1.08 0.00 -3.04 0.00 0.00 177.10 174.89 1l5i n THR 71 N 1.01 2.34 -3.65 0.00 5.66 -1.26 -2.94 114.28 115.44 1l5i n THR 71 Ca 0.29 -1.18 -0.05 0.00 -3.05 0.00 0.00 64.05 60.05 1l5i n THR 71 Cb 0.37 -0.64 -0.06 0.00 -1.55 0.00 0.00 70.33 68.45 1l5i n THR 71 CO 0.00 0.00 0.00 0.21 -3.05 0.00 0.00 175.07 172.23 1l5i s ASN 72 N -0.45 -0.96 -0.25 1.09 2.47 -1.26 -4.73 114.94 110.85 1l5i s ASN 72 Ca 0.36 1.47 0.00 0.00 0.42 0.00 0.00 52.86 55.11 1l5i s ASN 72 Cb 0.30 1.70 0.23 0.00 -1.45 0.00 0.00 41.25 42.03 1l5i s ASN 72 CO 0.07 -0.23 1.76 0.00 -3.72 0.00 0.00 177.10 174.98 1l5i n GLN 73 N 4.82 1.65 -0.00 0.43 6.02 -1.26 -3.50 117.38 125.53 1l5i n GLN 73 Ca -0.16 -1.36 0.02 0.00 -0.01 0.00 0.00 57.00 55.48 1l5i n GLN 73 Cb 0.54 -1.53 -0.02 0.00 1.02 0.00 0.00 30.24 30.25 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 0.19 2.77 0.15 -1.09 1.74 -1.26 -4.37 116.66 114.78 1l5i n ARG 74 Ca 0.26 -0.02 0.03 0.00 -0.77 0.00 0.00 57.85 57.36 1l5i n ARG 74 Cb 0.75 -0.88 0.12 0.00 -1.02 0.00 0.00 32.46 31.43 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 0.00 -0.48 -1.55 3.04 -2.01 -3.10 116.94 112.84 1l5i h PHE 75 Ca 0.00 0.00 0.00 0.00 3.98 0.00 0.00 57.97 61.95 1l5i h PHE 75 Cb 0.12 0.00 0.00 0.00 2.56 0.00 0.00 35.95 38.63 1l5i h PHE 75 CO 0.00 0.51 0.00 1.19 -2.02 0.00 0.00 178.31 177.99 1l5i n PHE 76 N -3.34 0.97 -1.88 0.41 3.72 -1.26 -4.95 117.46 111.13 1l5i n PHE 76 Ca 0.01 -0.61 -0.42 0.00 -0.05 0.00 0.00 57.45 56.38 1l5i n PHE 76 Cb 0.68 -0.16 -0.03 0.00 -0.94 0.00 0.00 39.48 39.03 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 -1.15 5.59 -0.12 4.37 1.01 -1.17 -4.46 116.67 120.74 1l5i s ASP 77 Ca 0.39 1.28 -0.04 0.00 0.71 0.00 0.00 52.55 54.90 1l5i s ASP 77 Cb 0.25 -2.52 -0.03 0.00 1.01 0.00 0.00 42.92 41.63 1l5i s ASP 77 CO 0.19 -1.95 0.03 -0.76 0.21 0.00 0.00 175.17 172.89 1l5i s LEU 78 N 7.93 3.68 0.32 1.23 1.43 -0.93 -4.97 118.68 127.39 1l5i s LEU 78 Ca 0.84 0.14 0.09 0.00 -1.03 0.00 0.00 54.13 54.17 1l5i s LEU 78 Cb -0.23 -1.87 -0.06 0.00 0.03 0.00 0.00 46.19 44.06 1l5i s LEU 78 CO 0.32 0.32 -0.09 0.68 0.23 0.00 0.00 176.35 177.80 1l5i s VAL 79 N -0.50 2.09 -0.28 -1.59 -7.23 -1.26 0.43 120.40 