#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1l9b n GLU 2 N 0.00 -1.44 0.00 -1.09 1.02 -1.26 -4.77 120.64 113.10 1l9b n GLU 2 Ca 0.00 1.22 0.00 0.00 -0.02 0.00 0.00 57.16 58.36 1l9b n GLU 2 Cb 0.00 -5.60 0.00 0.00 -0.02 0.00 0.00 31.44 25.82 1l9b n GLU 2 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1l9b n GLY 3 N -0.44 3.14 3.10 0.62 0.00 -1.26 -4.81 105.19 105.54 1l9b n GLY 3 Ca -0.21 -0.04 -0.33 0.00 0.00 0.00 0.00 46.02 45.45 1l9b n GLY 3 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1l9b s ASP 4 N 0.00 4.34 0.19 1.61 -1.08 -1.26 -4.94 116.67 115.53 1l9b s ASP 4 Ca 0.00 -1.25 -0.12 0.00 -0.52 0.00 0.00 52.55 50.66 1l9b s ASP 4 Cb 0.00 -1.57 0.18 0.00 -1.46 0.00 0.00 42.92 40.07 1l9b s ASP 4 CO 0.00 -0.17 1.78 1.55 0.52 0.00 0.00 175.17 178.85 1l9b h PRO 5 N 7.84 0.49 -0.30 4.34 0.13 -1.80 0.12 132.00 142.83 1l9b h PRO 5 Ca -0.24 -0.03 -0.07 0.00 -0.87 0.00 0.00 66.00 64.80 1l9b h PRO 5 Cb 1.06 -0.11 -0.02 0.00 0.13 0.00 0.00 31.00 32.06 1l9b h PRO 5 CO 0.50 0.32 -0.09 0.93 -0.23 0.00 0.00 178.00 179.43 1l9b h GLU 6 N 0.50 0.49 0.00 0.86 3.07 -1.94 0.94 114.58 118.51 1l9b h GLU 6 Ca 0.25 -0.13 -0.14 0.00 -0.50 0.00 0.00 59.36 58.84 1l9b h GLU 6 Cb 0.19 -0.06 -0.02 0.00 -0.84 0.00 0.00 28.75 28.02 1l9b h GLU 6 CO -0.19 0.59 -0.66 0.00 -1.40 0.00 0.00 179.01 177.35 1l9b h ALA 7 N 1.44 0.58 -0.15 3.43 0.00 -1.83 -3.16 119.26 119.58 1l9b h ALA 7 Ca 0.09 -0.60 -0.15 0.00 0.00 0.00 0.00 54.91 54.24 1l9b h ALA 7 Cb 0.45 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 1l9b h ALA 7 CO 0.02 0.83 -0.56 0.78 0.00 0.00 0.00 179.25 180.32 1l9b h GLY 8 N 3.26 0.49 1.23 0.00 0.00 0.15 -1.81 103.07 106.40 1l9b h GLY 8 Ca -0.01 -0.57 -0.07 0.00 0.00 0.00 0.00 47.33 46.68 1l9b h GLY 8 CO 0.09 0.51 0.08 0.00 0.00 0.00 0.00 176.54 177.22 1l9b h ALA 9 N 1.06 1.05 -0.16 3.60 0.00 -0.82 -0.70 119.26 123.29 1l9b h ALA 9 Ca 0.00 -0.25 -0.15 0.00 0.00 0.00 0.00 54.91 54.51 1l9b h ALA 9 Cb 1.08 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.65 1l9b h ALA 9 CO 0.10 0.61 -0.47 -0.22 0.00 0.00 0.00 179.25 179.26 1l9b h LYS 10 N 0.89 0.60 0.00 0.00 3.64 -1.50 -3.10 116.57 117.10 1l9b h LYS 10 Ca 0.18 -0.44 -0.04 0.00 -1.27 0.00 0.00 60.65 59.08 1l9b h LYS 10 Cb 0.41 0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 