#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 0.76 3.18 0.23 0.00 -1.26 -5.15 105.19 102.95 1l5i n GLY 5 Ca 0.00 -0.73 -0.18 0.00 0.00 0.00 0.00 46.02 45.11 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 -1.39 0.85 -0.60 1.61 0.52 -1.26 -5.09 118.95 113.59 1l5i s ARG 6 Ca 0.00 -1.00 -0.27 0.00 -0.52 0.00 0.00 55.73 53.94 1l5i s ARG 6 Cb 0.00 -0.83 0.00 0.00 0.52 0.00 0.00 34.95 34.64 1l5i s ARG 6 CO 0.00 0.18 1.57 0.12 0.02 0.00 0.00 175.30 177.19 1l5i s PHE 7 N -1.42 2.03 -0.20 -0.53 5.36 -1.26 -4.94 117.98 117.01 1l5i s PHE 7 Ca -0.00 0.49 -0.02 0.00 -0.96 0.00 0.00 56.93 56.44 1l5i s PHE 7 Cb -0.09 -4.31 0.06 0.00 -0.34 0.00 0.00 43.02 38.34 1l5i s PHE 7 CO 0.02 -2.18 0.01 -1.54 -1.46 0.00 0.00 175.22 170.07 1l5i s SER 8 N 5.70 3.10 -0.15 6.13 1.04 -1.26 -4.24 113.70 124.02 1l5i s SER 8 Ca 0.56 -0.88 -0.07 0.00 0.48 0.00 0.00 55.95 56.04 1l5i s SER 8 Cb -0.12 -0.74 -0.04 0.00 0.10 0.00 0.00 66.02 65.22 1l5i s SER 8 CO 0.22 -0.28 0.09 -0.63 0.98 0.00 0.00 173.24 173.62 1l5i s ILE 9 N 1.74 5.02 -0.17 -1.02 1.01 -1.15 -4.91 121.20 121.73 1l5i s ILE 9 Ca -0.02 0.04 -0.03 0.00 0.00 0.00 0.00 60.65 60.64 1l5i s ILE 9 Cb -0.17 -3.22 0.05 0.00 0.01 0.00 0.00 42.46 39.13 1l5i s ILE 9 CO -0.07 0.53 0.03 -0.54 0.00 0.00 0.00 174.94 174.89 1l5i s LYS 10 N -0.24 0.61 0.15 2.79 1.02 -1.26 0.77 119.74 123.58 1l5i s LYS 10 Ca 0.09 -0.31 -0.24 0.00 0.02 0.00 0.00 55.97 55.52 1l5i s LYS 10 Cb -0.12 -1.91 0.07 0.00 -0.52 0.00 0.00 37.83 35.34 1l5i s LYS 10 CO 0.01 -0.59 0.74 0.00 -0.92 0.00 0.00 175.35 174.59 1l5i s ALA 11 N 1.89 -1.57 0.04 5.17 0.00 -0.96 -4.96 121.76 121.38 1l5i s ALA 11 Ca 0.00 0.38 0.03 0.00 0.00 0.00 0.00 51.96 52.38 1l5i s ALA 11 Cb -0.16 0.75 -0.25 0.00 0.00 0.00 0.00 23.12 23.46 1l5i s ALA 11 CO -0.08 -0.85 0.99 -0.22 0.00 0.00 0.00 175.76 175.61 1l5i h LYS 12 N 2.00 0.12 -6.49 0.00 3.64 -1.83 0.11 116.57 114.12 1l5i h LYS 12 Ca -0.27 -0.20 -0.68 0.00 -1.27 0.00 0.00 60.65 58.24 1l5i h LYS 12 Cb 1.27 0.07 -0.19 0.00 -0.41 0.00 0.00 32.23 32.97 1l5i h LYS 12 CO 0.32 0.96 -0.76 -0.80 -2.27 0.00 0.00 179.45 176.89 1l5i s ASN 13 N -6.73 4.14 0.00 4.20 0.01 -1.26 -0.03 114.94 115.28 1l5i s ASN 13 Ca -0.04 -0.34 0.03 0.00 -0.71 0.00 0.00 52.86 51.79 1l5i s ASN 13 Cb 0.08 -0.78 -0.01 0.00 0.41 0.00 0.00 41.25 40.95 1l5i s ASN 13 CO 0.84 0.25 -0.08 -0.31 -1.51 0.00 0.00 177.10 176.28 1l5i s TYR 14 N -1.00 0.74 -0.17 2.20 2.02 -0.08 -1.81 117.35 119.26 1l5i s TYR 14 Ca 0.16 -0.18 0.01 0.00 -0.37 0.00 0.00 57.07 56.70 1l5i s TYR 14 Cb -0.11 -0.47 0.02 0.00 -0.40 0.00 0.00 41.96 41.00 1l5i s TYR 14 CO 0.07 -0.01 -0.20 -0.06 -1.57 0.00 0.00 175.55 173.77 1l5i s PHE 15 N -0.34 2.72 -0.15 2.71 0.08 0.23 -1.67 117.98 121.57 1l5i s PHE 15 Ca 0.02 -1.54 -0.06 0.00 0.12 0.00 0.00 56.93 55.47 1l5i s PHE 15 Cb -0.04 -1.88 -0.04 0.00 -0.57 0.00 0.00 43.02 40.50 1l5i s PHE 15 CO -0.00 -0.74 0.05 -0.51 -0.10 0.00 0.00 175.22 173.92 1l5i s LEU 16 N 1.14 3.82 -0.18 -0.37 2.01 -0.54 -1.74 118.68 122.82 1l5i s LEU 16 Ca 0.01 0.15 0.01 0.00 0.01 0.00 0.00 54.13 54.31 1l5i s LEU 16 Cb -0.14 -1.94 0.03 0.00 0.01 0.00 0.00 46.19 44.15 1l5i s LEU 16 CO -0.09 0.27 -0.17 -0.89 1.01 0.00 0.00 176.35 176.48 1l5i s THR 17 N -0.19 1.90 -0.44 5.49 2.01 -1.00 -2.26 115.64 121.16 1l5i s THR 17 Ca 0.07 -0.93 -0.08 0.00 0.31 0.00 0.00 61.69 61.06 1l5i s THR 17 Cb -0.12 -1.78 0.10 0.00 0.01 0.00 0.00 72.50 70.71 1l5i s THR 17 CO 0.01 0.42 0.29 -0.31 -0.69 0.00 0.00 174.62 174.34 1l5i s TYR 18 N 1.34 3.43 0.22 4.92 1.51 -0.96 -1.47 117.35 126.32 1l5i s TYR 18 Ca 0.03 -1.87 -0.30 0.00 -1.01 0.00 0.00 57.07 53.92 1l5i s TYR 18 Cb -0.14 -3.25 -0.08 0.00 -0.11 0.00 0.00 41.96 38.37 1l5i s TYR 18 CO -0.11 -0.94 1.10 -1.25 -1.11 