112.06 1l5i s VAL 79 Ca 0.09 -2.19 -0.24 0.00 -1.81 0.00 0.00 61.98 57.83 1l5i s VAL 79 Cb -0.12 -2.58 -0.00 0.00 0.56 0.00 0.00 36.38 34.24 1l5i s VAL 79 CO 0.02 -0.23 0.83 -0.55 -0.31 0.00 0.00 175.10 174.86 1l5i s SER 80 N -3.56 6.77 0.00 4.85 0.15 0.10 -4.90 113.70 117.11 1l5i s SER 80 Ca 0.32 0.87 0.23 0.00 0.70 0.00 0.00 55.95 58.07 1l5i s SER 80 Cb 0.03 -2.43 1.23 0.00 -1.71 0.00 0.00 66.02 63.13 1l5i s SER 80 CO 0.15 -0.59 1.75 -0.81 1.20 0.00 0.00 173.24 174.94 1l5i n PRO 81 N 6.17 0.45 -0.01 5.44 -0.04 -1.26 -2.55 135.00 143.20 1l5i n PRO 81 Ca 0.05 0.05 0.04 0.00 -0.04 0.00 0.00 63.50 63.60 1l5i n PRO 81 Cb 0.48 -1.50 -0.06 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 -1.20 0.04 -4.24 0.52 -2.24 -1.26 -5.01 114.28 100.89 1l5i n THR 82 Ca 0.13 -0.20 -0.17 0.00 -2.27 0.00 0.00 64.05 61.54 1l5i n THR 82 Cb 0.15 0.23 -0.13 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 -2.55 0.68 -0.90 -0.78 3.52 -1.06 -5.03 118.95 112.82 1l5i s ARG 83 Ca -0.03 -0.53 -0.07 0.00 -0.13 0.00 0.00 55.73 54.96 1l5i s ARG 83 Cb 0.05 -0.61 -0.12 0.00 -1.56 0.00 0.00 34.95 32.71 1l5i s ARG 83 CO 0.35 0.15 2.74 0.45 -0.81 0.00 0.00 175.30 178.17 1l5i n SER 84 N 2.24 6.21 -4.12 -2.12 2.88 -1.26 -3.83 113.62 113.63 1l5i n SER 84 Ca -0.17 -2.41 -0.21 0.00 -1.33 0.00 0.00 58.87 54.75 1l5i n SER 84 Cb 0.56 -1.29 -0.15 0.00 -0.75 0.00 0.00 64.21 62.58 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 2.29 1.15 0.05 -1.46 0.00 -1.26 -5.04 121.76 117.50 1l5i s ALA 85 Ca 0.56 -0.66 0.04 0.00 0.00 0.00 0.00 51.96 51.89 1l5i s ALA 85 Cb 0.18 -0.26 -0.04 0.00 0.00 0.00 0.00 23.12 23.00 1l5i s ALA 85 CO -0.03 0.26 -0.01 -1.01 0.00 0.00 0.00 175.76 174.97 1l5i s HIS 86 N -0.48 3.01 -0.05 0.00 3.76 -1.26 -0.72 115.29 119.55 1l5i s HIS 86 Ca 0.04 0.00 0.04 0.00 -0.15 0.00 0.00 55.06 55.00 1l5i s HIS 86 Cb -0.06 -1.58 -0.00 0.00 1.11 0.00 0.00 32.58 32.04 1l5i s HIS 86 CO 0.00 0.46 -0.17 -0.06 -0.85 0.00 0.00 174.74 174.13 1l5i s PHE 87 N -1.21 1.69 -0.43 1.40 0.08 0.17 -4.96 117.98 114.71 1l5i s PHE 87 Ca 0.23 -0.50 -0.07 0.00 0.12 0.00 0.00 56.93 56.71 1l5i s PHE 87 Cb -0.12 -1.14 0.10 0.00 -0.57 0.00 0.00 43.02 41.29 1l5i s