32.29 1l9b h LYS 10 CO 0.01 1.06 -0.19 0.00 -2.27 0.00 0.00 179.45 178.05 1l9b h ALA 11 N 0.55 1.55 0.00 5.00 0.00 -1.17 -2.33 119.26 122.87 1l9b h ALA 11 Ca -0.01 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.72 1l9b h ALA 11 Cb 1.09 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.85 1l9b h ALA 11 CO 0.10 0.24 0.00 0.34 0.00 0.00 0.00 179.25 179.93 1l9b n PHE 12 N -4.13 0.83 -0.33 0.00 7.35 -0.28 -3.20 117.46 117.70 1l9b n PHE 12 Ca -0.02 0.34 0.00 0.00 -0.76 0.00 0.00 57.45 57.01 1l9b n PHE 12 Cb 0.27 -1.05 0.14 0.00 0.35 0.00 0.00 39.48 39.18 1l9b n PHE 12 CO 0.00 0.00 0.00 -0.91 -0.76 0.00 0.00 176.76 175.09 1l9b h ASN 13 N 0.00 0.95 0.37 -2.13 4.21 -1.49 -1.00 115.58 116.50 1l9b h ASN 13 Ca 0.00 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.51 1l9b h ASN 13 Cb 0.30 -0.20 0.00 0.00 -1.12 0.00 0.00 38.32 37.30 1l9b h ASN 13 CO 0.00 0.63 0.00 0.06 -1.29 0.00 0.00 177.43 176.83 1l9b h GLN 14 N 1.10 0.00 0.00 0.81 3.07 -1.77 -1.49 115.11 116.83 1l9b h GLN 14 Ca 0.38 0.00 0.00 0.00 0.09 0.00 0.00 58.65 59.12 1l9b h GLN 14 Cb 0.09 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.65 1l9b h GLN 14 CO -0.15 0.00 -0.46 0.00 0.09 0.00 0.00 178.83 178.31 1l9b n GLN 16 N -2.67 0.37 0.06 0.00 6.02 -0.56 -0.55 117.38 120.04 1l9b n GLN 16 Ca 0.03 0.07 0.13 0.00 -0.01 0.00 0.00 57.00 57.22 1l9b n GLN 16 Cb 0.51 -1.50 0.49 0.00 1.02 0.00 0.00 30.24 30.76 1l9b n GLN 16 CO 0.00 0.00 0.00 2.41 -1.01 0.00 0.00 177.06 178.46 1l9b n THR 17 N -1.16 0.43 0.00 5.09 -1.04 -1.25 -4.27 114.28 112.08 1l9b n THR 17 Ca 0.10 -0.07 0.00 0.00 -2.04 0.00 0.00 64.05 62.04 1l9b n THR 17 Cb 0.10 -0.65 0.00 0.00 -1.82 0.00 0.00 70.33 67.95 1l9b n THR 17 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1l9b s HIS 19 N -1.25 2.93 0.15 0.00 3.76 0.29 -0.62 115.29 120.55 1l9b s HIS 19 Ca 0.00 -0.28 -0.04 0.00 -0.15 0.00 0.00 55.06 54.59 1l9b s HIS 19 Cb 0.00 -1.78 -0.03 0.00 1.11 0.00 0.00 32.58 31.88 1l9b s HIS 19 CO 0.00 0.20 0.16 0.54 -0.85 0.00 0.00 174.74 174.79 1l9b s VAL 20 N -2.28 0.08 -0.30 -0.90 0.11 -1.26 -4.23 120.40 111.61 1l9b s VAL 20 Ca 0.40 -1.71 -0.01 0.00 -2.93 0.00 0.00 61.98 57.73 1l9b s VAL 20 Cb -0.06 -2.01 0.10 0.00 -1.53 0.00 0.00 36.38 32.88 1l9b s VAL 20 CO 0.27 -0.36 0.09 -0.63 -3.33 0.00 0.00 175.10 