0.00 0.00 175.55 173.23 1l5i s PRO 19 N 1.34 4.62 -1.58 -1.71 0.04 -1.26 -2.40 135.00 134.05 1l5i s PRO 19 Ca 0.05 1.75 -0.06 0.00 0.04 0.00 0.00 61.00 62.78 1l5i s PRO 19 Cb -0.24 -3.24 0.06 0.00 0.04 0.00 0.00 34.50 31.12 1l5i s PRO 19 CO -0.01 0.14 0.16 1.63 0.04 0.00 0.00 177.00 178.96 1l5i n LYS 20 N 1.88 -0.88 -3.77 4.56 5.02 0.56 -4.87 118.16 120.66 1l5i n LYS 20 Ca 0.01 0.10 -0.36 0.00 -2.02 0.00 0.00 58.31 56.04 1l5i n LYS 20 Cb 0.46 -3.73 -0.12 0.00 -0.02 0.00 0.00 35.03 31.61 1l5i n LYS 20 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1l5i n ASP 22 N 4.85 1.91 -4.75 0.00 5.75 -1.26 -4.32 116.55 118.73 1l5i n ASP 22 Ca -0.16 -2.14 -0.41 0.00 -0.01 0.00 0.00 54.79 52.07 1l5i n ASP 22 Cb 0.51 -0.34 -0.03 0.00 -1.03 0.00 0.00 41.12 40.23 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 -0.98 4.44 0.58 -2.12 2.96 -1.26 -5.02 118.68 117.29 1l5i s LEU 23 Ca 0.18 2.41 -0.06 0.00 -0.22 0.00 0.00 54.13 56.44 1l5i s LEU 23 Cb 0.11 -3.62 0.01 0.00 0.50 0.00 0.00 46.19 43.19 1l5i s LEU 23 CO 0.09 -0.45 0.89 0.42 -1.32 0.00 0.00 176.35 175.98 1l5i s THR 24 N -0.33 3.73 0.26 3.68 -4.23 -1.26 -4.92 115.64 112.57 1l5i s THR 24 Ca 0.53 -0.00 0.14 0.00 -1.18 0.00 0.00 61.69 61.17 1l5i s THR 24 Cb -0.36 -3.47 0.06 0.00 1.34 0.00 0.00 72.50 70.06 1l5i s THR 24 CO 0.41 -0.48 1.71 0.07 -0.54 0.00 0.00 174.62 175.79 1l5i h LYS 25 N -0.14 0.00 -0.06 3.99 2.10 -1.96 -1.45 116.57 119.06 1l5i h LYS 25 Ca -0.45 0.00 -0.01 0.00 -2.00 0.00 0.00 60.65 58.19 1l5i h LYS 25 Cb 1.25 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 32.58 1l5i h LYS 25 CO 0.61 0.48 0.01 1.49 -2.00 0.00 0.00 179.45 180.03 1l5i h GLU 26 N 0.00 0.10 -0.39 0.07 4.81 -1.97 1.60 114.58 118.80 1l5i h GLU 26 Ca -0.00 -0.03 -0.05 0.00 -0.13 0.00 0.00 59.36 59.14 1l5i h GLU 26 Cb 0.93 -0.01 -0.01 0.00 0.63 0.00 0.00 28.75 30.28 1l5i h GLU 26 CO 0.06 0.33 0.03 -0.91 -0.73 0.00 0.00 179.01 177.79 1l5i h ASN 27 N -0.14 0.65 0.22 1.04 -0.26 -1.94 0.28 115.58 115.42 1l5i h ASN 27 Ca 0.02 -0.28 -0.10 0.00 -0.56 0.00 0.00 56.30 55.37 1l5i h ASN 27 Cb 0.27 -0.17 -0.01 0.00 -1.06 0.00 0.00 38.32 37.35 1l5i h ASN 27 CO 0.00 0.77 -0.40 0.00 -1.06 0.00 0.00 177.43 176.74 1l5i h ALA 28 N 0.90 1.12 -0.21 -0.83 0.00 -1.17 0.32 119.26 119.39 1l5i h ALA 28 Ca 0.11 -0.40 -0.08 0.00 0.00 0.00 0.00 54.91 54.55 1l5i h ALA 28 Cb 0.42 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.11 1l5i h ALA 28 CO 0.01 0.58 -0.16 1.25 0.00 0.00 0.00 179.25 180.93 1l5i h LEU 29 N 0.20 0.51 -0.32 0.00 7.12 0.28 0.62 115.31 123.72 1l5i h LEU 29 Ca 0.02 -0.45 -0.10 0.00 0.13 0.00 0.00 57.88 57.48 1l5i h LEU 29 Cb 0.80 -0.14 -0.01 0.00 -0.53 0.00 0.00 40.66 40.78 1l5i h LEU 29 CO 0.06 0.85 -0.18 0.28 -0.13 0.00 0.00 178.44 179.32 1l5i h SER 30 N 0.17 0.71 -0.11 1.25 0.02 -0.25 0.61 113.55 115.94 1l5i h SER 30 Ca 0.04 -0.42 -0.02 0.00 -0.84 0.00 0.00 61.79 60.55 1l5i h SER 30 Cb 0.69 -0.20 -0.00 0.00 0.14 0.00 0.00 62.40 63.03 1l5i h SER 30 CO 0.04 0.98 -0.01 1.56 -1.14 0.00 0.00 176.83 178.26 1l5i h GLN 31 N 0.45 0.20 -0.26 3.45 4.20 -0.34 0.41 115.11 123.21 1l5i h GLN 31 Ca 0.07 -0.07 -0.03 0.00 0.06 0.00 0.00 58.65 58.68 1l5i h GLN 31 Cb 0.72 -0.02 -0.01 0.00 0.30 0.00 0.00 27.48 28.48 1l5i h GLN 31 CO 0.05 0.47 0.05 0.82 -0.67 0.00 0.00 178.83 179.54 1l5i h ILE 32 N -0.08 1.23 -0.44 2.54 1.08 0.26 0.39 117.51 122.49 1l5i h ILE 32 Ca 0.03 -0.77 -0.03 0.00 -0.39 0.00 0.00 64.86 63.70 1l5i h ILE 32 Cb 0.38 1.23 -0.02 0.00 -3.07 0.00 0.00 36.82 35.33 1l5i h ILE 32 CO 0.01 0.25 0.14 0.74 -0.69 0.00 0.00 178.15 178.59 1l5i h THR 33 N 0.25 1.18 -0.00 -0.27 2.02 0.28 0.10 112.91 116.47 1l5i h THR 33 Ca 0.08 -0.62 0.00 0.00 0.77 0.00 0.00 66.41 66.64 1l5i h THR 33 Cb 0.33 0.70 0.00 