PHE 87 CO 0.15 -0.18 0.27 -1.58 -0.10 0.00 0.00 175.22 173.78 1l5i s HIS 88 N 0.10 3.45 0.83 0.36 5.65 -1.26 -2.18 115.29 122.23 1l5i s HIS 88 Ca -0.05 -1.96 -0.12 0.00 0.25 0.00 0.00 55.06 53.19 1l5i s HIS 88 Cb -0.12 -3.23 0.09 0.00 -1.18 0.00 0.00 32.58 28.14 1l5i s HIS 88 CO 0.02 -0.95 1.11 -1.25 -0.65 0.00 0.00 174.74 173.03 1l5i s PRO 89 N 1.31 1.84 -0.26 2.88 0.04 -1.26 -4.90 135.00 134.64 1l5i s PRO 89 Ca 0.05 0.54 -0.10 0.00 0.04 0.00 0.00 61.00 61.53 1l5i s PRO 89 Cb -0.24 -1.90 -0.05 0.00 0.04 0.00 0.00 34.50 32.35 1l5i s PRO 89 CO -0.01 -1.77 0.17 1.21 0.04 0.00 0.00 177.00 176.63 1l5i s ASN 90 N -3.94 6.01 -0.08 6.66 3.84 -0.56 -4.83 114.94 122.03 1l5i s ASN 90 Ca 0.62 0.04 -0.23 0.00 0.21 0.00 0.00 52.86 53.49 1l5i s ASN 90 Cb -0.14 -2.10 -0.03 0.00 -0.55 0.00 0.00 41.25 38.42 1l5i s ASN 90 CO 0.54 0.01 0.69 -0.63 -2.79 0.00 0.00 177.10 174.93 1l5i s ILE 91 N 1.37 5.04 -0.03 -5.21 1.01 -1.26 -2.31 121.20 119.82 1l5i s ILE 91 Ca 0.07 1.42 0.01 0.00 0.00 0.00 0.00 60.65 62.15 1l5i s ILE 91 Cb -0.15 -4.03 0.02 0.00 0.01 0.00 0.00 42.46 38.31 1l5i s ILE 91 CO 0.07 0.23 -0.04 -1.10 0.00 0.00 0.00 174.94 174.10 1l5i s GLN 92 N 0.95 0.63 -0.24 2.79 -1.52 -0.60 -4.95 119.66 116.72 1l5i s GLN 92 Ca 0.36 -0.10 -0.12 0.00 -1.95 0.00 0.00 55.36 53.55 1l5i s GLN 92 Cb -0.17 -0.66 -0.05 0.00 -0.22 0.00 0.00 33.01 31.91 1l5i s GLN 92 CO 0.17 -0.03 0.22 0.20 -0.25 0.00 0.00 175.29 175.60 1l5i s GLY 93 N 0.62 1.99 -0.39 3.09 0.00 -1.26 -0.47 107.32 110.90 1l5i s GLY 93 Ca -0.08 -0.85 -0.29 0.00 0.00 0.00 0.00 44.72 43.51 1l5i s GLY 93 CO -0.00 0.55 1.13 0.00 0.00 0.00 0.00 173.10 174.78 1l5i s ALA 94 N 1.28 3.32 -1.11 3.20 0.00 -0.94 -4.86 121.76 122.66 1l5i s ALA 94 Ca 0.10 -0.23 0.12 0.00 0.00 0.00 0.00 51.96 51.95 1l5i s ALA 94 Cb -0.14 -3.79 0.52 0.00 0.00 0.00 0.00 23.12 19.71 1l5i s ALA 94 CO 0.06 -1.88 1.35 1.63 0.00 0.00 0.00 175.76 176.93 1l5i n LYS 95 N 7.37 0.04 -3.43 0.00 5.02 -1.26 -4.57 118.16 121.33 1l5i n LYS 95 Ca 0.12 0.27 -0.22 0.00 -2.02 0.00 0.00 58.31 56.46 1l5i n LYS 95 Cb 0.48 -1.50 0.02 0.00 -0.02 0.00 0.00 35.03 34.01 1l5i n LYS 95 CO 0.00 0.00 0.00 -1.12 -0.52 0.00 0.00 177.40 175.76 1l5i