171.14 1l9b s ILE 21 N -4.03 0.83 -0.16 7.04 1.01 0.39 -1.36 121.20 124.93 1l9b s ILE 21 Ca 0.23 -1.32 0.00 0.00 0.00 0.00 0.00 60.65 59.55 1l9b s ILE 21 Cb 0.06 -1.61 0.03 0.00 0.01 0.00 0.00 42.46 40.95 1l9b s ILE 21 CO 0.02 -0.64 -0.12 -0.69 0.00 0.00 0.00 174.94 173.51 1l9b s VAL 22 N 1.64 1.48 0.95 2.92 1.01 -1.26 -0.19 120.40 126.95 1l9b s VAL 22 Ca 0.09 -0.67 -0.16 0.00 0.00 0.00 0.00 61.98 61.24 1l9b s VAL 22 Cb -0.17 -1.46 0.24 0.00 0.00 0.00 0.00 36.38 34.99 1l9b s VAL 22 CO -0.24 0.36 0.74 -0.90 0.00 0.00 0.00 175.10 175.06 1l9b n ASP 23 N 4.78 -2.38 0.00 3.32 5.68 -0.88 -4.67 116.55 122.41 1l9b n ASP 23 Ca -0.15 -0.87 0.12 0.00 -0.50 0.00 0.00 54.79 53.39 1l9b n ASP 23 Cb 0.49 -0.72 0.62 0.00 -1.14 0.00 0.00 41.12 40.37 1l9b n ASP 23 CO 0.00 0.00 0.00 0.47 -1.33 0.00 0.00 177.20 176.34 1l9b n ASP 24 N -4.58 0.00 0.04 -1.12 8.00 -1.26 -2.56 116.55 115.07 1l9b n ASP 24 Ca 0.11 -0.05 0.12 0.00 0.71 0.00 0.00 54.79 55.67 1l9b n ASP 24 Cb 0.43 -0.29 0.12 0.00 -0.02 0.00 0.00 41.12 41.36 1l9b n ASP 24 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 1l9b n SER 25 N -1.29 0.64 0.00 -2.24 3.41 -1.26 -4.93 113.62 107.94 1l9b n SER 25 Ca 0.12 -0.08 0.00 0.00 -0.26 0.00 0.00 58.87 58.65 1l9b n SER 25 Cb 0.20 0.44 0.00 0.00 -0.26 0.00 0.00 64.21 64.58 1l9b n SER 25 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1l9b n GLY 26 N 1.37 0.53 3.73 5.00 0.00 -1.06 -5.07 105.19 109.69 1l9b n GLY 26 Ca 0.03 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.64 1l9b n GLY 26 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1l9b s THR 27 N -2.00 4.77 -0.25 2.61 2.01 -1.26 -4.88 115.64 116.64 1l9b s THR 27 Ca 0.00 1.84 -0.27 0.00 0.31 0.00 0.00 61.69 63.57 1l9b s THR 27 Cb 0.00 -4.22 0.00 0.00 0.01 0.00 0.00 72.50 68.30 1l9b s THR 27 CO 0.00 0.27 0.93 -0.89 -0.69 0.00 0.00 174.62 174.24 1l9b s THR 28 N 0.42 4.75 -0.05 -0.82 2.01 -1.26 -2.08 115.64 118.60 1l9b s THR 28 Ca 0.44 1.75 0.13 0.00 0.31 0.00 0.00 61.69 64.33 1l9b s THR 28 Cb -0.21 -4.22 -0.20 0.00 0.01 0.00 0.00 72.50 67.88 1l9b s THR 28 CO 0.25 -0.15 0.76 0.40 -0.69 0.00 0.00 174.62 175.19 1l9b h ILE 29 N 5.47 0.83 -1.55 1.82 5.03 -0.97 -3.48 117.51 124.66 1l9b h ILE 29 Ca -0.21 -2.59 0.07 0.00 -0.12 0.00 0.00 64.86 62.02 1l9b h ILE 29 Cb 1.08 2.36 -0.27 