0.00 -1.74 0.00 0.00 68.15 67.44 1l5i h THR 33 CO 0.00 0.23 -0.17 0.59 0.37 0.00 0.00 175.52 176.54 1l5i n ASN 34 N -4.34 0.19 -4.65 4.18 3.02 0.14 -4.78 115.26 109.03 1l5i n ASN 34 Ca 0.03 0.19 -0.43 0.00 -0.03 0.00 0.00 54.58 54.34 1l5i n ASN 34 Cb 0.18 -0.22 -0.02 0.00 -0.61 0.00 0.00 39.78 39.10 1l5i n ASN 34 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1l5i s LEU 35 N -2.97 4.12 0.65 3.41 1.02 0.14 -5.00 118.68 120.04 1l5i s LEU 35 Ca 0.14 1.64 -0.11 0.00 0.02 0.00 0.00 54.13 55.82 1l5i s LEU 35 Cb 0.19 -3.54 -0.02 0.00 0.02 0.00 0.00 46.19 42.84 1l5i s LEU 35 CO 0.58 -0.86 1.05 0.00 0.02 0.00 0.00 176.35 177.14 1l5i s GLN 36 N 3.74 3.28 0.04 1.70 -2.07 -1.26 -4.96 119.66 120.13 1l5i s GLN 36 Ca 0.58 0.60 -0.10 0.00 -1.82 0.00 0.00 55.36 54.61 1l5i s GLN 36 Cb -0.22 -2.07 0.01 0.00 -1.09 0.00 0.00 33.01 29.64 1l5i s GLN 36 CO 0.18 -0.76 0.22 -0.08 -1.32 0.00 0.00 175.29 173.53 1l5i s THR 37 N -3.24 0.11 -1.36 3.63 -1.32 -1.26 -5.02 115.64 107.17 1l5i s THR 37 Ca 0.56 -0.87 0.23 0.00 -1.21 0.00 0.00 61.69 60.40 1l5i s THR 37 Cb -0.11 -0.95 0.36 0.00 -1.51 0.00 0.00 72.50 70.29 1l5i s THR 37 CO 0.53 -0.48 1.74 -0.81 -2.21 0.00 0.00 174.62 173.38 1l5i n PRO 38 N 0.60 0.27 0.00 7.08 -0.04 -1.26 -4.59 135.00 137.06 1l5i n PRO 38 Ca -0.18 0.08 0.00 0.00 -0.04 0.00 0.00 63.50 63.35 1l5i n PRO 38 Cb 0.59 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.55 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 -1.32 0.00 -3.64 0.52 5.66 -1.26 -5.11 114.28 109.13 1l5i n THR 39 Ca 0.10 0.00 -0.05 0.00 -3.05 0.00 0.00 64.05 61.05 1l5i n THR 39 Cb 0.19 0.00 -0.07 0.00 -1.55 0.00 0.00 70.33 68.91 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 0.13 -0.43 -0.31 1.09 3.04 -1.26 -4.98 114.94 112.21 1l5i s ASN 40 Ca 0.00 0.75 -0.25 0.00 0.04 0.00 0.00 52.86 53.40 1l5i s ASN 40 Cb 0.00 0.99 0.01 0.00 -1.54 0.00 0.00 41.25 40.71 1l5i s ASN 40 CO 0.00 -0.12 0.87 -0.54 -3.04 0.00 0.00 177.10 174.27 1l5i s LYS 41 N 0.82 3.97 -0.09 0.43 1.02 -1.26 -1.42 119.74 123.20 1l5i s LYS 41 Ca -0.03 0.70 -0.05 0.00 0.02 0.00 0.00 55.97 56.61 1l5i s LYS 41 Cb -0.04 -3.74 -0.02 0.00 -0.52 0.00 0.00 37.83 33.51 1l5i s LYS 41 CO -0.12 -0.76 -0.10 1.25 -0.92 0.00 0.00 175.35 174.71 1l5i h LEU 42 N 9.66 0.00 -8.40 3.17 5.85 -1.62 -3.47 115.31 120.50 1l5i h LEU 42 Ca -0.23 0.00 -0.19 0.00 0.84 0.00 0.00 57.88 58.29 1l5i h LEU 42 Cb 1.09 0.00 -0.15 0.00 0.37 0.00 0.00 40.66 41.97 1l5i h LEU 42 CO 0.93 0.48 -0.68 0.12 -0.34 0.00 0.00 178.44 178.94 1l5i s PHE 43 N -1.76 0.80 -0.03 1.25 5.36 -1.12 -1.85 117.98 120.64 1l5i s PHE 43 Ca -0.08 -1.00 0.01 0.00 -0.96 0.00 0.00 56.93 54.90 1l5i s PHE 43 Cb 0.01 -0.49 0.02 0.00 -0.34 0.00 0.00 43.02 42.22 1l5i s PHE 43 CO 0.12 -0.26 -0.03 0.42 -1.46 0.00 0.00 175.22 174.02 1l5i s ILE 44 N -3.75 0.35 -0.28 3.12 1.01 0.61 -2.15 121.20 120.11 1l5i s ILE 44 Ca 0.13 -0.05 0.02 0.00 0.00 0.00 0.00 60.65 60.74 1l5i s ILE 44 Cb 0.06 -0.38 0.08 0.00 0.01 0.00 0.00 42.46 42.23 1l5i s ILE 44 CO -0.05 0.16 -0.02 -0.75 0.00 0.00 0.00 174.94 174.28 1l5i s LYS 45 N 0.71 1.66 -0.26 2.79 2.47 0.20 -2.24 119.74 125.08 1l5i s LYS 45 Ca -0.08 -1.35 -0.04 0.00 -1.56 0.00 0.00 55.97 52.94 1l5i s LYS 45 Cb -0.11 -2.79 0.01 0.00 -1.46 0.00 0.00 37.83 33.48 1l5i s LYS 45 CO -0.01 -0.73 -0.01 0.42 0.16 0.00 0.00 175.35 175.18 1l5i s ILE 46 N 1.20 3.33 -0.01 5.43 1.01 -0.98 0.57 121.20 131.75 1l5i s ILE 46 Ca -0.00 -0.80 0.05 0.00 0.00 0.00 0.00 60.65 59.90 1l5i s ILE 46 Cb -0.19 -2.66 -0.01 0.00 0.01 0.00 0.00 42.46 39.61 1l5i s ILE 46 CO -0.08 0.21 -0.17 0.00 0.00 0.00 0.00 174.94 174.90 1l5i s ARG 48 N -0.40 3.65 -0.00 0.00 3.52 -1.26 -0.05 118.95 124.41 1l5i s ARG 48 Ca 0.06 0.07 0.03 0.00 -0.13 0.00 0.00 