s SER 96 N -2.89 4.96 0.01 4.39 0.01 -1.26 -5.07 113.70 113.85 1l5i s SER 96 Ca 0.07 -0.94 0.00 0.00 1.31 0.00 0.00 55.95 56.39 1l5i s SER 96 Cb 0.08 0.13 0.00 0.00 0.21 0.00 0.00 66.02 66.44 1l5i s SER 96 CO 0.20 -1.10 0.00 -1.54 0.41 0.00 0.00 173.24 171.21 1l5i n SER 97 N -1.93 0.02 0.06 2.44 3.41 -1.26 -4.80 113.62 111.56 1l5i n SER 97 Ca 0.07 0.01 -0.08 0.00 -0.26 0.00 0.00 58.87 58.61 1l5i n SER 97 Cb 0.62 -0.00 -0.12 0.00 -0.26 0.00 0.00 64.21 64.45 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 0.04 -0.59 4.04 0.02 -1.99 -3.22 113.55 111.85 1l5i h SER 98 Ca 0.00 -0.05 0.17 0.00 -0.84 0.00 0.00 61.79 61.07 1l5i h SER 98 Cb 0.56 -0.01 -0.02 0.00 0.14 0.00 0.00 62.40 63.06 1l5i h SER 98 CO 0.00 1.04 0.84 -2.24 -1.14 0.00 0.00 176.83 175.33 1l5i h ASP 99 N 0.01 0.00 -0.42 3.07 2.03 -2.00 1.90 116.42 121.00 1l5i h ASP 99 Ca -0.04 0.00 -0.10 0.00 -0.73 0.00 0.00 57.03 56.16 1l5i h ASP 99 Cb 1.80 0.00 -0.01 0.00 -0.83 0.00 0.00 39.33 40.29 1l5i h ASP 99 CO 0.13 0.00 -0.12 -0.37 -1.03 0.00 0.00 179.24 177.85 1l5i h VAL 100 N 0.00 1.27 -0.91 4.15 -1.51 -1.89 -2.57 116.25 114.79 1l5i h VAL 100 Ca 0.28 -1.24 -0.00 0.00 -1.23 0.00 0.00 66.70 64.51 1l5i h VAL 100 Cb 1.96 1.19 -0.04 0.00 -2.13 0.00 0.00 31.29 32.27 1l5i h VAL 100 CO -0.00 0.42 0.56 0.50 -1.23 0.00 0.00 177.57 177.82 1l5i h LYS 101 N 0.65 1.23 -0.46 5.19 3.11 0.28 0.24 116.57 126.81 1l5i h LYS 101 Ca 0.10 -0.10 0.04 0.00 -2.81 0.00 0.00 60.65 57.88 1l5i h LYS 101 Cb 0.66 -0.26 -0.04 0.00 -1.00 0.00 0.00 32.23 31.59 1l5i h LYS 101 CO 0.05 0.85 0.23 1.03 -2.81 0.00 0.00 179.45 178.80 1l5i h SER 102 N 1.26 0.34 0.23 4.20 0.87 -1.20 -1.02 113.55 118.22 1l5i h SER 102 Ca 0.33 0.02 -0.14 0.00 -1.23 0.00 0.00 61.79 60.77 1l5i h SER 102 Cb -0.07 -0.04 -0.01 0.00 -0.44 0.00 0.00 62.40 61.84 1l5i h SER 102 CO -0.06 0.24 -0.55 0.22 -0.53 0.00 0.00 176.83 176.15 1l5i h TYR 103 N 0.46 0.43 0.00 2.24 3.20 -0.99 -2.35 116.97 119.95 1l5i h TYR 103 Ca 0.20 -0.15 -0.02 0.00 3.14 0.00 0.00 58.73 61.90 1l5i h TYR 103 Cb 0.10 -0.08 -0.00 0.00 1.54 0.00 0.00 36.73 38.29 1l5i h TYR 103 CO -0.10 0.81 -0.08 0.82 -1.64 0.00 0.00 178.16 177.97 1l5i h ILE 104 N 0.26 0.75 