0.00 -3.03 0.00 0.00 36.82 36.96 1l9b h ILE 29 CO 0.93 0.47 0.50 0.00 -0.68 0.00 0.00 178.15 179.37 1l9b s ALA 30 N -2.69 -1.99 0.00 1.87 0.00 -1.10 -4.99 121.76 112.87 1l9b s ALA 30 Ca -0.04 1.84 0.00 0.00 0.00 0.00 0.00 51.96 53.76 1l9b s ALA 30 Cb 0.08 -1.41 0.00 0.00 0.00 0.00 0.00 23.12 21.79 1l9b s ALA 30 CO 0.82 -0.23 0.00 0.41 0.00 0.00 0.00 175.76 176.76 1l9b n GLY 31 N 2.04 3.34 1.94 0.00 0.00 -1.26 -0.46 105.19 110.78 1l9b n GLY 31 Ca -0.12 -1.68 -0.02 0.00 0.00 0.00 0.00 46.02 44.20 1l9b n GLY 31 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1l9b n ARG 32 N -1.97 1.49 -1.58 1.61 1.74 -1.26 -4.95 116.66 111.74 1l9b n ARG 32 Ca 0.00 -3.12 -0.13 0.00 -0.77 0.00 0.00 57.85 53.83 1l9b n ARG 32 Cb 0.00 -1.22 -0.04 0.00 -1.02 0.00 0.00 32.46 30.17 1l9b n ARG 32 CO 0.00 0.00 0.00 -1.71 -1.52 0.00 0.00 177.63 174.40 1l9b n ASN 33 N -0.35 -4.42 -4.77 0.55 4.05 -1.26 -4.98 115.26 104.08 1l9b n ASN 33 Ca 0.15 0.24 -0.41 0.00 0.45 0.00 0.00 54.58 55.01 1l9b n ASN 33 Cb 0.92 -3.18 -0.01 0.00 1.23 0.00 0.00 39.78 38.74 1l9b n ASN 33 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 1l9b s ALA 34 N -2.51 3.54 0.00 5.20 0.00 -1.26 -4.94 121.76 121.79 1l9b s ALA 34 Ca 0.00 1.39 0.00 0.00 0.00 0.00 0.00 51.96 53.35 1l9b s ALA 34 Cb 0.00 -3.54 0.00 0.00 0.00 0.00 0.00 23.12 19.58 1l9b s ALA 34 CO 0.00 -0.82 0.61 1.63 0.00 0.00 0.00 175.76 177.19 1l9b n LYS 35 N 0.83 0.82 -0.19 0.00 5.02 -1.23 -4.33 118.16 119.09 1l9b n LYS 35 Ca 0.01 -0.80 -0.08 0.00 -2.02 0.00 0.00 58.31 55.42 1l9b n LYS 35 Cb 0.41 -0.83 0.01 0.00 -0.02 0.00 0.00 35.03 34.60 1l9b n LYS 35 CO 0.00 0.00 0.00 1.15 -0.52 0.00 0.00 177.40 178.03 1l9b h THR 36 N 0.70 1.23 -2.25 -0.18 2.02 -1.77 -3.44 112.91 109.22 1l9b h THR 36 Ca 0.00 -0.74 -0.52 0.00 0.77 0.00 0.00 66.41 65.92 1l9b h THR 36 Cb 0.44 0.72 -0.06 0.00 -1.74 0.00 0.00 68.15 67.51 1l9b h THR 36 CO 0.00 0.28 -0.55 -0.83 0.37 0.00 0.00 175.52 174.78 1l9b s GLY 37 N -3.13 1.48 0.90 2.16 0.00 0.21 -4.96 107.32 103.98 1l9b s GLY 37 Ca -0.13 -1.45 -0.10 0.00 0.00 0.00 0.00 44.72 43.04 1l9b s GLY 37 CO 0.79 -1.49 1.13 2.56 0.00 0.00 0.00 173.10 176.09 1l9b s PRO 38 N -3.74 1.14 -0.01 2.90 0.04 -1.26 -4.56 135.00 129.51 1l9b s PRO 38 Ca 0.32 1.47 -0.30 0.00 0.04 0.00 0.00 61.00 62.53 1l9b s PRO 38 Cb -0.08 -1.75 -0.06 0.00 0.04 0.00 0.00 34.50 32.65 1l9b s PRO 38 CO 0.24 -2.52 1.54 1.21 0.04 0.00 0.00 177.00 177.51 1l9b s ASN 39 N -2.78 6.73 0.00 6.66 3.84 -1.26 -4.31 114.94 123.82 1l9b s ASN 39 Ca 0.66 2.22 0.27 0.00 0.21 0.00 0.00 52.86 56.23 1l9b s ASN 39 Cb -0.22 -2.55 1.29 0.00 -0.55 0.00 0.00 41.25 39.22 1l9b s ASN 39 CO 0.58 -0.84 1.87 0.18 -2.79 0.00 0.00 177.10 176.10 1l9b n LEU 40 N 6.11 0.88 -4.70 3.21 4.77 -0.46 -4.83 117.00 121.99 1l9b n LEU 40 Ca 0.15 -0.31 -0.42 0.00 -0.03 0.00 0.00 56.01 55.40 1l9b n LEU 40 Cb 0.43 -0.02 -0.03 0.00 -2.33 0.00 0.00 43.42 41.47 1l9b n LEU 40 CO 0.61 0.16 1.00 -0.47 -1.33 0.00 0.00 177.39 177.35 1l9b s TYR 41 N -1.97 3.18 0.00 -1.77 5.04 -1.26 -2.46 117.35 118.10 1l9b s TYR 41 Ca 0.39 1.08 0.00 0.00 -2.44 0.00 0.00 57.07 56.10 1l9b s TYR 41 Cb 0.20 -3.54 0.00 0.00 0.35 0.00 0.00 41.96 38.97 1l9b s TYR 41 CO 0.32 -1.82 0.00 0.41 -1.34 0.00 0.00 175.55 173.13 1l9b n GLY 42 N 3.42 0.57 0.12 8.97 0.00 0.22 -4.95 105.19 113.54 1l9b n GLY 42 Ca 0.11 -0.36 -0.06 0.00 0.00 0.00 0.00 46.02 45.70 1l9b n GLY 42 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 1l9b h VAL 43 N 0.00 1.51 -1.94 1.61 3.04 -1.57 -3.39 116.25 115.51 1l9b h VAL 43 Ca 0.00 -2.57 -0.59 0.00 -1.01 0.00 0.00 66.70 62.53 1l9b h VAL 43 Cb 0.00 2.40 0.00 0.00 -2.01 0.00 0.00 31.29 31.69 1l9b h VAL 43 CO 0.00 0.74 1.43 0.52 -1.01 0.00 0.00 177.57 179.25 1l9b n VAL 44 N -3.67 0.40 -0.82 1.51 0.31 -1.26 -0.45 118.33 114.36 1l9b n VAL 44 Ca -0.02 -0.38 0.00 0.00 -0.01 0.00 0.00 64.34 63.93 1l9b n VAL 44 Cb 0.77 -2.40 0.00 0.00 -0.91 0.00 0.00 33.84 31.29 1l9b n VAL 44 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1l9b n GLY 45 N 5.61 0.62 3.89 2.92 0.00 0.84 -4.78 105.19 114.29 1l9b n GLY 45 Ca 0.29 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 46.01 1l9b n GLY 45 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1l9b s ARG 46 N -0.18 3.71 -0.31 1.61 3.52 0.40 -4.65 118.95 123.06 1l9b s ARG 46 Ca 0.00 0.18 -0.29 0.00 -0.13 0.00 0.00 55.73 55.49 1l9b s ARG 46 Cb 0.00 -2.60 0.01 0.00 -1.56 0.00 0.00 34.95 30.80 1l9b s ARG 46 CO 0.00 0.20 1.14 0.99 -0.81 0.00 0.00 175.30 176.82 1l9b s THR 47 N -2.05 4.41 0.20 4.11 2.01 -1.26 -0.74 115.64 122.33 1l9b s THR 47 Ca 0.46 1.63 -0.30 0.00 0.31 0.00 0.00 