55.73 55.76 1l5i s ARG 48 Cb -0.06 -3.13 -0.01 0.00 -1.56 0.00 0.00 34.95 30.19 1l5i s ARG 48 CO -0.01 0.68 -0.09 -2.00 -0.81 0.00 0.00 175.30 173.08 1l5i s GLU 49 N -1.45 0.68 -0.04 5.12 2.12 0.02 -4.90 118.70 120.25 1l5i s GLU 49 Ca 0.24 -0.33 0.04 0.00 0.36 0.00 0.00 54.97 55.29 1l5i s GLU 49 Cb -0.14 -0.66 -0.00 0.00 0.26 0.00 0.00 34.13 33.59 1l5i s GLU 49 CO 0.13 0.18 -0.16 -0.51 -0.54 0.00 0.00 175.26 174.36 1l5i s LEU 50 N -0.27 1.91 0.25 2.70 2.01 -1.26 0.45 118.68 124.47 1l5i s LEU 50 Ca 0.03 -0.33 -0.02 0.00 0.01 0.00 0.00 54.13 53.82 1l5i s LEU 50 Cb -0.04 -0.92 -0.04 0.00 0.01 0.00 0.00 46.19 45.20 1l5i s LEU 50 CO -0.00 0.15 0.46 -1.00 1.01 0.00 0.00 176.35 176.96 1l5i s HIS 51 N 0.04 3.48 -1.34 0.29 3.76 -0.69 -4.96 115.29 115.87 1l5i s HIS 51 Ca -0.03 0.43 0.26 0.00 -0.15 0.00 0.00 55.06 55.57 1l5i s HIS 51 Cb -0.11 -1.93 1.26 0.00 1.11 0.00 0.00 32.58 32.90 1l5i s HIS 51 CO 0.02 0.28 1.86 -0.85 -0.85 0.00 0.00 174.74 175.20 1l5i n GLU 52 N -0.89 0.29 0.00 1.40 0.00 -1.26 -2.33 120.64 117.85 1l5i n GLU 52 Ca -0.04 0.05 0.14 0.00 0.00 0.00 0.00 57.16 57.31 1l5i n GLU 52 Cb 0.54 -1.50 0.67 0.00 0.00 0.00 0.00 31.44 31.15 1l5i n GLU 52 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.13 177.22 1l5i n ASN 53 N -1.33 0.50 0.00 -1.84 3.02 -1.26 -4.87 115.26 109.48 1l5i n ASN 53 Ca 0.11 -0.76 0.00 0.00 -0.03 0.00 0.00 54.58 53.90 1l5i n ASN 53 Cb 0.22 -0.06 0.00 0.00 -0.61 0.00 0.00 39.78 39.33 1l5i n ASN 53 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1l5i n GLY 54 N 1.21 0.75 3.61 7.41 0.00 -0.98 -5.04 105.19 112.15 1l5i n GLY 54 Ca 0.17 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.80 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 -0.47 4.02 0.48 1.61 -1.05 -1.25 -4.94 118.70 117.10 1l5i s GLU 55 Ca 0.00 -0.00 -0.20 0.00 -0.15 0.00 0.00 54.97 54.61 1l5i s GLU 55 Cb 0.00 -3.64 -0.09 0.00 -0.44 0.00 0.00 34.13 29.96 1l5i s GLU 55 CO 0.00 -0.24 1.04 -1.25 0.95 0.00 0.00 175.26 175.76 1l5i s PRO 56 N 1.95 3.82 0.03 -4.83 0.04 -1.26 -1.70 135.00 133.04 1l5i s PRO 56 Ca 0.14 1.36 -0.02 0.00 0.04 0.00 0.00 61.00 62.53 1l5i s PRO 56 Cb -0.16 -2.11 -0.02 0.00 0.04 0.00 0.00 34.50 32.26 1l5i s PRO 56 CO 0.10 -0.42 0.01 -1.58 0.04 0.00 0.00 177.00 175.15 1l5i s HIS 57 N -1.97 0.27 -0.02 0.56 2.46 0.17 -0.32 115.29 116.44 1l5i s HIS 57 Ca 0.67 -0.58 0.02 0.00 0.47 0.00 0.00 55.06 55.64 1l5i s HIS 57 Cb -0.16 -0.20 0.00 0.00 -0.13 0.00 0.00 32.58 32.08 1l5i s HIS 57 CO 0.20 -0.27 -0.08 -1.17 -2.47 0.00 0.00 174.74 170.95 1l5i s LEU 58 N -1.83 1.83 -0.01 8.88 1.98 -1.01 -0.80 118.68 127.72 1l5i s LEU 58 Ca -0.10 -0.16 0.07 0.00 -2.89 0.00 0.00 54.13 51.05 1l5i s LEU 58 Cb -0.05 -0.48 -0.02 0.00 0.66 0.00 0.00 46.19 46.29 1l5i s LEU 58 CO -0.03 0.07 -0.21 -1.00 -1.89 0.00 0.00 176.35 173.28 1l5i s HIS 59 N 0.11 2.47 -0.04 5.38 3.76 0.93 -2.27 115.29 125.64 1l5i s HIS 59 Ca -0.01 -0.32 -0.02 0.00 -0.15 0.00 0.00 55.06 54.55 1l5i s HIS 59 Cb -0.07 -1.52 0.02 0.00 1.11 0.00 0.00 32.58 32.12 1l5i s HIS 59 CO 0.00 0.09 0.08 0.42 -0.85 0.00 0.00 174.74 174.48 1l5i s ILE 60 N -0.72 -0.03 -0.17 0.60 1.01 -0.96 -1.05 121.20 119.88 1l5i s ILE 60 Ca 0.11 0.11 -0.04 0.00 0.00 0.00 0.00 60.65 60.83 1l5i s ILE 60 Cb -0.10 -0.14 0.06 0.00 0.01 0.00 0.00 42.46 42.29 1l5i s ILE 60 CO 0.01 0.04 0.07 -0.22 0.00 0.00 0.00 174.94 174.84 1l5i s LEU 61 N 0.61 0.57 0.15 2.97 1.98 0.19 -1.46 118.68 123.70 1l5i s LEU 61 Ca -0.05 -0.65 0.09 0.00 -2.89 0.00 0.00 54.13 50.63 1l5i s LEU 61 Cb -0.07 -0.34 -0.04 0.00 0.66 0.00 0.00 46.19 46.40 1l5i s LEU 61 CO -0.02 -0.33 -0.16 -0.63 -1.89 0.00 0.00 176.35 173.31 1l5i s ILE 62 N 2.06 2.90 -0.12 6.68 1.09 -0.67 0.59 121.20 133.73 1l5i s ILE 62 Ca 0.01 -1.64 -0.02 