0.18 1.81 2.04 0.27 -1.46 117.51 121.36 1l5i h ILE 104 Ca 0.00 -0.31 -0.32 0.00 1.00 0.00 0.00 64.86 65.23 1l5i h ILE 104 Cb 1.05 1.19 0.02 0.00 -0.74 0.00 0.00 36.82 38.33 1l5i h ILE 104 CO 0.09 0.08 -1.47 -0.78 0.00 0.00 0.00 178.15 176.07 1l5i h ASP 105 N 0.00 0.60 0.00 1.72 3.58 -0.85 -3.27 116.42 118.20 1l5i h ASP 105 Ca -0.00 -0.71 0.00 0.00 0.42 0.00 0.00 57.03 56.74 1l5i h ASP 105 Cb 0.18 -0.20 0.00 0.00 1.72 0.00 0.00 39.33 41.03 1l5i h ASP 105 CO 0.01 1.57 0.00 2.29 -2.88 0.00 0.00 179.24 180.23 1l5i n LYS 106 N -3.59 0.78 -2.10 0.28 2.85 -0.55 -4.81 118.16 111.01 1l5i n LYS 106 Ca -0.16 0.00 -0.28 0.00 -1.05 0.00 0.00 58.31 56.82 1l5i n LYS 106 Cb 1.07 -1.11 0.18 0.00 -0.65 0.00 0.00 35.03 34.52 1l5i n LYS 106 CO 0.00 0.00 0.00 0.16 -0.05 0.00 0.00 177.40 177.51 1l5i s ASP 107 N 1.58 3.23 0.00 -5.58 1.47 -1.21 -5.01 116.67 111.15 1l5i s ASP 107 Ca 0.00 0.03 0.00 0.00 1.18 0.00 0.00 52.55 53.76 1l5i s ASP 107 Cb 0.00 -0.09 0.00 0.00 -0.34 0.00 0.00 42.92 42.49 1l5i s ASP 107 CO 0.00 -2.63 0.00 0.61 0.68 0.00 0.00 175.17 173.83 1l5i n GLY 108 N -3.60 -0.10 1.36 2.12 0.00 -1.26 -5.03 105.19 98.68 1l5i n GLY 108 Ca 0.16 0.58 -0.01 0.00 0.00 0.00 0.00 46.02 46.75 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 -2.11 -4.22 1.61 8.00 -1.26 -5.00 116.55 113.57 1l5i n ASP 109 Ca 0.00 -0.03 -0.13 0.00 0.71 0.00 0.00 54.79 55.34 1l5i n ASP 109 Cb 0.00 -0.70 -0.10 0.00 -0.02 0.00 0.00 41.12 40.30 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 -3.02 0.38 -0.18 2.53 -7.23 -1.26 -4.54 120.40 107.07 1l5i s VAL 110 Ca 0.01 -1.97 -0.07 0.00 -1.81 0.00 0.00 61.98 58.15 1l5i s VAL 110 Cb -0.00 -2.26 -0.04 0.00 0.56 0.00 0.00 36.38 34.64 1l5i s VAL 110 CO 0.03 -0.30 0.05 -0.22 -0.31 0.00 0.00 175.10 174.35 1l5i s LEU 111 N -3.16 3.71 -0.02 1.32 0.20 -0.31 -5.00 118.68 115.42 1l5i s LEU 111 Ca 0.29 0.03 0.02 0.00 0.69 0.00 0.00 54.13 55.16 1l5i s LEU 111 Cb 0.07 -1.94 -0.03 0.00 -0.43 0.00 0.00 46.19 43.86 1l5i s LEU 111 CO 0.07 0.16 -0.05 -1.61 -0.29 0.00 0.00 176.35 174.62 1l5i s GLU 112 N 0.47 2.66 0.03 1.98 8.01 -1.26 -1.29 118.70 129.30 1l5i s GLU 112 Ca 0.02 -0.65 -0.02 0.00 0.01 0.00 0.00 54.97 54.33 1l5i