61.69 63.79 1l9b s THR 47 Cb -0.11 -4.34 -0.16 0.00 0.01 0.00 0.00 72.50 67.90 1l9b s THR 47 CO 0.27 -0.46 0.83 0.00 -0.69 0.00 0.00 174.62 174.57 1l9b n ALA 48 N 7.03 -1.85 -1.95 7.40 0.00 -0.65 -2.74 120.51 127.76 1l9b n ALA 48 Ca 0.13 0.45 -0.05 0.00 0.00 0.00 0.00 53.44 53.96 1l9b n ALA 48 Cb 0.47 -1.82 -0.01 0.00 0.00 0.00 0.00 19.45 18.10 1l9b n ALA 48 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1l9b n GLY 49 N 1.74 0.26 0.15 0.00 0.00 -1.26 -3.84 105.19 102.24 1l9b n GLY 49 Ca 0.15 -0.71 0.02 0.00 0.00 0.00 0.00 46.02 45.48 1l9b n GLY 49 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1l9b n THR 50 N -3.83 0.51 -1.81 2.61 -2.24 -1.11 -4.83 114.28 103.58 1l9b n THR 50 Ca -0.06 -0.57 -0.42 0.00 -2.27 0.00 0.00 64.05 60.73 1l9b n THR 50 Cb 0.49 0.56 -0.03 0.00 -2.10 0.00 0.00 70.33 69.24 1l9b n THR 50 CO 0.00 0.00 0.00 -1.58 -0.57 0.00 0.00 175.07 172.92 1l9b s GLN 51 N -0.67 3.84 0.40 -0.78 -0.44 -1.26 -4.84 119.66 115.91 1l9b s GLN 51 Ca 0.05 2.19 0.25 0.00 -2.50 0.00 0.00 55.36 55.35 1l9b s GLN 51 Cb 0.05 -4.15 1.34 0.00 -1.64 0.00 0.00 33.01 28.60 1l9b s GLN 51 CO 0.00 -1.28 1.62 0.00 0.50 0.00 0.00 175.29 176.13 1l9b h ALA 52 N 11.48 2.43 0.00 1.58 0.00 -1.98 -2.39 119.26 130.38 1l9b h ALA 52 Ca -0.42 0.17 -0.20 0.00 0.00 0.00 0.00 54.91 54.46 1l9b h ALA 52 Cb 1.21 0.23 -0.03 0.00 0.00 0.00 0.00 17.79 19.19 1l9b h ALA 52 CO 0.96 -1.10 -1.53 -0.25 0.00 0.00 0.00 179.25 177.33 1l9b n ASP 53 N -4.92 0.81 -4.66 0.00 8.00 -1.26 -4.88 116.55 109.64 1l9b n ASP 53 Ca 0.36 0.36 -0.42 0.00 0.71 0.00 0.00 54.79 55.80 1l9b n ASP 53 Cb 1.31 0.19 -0.03 0.00 -0.02 0.00 0.00 41.12 42.57 1l9b n ASP 53 CO 0.00 0.00 0.00 0.12 -0.39 0.00 0.00 177.20 176.93 1l9b s PHE 54 N -2.85 2.06 -1.01 1.24 5.36 -0.90 -4.87 117.98 117.00 1l9b s PHE 54 Ca -0.04 0.29 0.16 0.00 -0.96 0.00 0.00 56.93 56.38 1l9b s PHE 54 Cb 0.09 -3.88 0.51 0.00 -0.34 0.00 0.00 43.02 39.39 1l9b s PHE 54 CO 0.82 -3.61 1.43 1.63 -1.46 0.00 0.00 175.22 174.02 1l9b n LYS 55 N 7.13 3.09 -0.57 10.12 4.76 -1.26 -4.56 118.16 136.87 1l9b n LYS 55 Ca 0.17 -2.50 0.04 0.00 -2.87 0.00 0.00 58.31 53.15 1l9b n LYS 55 Cb 0.43 -1.58 0.20 0.00 -1.84 0.00 0.00 35.03 32.24 1l9b n LYS 55 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1l9b n GLY 56 N 0.67 4.94 3.76 0.72 