0.00 -1.10 0.00 0.00 60.65 57.90 1l5i s ILE 62 Cb -0.16 -2.38 0.04 0.00 -1.06 0.00 0.00 42.46 38.90 1l5i s ILE 62 CO -0.09 -0.01 0.03 0.00 -0.10 0.00 0.00 174.94 174.77 1l5i s GLN 63 N -2.48 0.52 0.32 2.79 1.03 -0.91 -0.90 119.66 120.03 1l5i s GLN 63 Ca 0.21 -0.08 -0.05 0.00 0.04 0.00 0.00 55.36 55.48 1l5i s GLN 63 Cb -0.09 -1.44 -0.05 0.00 0.03 0.00 0.00 33.01 31.45 1l5i s GLN 63 CO 0.12 -0.46 0.60 -0.06 -2.54 0.00 0.00 175.29 172.94 1l5i s PHE 64 N 1.96 3.48 0.38 9.60 0.40 0.95 -1.58 117.98 133.18 1l5i s PHE 64 Ca 0.03 0.68 0.07 0.00 -0.60 0.00 0.00 56.93 57.10 1l5i s PHE 64 Cb -0.14 -2.14 0.75 0.00 0.51 0.00 0.00 43.02 42.00 1l5i s PHE 64 CO -0.06 0.10 1.96 1.49 0.70 0.00 0.00 175.22 179.41 1l5i h GLU 65 N 1.45 0.47 -6.02 0.44 4.22 -1.54 -3.44 114.58 110.16 1l5i h GLU 65 Ca -0.48 -0.07 -0.54 0.00 0.08 0.00 0.00 59.36 58.35 1l5i h GLU 65 Cb 1.19 -0.09 -0.17 0.00 0.50 0.00 0.00 28.75 30.19 1l5i h GLU 65 CO 0.65 0.43 -0.78 0.20 -2.18 0.00 0.00 179.01 177.33 1l5i s GLY 66 N -3.82 1.49 -0.19 1.92 0.00 -1.26 -5.04 107.32 100.41 1l5i s GLY 66 Ca -0.07 -1.57 -0.29 0.00 0.00 0.00 0.00 44.72 42.79 1l5i s GLY 66 CO 0.74 -1.62 2.19 0.28 0.00 0.00 0.00 173.10 174.69 1l5i n LYS 67 N 0.13 2.03 -3.30 2.90 4.76 -1.26 -4.65 118.16 118.77 1l5i n LYS 67 Ca -0.12 0.59 -0.38 0.00 -2.87 0.00 0.00 58.31 55.53 1l5i n LYS 67 Cb 0.58 -3.16 -0.06 0.00 -1.84 0.00 0.00 35.03 30.55 1l5i n LYS 67 CO 0.00 0.00 0.00 -0.47 -1.37 0.00 0.00 177.40 175.56 1l5i s TYR 68 N 7.73 3.80 -0.33 2.13 5.04 0.38 -4.78 117.35 131.33 1l5i s TYR 68 Ca 1.00 1.24 -0.14 0.00 -2.44 0.00 0.00 57.07 56.73 1l5i s TYR 68 Cb -0.38 -2.47 -0.02 0.00 0.35 0.00 0.00 41.96 39.44 1l5i s TYR 68 CO 0.37 0.59 0.29 1.21 -1.34 0.00 0.00 175.55 176.67 1l5i s ASN 69 N -1.12 6.11 -0.79 4.32 3.04 -1.26 -2.26 114.94 122.98 1l5i s ASN 69 Ca 0.29 -0.26 0.03 0.00 0.04 0.00 0.00 52.86 52.95 1l5i s ASN 69 Cb -0.19 -2.16 0.27 0.00 -1.54 0.00 0.00 41.25 37.63 1l5i s ASN 69 CO 0.18 -0.25 1.00 0.00 -3.04 0.00 0.00 177.10 175.00 1l5i n THR 71 N 1.00 1.74 -3.66 0.00 5.66 -1.26 -2.92 114.28 114.83 1l5i n THR 71 Ca 0.29 -0.87 -0.07 0.00 -3.05 0.00 0.00 64.05 60.35 1l5i n THR 71 Cb 0.38 -0.44 -0.08 0.00 -1.55 0.00 0.00 70.33 68.64 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 -0.42 -0.50 -0.24 1.09 2.47 -1.26 -4.71 114.94 111.36 1l5i s ASN 72 Ca 0.32 1.15 -0.02 0.00 0.42 0.00 0.00 52.86 54.72 1l5i s ASN 72 Cb 0.25 1.59 0.06 0.00 -1.45 0.00 0.00 41.25 41.70 1l5i s ASN 72 CO 0.09 -0.23 2.45 0.00 -3.72 0.00 0.00 177.10 175.69 1l5i n GLN 73 N 5.37 1.83 -0.00 0.43 6.02 -1.26 -3.57 117.38 126.21 1l5i n GLN 73 Ca -0.10 -1.38 0.01 0.00 -0.01 0.00 0.00 57.00 55.52 1l5i n GLN 73 Cb 0.49 -1.69 -0.01 0.00 1.02 0.00 0.00 30.24 30.05 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 1.03 2.17 0.08 -1.09 1.74 -1.26 -4.49 116.66 114.84 1l5i n ARG 74 Ca 0.31 -0.01 -0.22 0.00 -0.77 0.00 0.00 57.85 57.16 1l5i n ARG 74 Cb 0.61 -0.89 -0.13 0.00 -1.02 0.00 0.00 32.46 31.04 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 1.00 -0.29 -1.55 3.57 -2.01 -3.16 116.94 114.50 1l5i h PHE 75 Ca 0.00 -0.61 0.00 0.00 3.53 0.00 0.00 57.97 60.89 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 1.45 0.00 1.19 -2.23 0.00 0.00 178.31 178.72 1l5i n PHE 76 N -3.83 0.51 -2.08 0.41 3.72 -1.26 -4.84 117.46 110.09 1l5i n PHE 76 Ca -0.13 -0.23 -0.41 0.00 -0.05 0.00 0.00 57.45 56.63 1l5i n PHE 76 Cb 0.95 -0.06 -0.03 0.00 -0.94 0.00 0.00 39.48 39.40 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 5.76 -0.14 4.37 1.11 -1.20 -4.44 116.67 121.30 1l5i s ASP 77 Ca 0.21 0.88 -0.06 0.00 0.18 0.00 0.00 52.55 53.75 1l5i s ASP 77 Cb 0.12 -2.53 -0.04 0.00 1.07 0.00 0.00 42.92 41.54 1l5i s ASP 77 CO 0.12 -1.89 0.09 -0.76 1.18 