s GLU 112 Cb -0.13 -2.57 -0.02 0.00 -4.31 0.00 0.00 34.13 27.10 1l5i s GLU 112 CO 0.01 0.62 0.01 -0.46 0.01 0.00 0.00 175.26 175.46 1l5i s TRP 113 N -0.97 0.31 0.28 1.61 -0.00 0.14 -5.02 118.94 115.30 1l5i s TRP 113 Ca 0.16 -0.67 0.00 0.00 -0.00 0.00 0.00 56.10 55.59 1l5i s TRP 113 Cb -0.11 -0.23 0.00 0.00 -0.00 0.00 0.00 33.47 33.13 1l5i s TRP 113 CO 0.07 -0.30 0.00 0.41 -0.00 0.00 0.00 176.95 177.12 1l5i n GLY 114 N 0.89 -1.55 3.06 5.86 0.00 -1.26 -0.56 105.19 111.62 1l5i n GLY 114 Ca -0.19 -0.93 -0.28 0.00 0.00 0.00 0.00 46.02 44.61 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 -2.02 1.47 0.44 2.61 2.01 -1.22 -4.61 115.64 114.32 1l5i s THR 115 Ca 0.00 -0.64 -0.20 0.00 0.31 0.00 0.00 61.69 61.16 1l5i s THR 115 Cb 0.00 -1.33 -0.10 0.00 0.01 0.00 0.00 72.50 71.07 1l5i s THR 115 CO 0.00 0.43 0.96 0.12 -0.69 0.00 0.00 174.62 175.44 1l5i s PHE 116 N 0.87 3.32 -0.05 4.92 2.19 -1.26 -3.85 117.98 124.12 1l5i s PHE 116 Ca -0.09 1.59 -0.02 0.00 0.33 0.00 0.00 56.93 58.74 1l5i s PHE 116 Cb -0.15 -2.85 0.04 0.00 -1.31 0.00 0.00 43.02 38.74 1l5i s PHE 116 CO 0.00 -0.17 0.09 1.14 1.83 0.00 0.00 175.22 178.11 1l5i s GLN 117 N -3.32 -0.00 -0.18 10.12 -2.07 -1.26 -5.00 119.66 117.95 1l5i s GLN 117 Ca 0.62 0.35 -0.13 0.00 -1.82 0.00 0.00 55.36 54.37 1l5i s GLN 117 Cb -0.09 -0.30 -0.05 0.00 -1.09 0.00 0.00 33.01 31.48 1l5i s GLN 117 CO 0.16 -0.23 0.28 0.42 -1.32 0.00 0.00 175.29 174.60 1l5i s ILE 118 N 1.59 5.30 -0.16 3.63 1.09 -1.26 -5.04 121.20 126.35 1l5i s ILE 118 Ca -0.03 0.50 -0.29 0.00 -1.10 0.00 0.00 60.65 59.73 1l5i s ILE 118 Cb -0.12 -3.62 -0.02 0.00 -1.06 0.00 0.00 42.46 37.64 1l5i s ILE 118 CO -0.04 0.36 1.27 1.51 -0.10 0.00 0.00 174.94 177.94 1l5i s ASP 119 N 0.63 6.94 0.00 3.58 -4.77 -1.26 -4.51 116.67 117.29 1l5i s ASP 119 Ca 0.15 1.71 0.00 0.00 -3.30 0.00 0.00 52.55 51.11 1l5i s ASP 119 Cb -0.13 -2.54 0.00 0.00 -1.09 0.00 0.00 42.92 39.16 1l5i s ASP 119 CO 0.04 -0.76 0.00 0.61 0.70 0.00 0.00 175.17 175.76 1l5i n GLY 120 N 3.61 1.16 0.02 2.12 0.00 -1.26 -5.18 105.19 105.66 1l5i n GLY 120 Ca 0.14 -1.03 0.16 0.00 0.00 0.00 0.00 46.02 45.29 1l5i n GLY 120 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19