0.00 0.00 175.17 173.91 1l5i s LEU 78 N 7.35 4.05 0.29 1.23 1.02 -0.89 -4.96 118.68 126.78 1l5i s LEU 78 Ca 0.72 0.27 0.08 0.00 0.02 0.00 0.00 54.13 55.23 1l5i s LEU 78 Cb -0.17 -1.99 -0.06 0.00 0.02 0.00 0.00 46.19 43.99 1l5i s LEU 78 CO 0.29 0.32 -0.10 0.68 0.02 0.00 0.00 176.35 177.56 1l5i s VAL 79 N -0.49 1.91 -0.28 -1.59 -7.23 -1.26 0.36 120.40 111.82 1l5i s VAL 79 Ca 0.11 -2.19 -0.24 0.00 -1.81 0.00 0.00 61.98 57.85 1l5i s VAL 79 Cb -0.12 -2.43 -0.00 0.00 0.56 0.00 0.00 36.38 34.39 1l5i s VAL 79 CO 0.02 -0.32 0.80 -0.55 -0.31 0.00 0.00 175.10 174.74 1l5i s SER 80 N -3.48 6.73 0.00 4.85 0.15 0.16 -4.90 113.70 117.20 1l5i s SER 80 Ca 0.29 0.81 0.23 0.00 0.70 0.00 0.00 55.95 57.99 1l5i s SER 80 Cb 0.02 -2.42 1.25 0.00 -1.71 0.00 0.00 66.02 63.16 1l5i s SER 80 CO 0.13 -0.57 1.76 -0.81 1.20 0.00 0.00 173.24 174.94 1l5i n PRO 81 N 6.13 0.48 -0.01 5.44 -0.04 -1.26 -2.56 135.00 143.18 1l5i n PRO 81 Ca 0.04 0.05 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 -1.18 0.03 -4.24 0.52 -2.24 -1.26 -5.01 114.28 100.90 1l5i n THR 82 Ca 0.13 -0.18 -0.17 0.00 -2.27 0.00 0.00 64.05 61.57 1l5i n THR 82 Cb 0.14 0.25 -0.13 0.00 -2.10 0.00 0.00 70.33 68.50 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 -2.49 0.67 -0.89 -0.78 6.06 -1.06 -5.03 118.95 115.43 1l5i s ARG 83 Ca -0.03 -0.55 -0.07 0.00 -2.50 0.00 0.00 55.73 52.58 1l5i s ARG 83 Cb 0.05 -0.61 -0.12 0.00 0.06 0.00 0.00 34.95 34.32 1l5i s ARG 83 CO 0.31 0.15 2.77 0.43 -2.50 0.00 0.00 175.30 176.46 1l5i n SER 84 N 2.20 6.24 -4.08 -2.12 7.64 -1.26 -3.82 113.62 118.42 1l5i n SER 84 Ca -0.17 -2.41 -0.23 0.00 1.01 0.00 0.00 58.87 57.06 1l5i n SER 84 Cb 0.56 -1.30 -0.16 0.00 -1.01 0.00 0.00 64.21 62.30 1l5i n SER 84 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1l5i s ALA 85 N 2.23 1.21 0.04 -0.43 0.00 -1.26 -5.04 121.76 118.51 1l5i s ALA 85 Ca 0.57 -0.53 0.03 0.00 0.00 0.00 0.00 51.96 52.03 1l5i s ALA 85 Cb 0.19 -0.40 -0.04 0.00 0.00 0.00 0.00 23.12 22.87 1l5i s ALA 85 CO -0.03 0.22 -0.01 -1.01 0.00 0.00 0.00 175.76 174.93 1l5i s HIS 86 N 0.06 3.01 -0.05 0.00 3.76 -1.26 -0.67 115.29 120.14 1l5i s HIS 86 Ca -0.02 0.02 0.04 0.00 -0.15 0.00 0.00 55.06 54.94 1l5i s HIS 86 Cb -0.10 -1.60 0.00 0.00 1.11 0.00 0.00 32.58 32.00 1l5i s HIS 86 CO 0.01 0.46 -0.16 -0.06 -0.85 0.00 0.00 174.74 174.14 1l5i s PHE 87 N -1.18 1.69 -0.42 1.40 0.08 0.16 -4.98 117.98 114.74 1l5i s PHE 87 Ca 0.22 -0.53 -0.05 0.00 0.12 0.00 0.00 56.93 56.69 1l5i s PHE 87 Cb -0.12 -1.16 0.10 0.00 -0.57 0.00 0.00 43.02 41.28 1l5i s PHE 87 CO 0.14 -0.20 0.23 -1.58 -0.10 0.00 0.00 175.22 173.70 1l5i s HIS 88 N 0.19 3.50 0.70 0.36 5.65 -1.26 -2.09 115.29 122.34 1l5i s HIS 88 Ca -0.07 -2.14 -0.11 0.00 0.25 0.00 0.00 55.06 52.99 1l5i s HIS 88 Cb -0.13 -3.19 0.01 0.00 -1.18 0.00 0.00 32.58 28.10 1l5i s HIS 88 CO 0.03 -0.95 1.06 -1.25 -0.65 0.00 0.00 174.74 172.98 1l5i s PRO 89 N 1.24 2.88 -0.20 2.88 0.04 -1.26 -4.91 135.00 135.67 1l5i s PRO 89 Ca 0.06 0.94 -0.22 0.00 0.04 0.00 0.00 61.00 61.82 1l5i s PRO 89 Cb -0.23 -1.98 -0.02 0.00 0.04 0.00 0.00 34.50 32.30 1l5i s PRO 89 CO -0.02 -1.13 0.71 1.21 0.04 0.00 0.00 177.00 177.80 1l5i s ASN 90 N -3.80 6.77 -0.10 6.66 3.84 -0.55 -4.81 114.94 122.95 1l5i s ASN 90 Ca 0.58 0.94 -0.22 0.00 0.21 0.00 0.00 52.86 54.37 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 -0.34 0.67 -0.63 -2.79 0.00 0.00 177.10 174.56 1l5i s ILE 91 N 2.12 5.05 -0.03 -5.21 1.01 -1.26 -2.36 121.20 120.51 1l5i s ILE 91 Ca 0.32 1.36 0.01 0.00 0.00 0.00 0.00 60.65 62.34 1l5i s ILE 91 Cb -0.16 -4.01 0.02 0.00 0.01 0.00 0.00 42.46 38.32 1l5i s ILE 91 CO 0.10 0.22 -0.04 -1.10 0.00 0.00 0.00 174.94 174.12 1l5i s GLN 92 N 1.07 0.60 -0.36 2.79 -0.21 -0.71 -4.98 119.66 117.86 1l5i s GLN 92 Ca 0.35 -0.10 -0.17 0.00 0.02 0.00 0.00 55.36 55.46 1l5i s GLN 92 Cb -0.17 -0.64 -0.00 0.00 1.00 0.00 0.00 33.01 33.20 1l5i s GLN 92 CO 0.15 -0.03 0.47 0.20 -2.12 0.00 0.00 175.29 173.97 1l5i s GLY 93 N 0.61 1.85 -0.38 3.09 0.00 -1.26 -0.60 107.32 110.62 1l5i s GLY 93 Ca -0.07 -1.14 -0.24 0.00 0.00 0.00 0.00 44.72 43.26 1l5i s GLY 93 CO -0.00 1.20 0.84 0.00 0.00 0.00 0.00 173.10 175.13 1l5i s ALA 94 N 2.28 3.39 0.38 3.20 0.00 -0.75 -5.01 121.76 125.26 1l5i s ALA 94 Ca 0.16 -0.64 0.00 0.00 0.00 0.00 0.00 51.96 51.49 1l5i s ALA 94 Cb -0.16 -3.45 0.00 0.00 0.00 0.00 0.00 23.12 19.51 1l5i s ALA 94 CO 0.13 -1.61 0.00 1.17 0.00 0.00 0.00 175.76 175.45 1l5i n LYS 95 N 6.62 2.71 -3.35 0.00 3.00 -1.26 -4.08 118.16 121.80 1l5i n LYS 95 Ca 0.04 0.00 -0.37 0.00 -0.00 0.00 0.00 58.31 57.99 1l5i n LYS 95 Cb 0.48 0.00 -0.06 0.00 0.00 0.00 0.00 35.03 35.45 1l5i n LYS 95 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.40 176.28 1l5i s SER 96 N -1.91 6.89 0.00 3.14 0.01 -1.26 -4.84 113.70 115.74 1l5i s SER 96 Ca 0.00 1.12 0.00 0.00 1.31 0.00 0.00 55.95 58.38 1l5i s SER 96 Cb 0.00 -2.30 0.00 0.00 0.21 0.00 0.00 66.02 63.93 1l5i s SER 96 CO 0.00 0.19 0.00 -1.54 0.41 0.00 0.00 173.24 172.30 1l5i n SER 97 N 1.22 0.00 -0.01 2.44 3.41 -1.26 -4.98 113.62 114.44 1l5i n SER 97 Ca -0.08 0.00 0.15 0.00 -0.26 0.00 0.00 58.87 58.68 1l5i n SER 97 Cb 0.52 0.00 0.70 0.00 -0.26 0.00 0.00 64.21 65.17 1l5i n SER 97 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1l5i n SER 98 N 0.00 0.03 -0.15 4.04 7.64 -1.26 -3.67 113.62 120.25 1l5i n SER 98 Ca 0.00 0.03 0.28 0.00 1.01 0.00 0.00 58.87 60.19 1l5i n SER 98 Cb 0.00 -0.33 0.59 0.00 -1.01 0.00 0.00 64.21 63.46 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 -0.26 6.43 1.82 -1.99 1.75 116.42 124.19 1l5i h ASP 99 Ca 0.00 0.00 -0.06 0.00 -0.39 0.00 0.00 57.03 56.58 1l5i h ASP 99 Cb 0.36 0.00 -0.01 0.00 0.68 0.00 0.00 39.33 40.36 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 1.29 -0.40 2.25 -1.51 -1.99 -0.09 116.25 115.80 1l5i h VAL 100 Ca 0.43 -1.11 -0.03 0.00 -1.23 0.00 0.00 66.70 64.76 1l5i h VAL 100 Cb 2.33 1.46 -0.02 0.00 -2.13 0.00 0.00 31.29 32.94 1l5i h VAL 100 CO -0.00 0.35 0.12 0.50 -1.23 0.00 0.00 177.57 177.30 1l5i h LYS 101 N 0.27 0.63 -0.26 5.19 1.63 0.23 0.36 116.57 124.62 1l5i h LYS 101 Ca 0.07 -0.14 0.03 0.00 -0.85 0.00 0.00 60.65 59.75 1l5i h LYS 101 Cb 0.56 -0.09 -0.03 0.00 -0.60 0.00 0.00 32.23 32.07 1l5i h LYS 101 CO 0.03 0.63 0.09 0.77 -3.45 0.00 0.00 179.45 177.52 1l5i h SER 102 N 0.50 0.11 -0.11 4.20 0.02 -1.18 0.87 113.55 117.96 1l5i h SER 102 Ca 0.13 0.02 -0.09 0.00 -0.84 0.00 0.00 61.79 61.01 1l5i h SER 102 Cb 0.27 0.01 -0.01 0.00 0.14 0.00 0.00 62.40 62.81 1l5i h SER 102 CO -0.00 0.10 -0.21 0.22 -1.14 0.00 0.00 176.83 175.79 1l5i h TYR 103 N 0.21 0.59 -0.35 3.45 3.20 -0.79 -2.37 116.97 120.91 1l5i h TYR 103 Ca 0.11 -0.12 -0.06 0.00 3.14 0.00 0.00 58.73 61.81 1l5i h TYR 103 Cb 0.07 -0.15 -0.02 0.00 1.54 0.00 0.00 36.73 38.18 1l5i h TYR 103 CO -0.12 0.71 -0.04 0.82 -1.64 0.00 0.00 178.16 177.89 1l5i h ILE 104 N 0.47 1.21 -0.18 1.81 2.04 0.47 -1.84 117.51 121.49 1l5i h ILE 104 Ca 0.07 -0.88 -0.11 0.00 1.00 0.00 0.00 64.86 64.94 1l5i h ILE 104 Cb 0.63 0.99 -0.01 0.00 -0.74 0.00 0.00 36.82 37.69 1l5i h ILE 104 CO 0.04 0.30 -0.37 -0.78 0.00 0.00 0.00 178.15 177.34 1l5i h ASP 105 N 0.53 0.40 -0.34 1.72 1.82 -0.37 -3.34 116.42 116.84 1l5i h ASP 105 Ca 0.11 -0.16 -0.60 0.00 -0.39 0.00 0.00 57.03 55.99 1l5i h ASP 105 Cb 0.39 -0.11 -0.03 0.00 0.68 0.00 0.00 39.33 40.27 1l5i h ASP 105 CO 0.02 0.74 2.18 0.29 -1.61 0.00 0.00 179.24 180.86 1l5i n LYS 106 N -4.05 2.29 -2.10 0.28 5.02 -0.69 -4.92 118.16 113.99 1l5i n LYS 106 Ca -0.01 -2.55 -0.28 0.00 -2.02 0.00 0.00 58.31 53.44 1l5i n LYS 106 Cb 0.47 -3.36 0.17 0.00 -0.02 0.00 0.00 35.03 32.30 1l5i n LYS 106 CO 0.00 0.00 0.00 0.16 -0.52 0.00 0.00 177.40 177.04 1l5i s ASP 107 N 4.73 3.38 0.00 4.39 -4.77 -1.26 -4.97 116.67 118.17 1l5i s ASP 107 Ca 0.57 0.09 0.00 0.00 -3.30 0.00 0.00 52.55 49.90 1l5i s ASP 107 Cb 0.08 -0.19 0.00 0.00 -1.09 0.00 0.00 42.92 41.71 1l5i s ASP 107 CO 0.06 -2.54 0.00 0.61 0.70 0.00 0.00 175.17 174.00 1l5i n GLY 108 N -3.55 1.25 2.84 2.12 0.00 -1.26 -4.95 105.19 101.64 1l5i n GLY 108 Ca 0.15 0.14 -0.21 0.00 0.00 0.00 0.00 46.02 46.11 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 -5.83 -4.50 1.61 9.92 -1.26 -4.85 116.55 111.64 1l5i n ASP 109 Ca 0.00 -0.23 -0.24 0.00 -0.53 0.00 0.00 54.79 53.79 1l5i n ASP 109 Cb 0.00 -4.68 -0.10 0.00 -0.64 0.00 0.00 41.12 35.69 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 -3.11 2.07 -0.00 2.53 -7.23 -1.26 -4.35 120.40 109.04 1l5i s VAL 110 Ca 0.24 -2.19 0.00 0.00 -1.81 0.00 0.00 61.98 58.21 1l5i s VAL 110 Cb -0.10 -2.56 -0.04 0.00 0.56 0.00 0.00 36.38 34.24 1l5i s VAL 110 CO 0.29 -0.25 0.07 -0.22 -0.31 0.00 0.00 175.10 174.68 1l5i s LEU 111 N -3.55 3.84 -0.10 1.32 0.20 0.97 -5.01 118.68 116.35 1l5i s LEU 111 Ca 0.31 0.12 0.00 0.00 0.69 0.00 0.00 54.13 55.25 1l5i s LEU 111 Cb 0.02 -2.25 0.02 0.00 -0.43 0.00 0.00 46.19 43.56 1l5i s LEU 111 CO 0.15 0.27 -0.08 -1.61 -0.29 0.00 0.00 176.35 174.79 1l5i s GLU 112 N -1.74 1.46 0.08 1.98 2.02 -1.26 -2.31 118.70 118.93 1l5i s GLU 112 Ca 0.23 -0.25 0.05 0.00 0.02 0.00 0.00 54.97 55.02 1l5i s GLU 112 Cb -0.12 -1.47 -0.03 0.00 0.10 0.00 0.00 34.13 32.61 1l5i s GLU 112 CO 0.14 -0.21 -0.14 -0.46 0.02 0.00 0.00 175.26 174.61 1l5i s TRP 113 N 1.49 1.25 0.17 1.61 -0.00 -0.95 -5.02 118.94 117.49 1l5i s TRP 113 Ca 0.01 -0.48 0.00 0.00 -0.00 0.00 0.00 56.10 55.62 1l5i s TRP 113 Cb -0.13 -0.69 0.00 0.00 -0.00 0.00 0.00 33.47 32.64 1l5i s TRP 113 CO -0.05 0.07 0.00 0.41 -0.00 0.00 0.00 176.95 177.38 1l5i n GLY 114 N 1.14 -1.88 3.03 5.86 0.00 -1.26 -0.28 105.19 111.80 1l5i n GLY 114 Ca -0.20 -1.26 -0.31 0.00 0.00 0.00 0.00 46.02 44.25 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 -1.41 1.75 0.40 2.61 2.01 -0.77 -4.72 115.64 115.50 1l5i s THR 115 Ca 0.00 -0.94 -0.23 0.00 0.31 0.00 0.00 61.69 60.83 1l5i s THR 115 Cb 0.00 -1.72 -0.10 0.00 0.01 0.00 0.00 72.50 70.68 1l5i s THR 115 CO 0.00 0.31 0.96 0.12 -0.69 0.00 0.00 174.62 175.31 1l5i s PHE 116 N 1.38 3.41 -0.07 4.92 2.19 -1.26 -4.15 117.98 124.39 1l5i s PHE 116 Ca 0.01 1.66 -0.06 0.00 0.33 0.00 0.00 56.93 58.87 1l5i s PHE 116 Cb -0.15 -2.89 0.02 0.00 -1.31 0.00 0.00 43.02 38.69 1l5i s PHE 116 CO -0.10 -0.06 0.18 1.14 1.83 0.00 0.00 175.22 178.21 1l5i s GLN 117 N -2.81 0.21 0.07 10.12 -2.07 -1.26 -5.05 119.66 118.86 1l5i s GLN 117 Ca 0.58 0.27 -0.26 0.00 -1.82 0.00 0.00 55.36 54.13 1l5i s GLN 117 Cb -0.13 0.08 -0.06 0.00 -1.09 0.00 0.00 33.01 31.82 1l5i s GLN 117 CO 0.17 -0.04 0.82 0.42 -1.32 0.00 0.00 175.29 175.34 1l5i s ILE 118 N 0.20 4.66 -0.15 3.63 -1.09 -1.26 -4.98 121.20 122.22 1l5i s ILE 118 Ca -0.01 1.75 -0.16 0.00 -2.23 0.00 0.00 60.65 60.00 1l5i s ILE 118 Cb -0.02 -4.17 -0.13 0.00 -1.58 0.00 0.00 42.46 36.56 1l5i s ILE 118 CO -0.00 0.36 0.24 -0.78 -1.23 0.00 0.00 174.94 173.53 1l5i h ASP 119 N 5.61 0.00 -0.81 3.58 1.82 -2.00 -3.50 116.42 121.11 1l5i h ASP 119 Ca -0.44 -0.42 0.06 0.00 -0.39 0.00 0.00 57.03 55.84 1l5i h ASP 119 Cb 1.21 0.00 -0.02 0.00 0.68 0.00 0.00 39.33 41.20 1l5i h ASP 119 CO 0.71 0.95 -0.08 0.61 -1.61 0.00 0.00 179.24 179.82 1l5i n GLY 120 N 1.61 -0.57 0.21 -0.78 0.00 -1.26 -5.27 105.19 99.13 1l5i n GLY 120 Ca -0.13 -0.48 0.15 0.00 0.00 0.00 0.00 46.02 45.57 1l5i n GLY 120 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36