0.00 -1.26 -5.04 105.19 108.98 1l9b n GLY 56 Ca 0.19 -1.23 -0.40 0.00 0.00 0.00 0.00 46.02 44.58 1l9b n GLY 56 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1l9b s TYR 57 N -3.15 3.34 0.93 1.61 2.02 -1.26 -4.99 117.35 115.84 1l9b s TYR 57 Ca 0.39 1.61 -0.14 0.00 -0.37 0.00 0.00 57.07 58.56 1l9b s TYR 57 Cb 0.36 -3.38 0.19 0.00 -0.40 0.00 0.00 41.96 38.74 1l9b s TYR 57 CO -0.02 -0.99 1.28 0.20 -1.57 0.00 0.00 175.55 174.45 1l9b s GLY 58 N -0.90 1.78 0.06 0.71 0.00 -1.26 -4.94 107.32 102.77 1l9b s GLY 58 Ca 0.49 -1.31 -0.15 0.00 0.00 0.00 0.00 44.72 43.75 1l9b s GLY 58 CO 0.42 -0.56 1.13 0.83 0.00 0.00 0.00 173.10 174.92 1l9b h GLU 59 N -1.50 0.64 -0.63 2.90 4.39 -1.97 -2.74 114.58 115.68 1l9b h GLU 59 Ca -0.43 -0.78 0.01 0.00 0.34 0.00 0.00 59.36 58.50 1l9b h GLU 59 Cb 1.24 0.24 -0.03 0.00 -0.10 0.00 0.00 28.75 30.10 1l9b h GLU 59 CO 0.37 1.35 0.41 0.78 -1.16 0.00 0.00 179.01 180.76 1l9b h GLY 60 N 0.29 0.89 0.97 -3.84 0.00 -1.95 0.12 103.07 99.55 1l9b h GLY 60 Ca -0.16 -0.32 -0.02 0.00 0.00 0.00 0.00 47.33 46.82 1l9b h GLY 60 CO 0.22 0.30 0.23 1.98 0.00 0.00 0.00 176.54 179.27 1l9b h MET 61 N 0.83 0.75 -0.06 4.80 1.85 -1.83 -2.06 114.93 119.21 1l9b h MET 61 Ca 0.24 -0.12 -0.12 0.00 -0.61 0.00 0.00 59.70 59.09 1l9b h MET 61 Cb -0.07 -0.13 -0.01 0.00 0.43 0.00 0.00 31.60 31.82 1l9b h MET 61 CO -0.06 0.64 -0.49 0.87 -0.40 0.00 0.00 176.91 177.47 1l9b h LYS 62 N 0.69 0.15 0.00 0.39 1.57 -1.14 -2.63 116.57 115.61 1l9b h LYS 62 Ca 0.17 -0.08 0.00 0.00 -1.87 0.00 0.00 60.65 58.87 1l9b h LYS 62 Cb 0.15 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.47 1l9b h LYS 62 CO -0.02 0.62 -0.09 0.39 -0.57 0.00 0.00 179.45 179.77 1l9b n GLU 63 N -3.95 0.17 0.02 3.15 1.02 0.39 -2.05 120.64 119.38 1l9b n GLU 63 Ca -0.02 0.13 -0.10 0.00 -0.02 0.00 0.00 57.16 57.15 1l9b n GLU 63 Cb 0.53 -1.68 -0.14 0.00 -0.02 0.00 0.00 31.44 30.13 1l9b n GLU 63 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1l9b h ALA 64 N 2.69 0.56 -0.05 0.62 0.00 -1.11 -2.70 119.26 119.27 1l9b h ALA 64 Ca 0.00 -1.25 -0.19 0.00 0.00 0.00 0.00 54.91 53.47 1l9b h ALA 64 Cb 0.65 0.29 -0.01 0.00 0.00 0.00 0.00 17.79 18.73 1l9b h ALA 64 CO 0.00 1.41 -0.78 0.78 0.00 0.00 0.00 179.25 180.65 1l9b h GLY 65 N 2.92 0.39 1.76 0.00 0.00 -1.40 0.19 103.07 106.93 1l9b h GLY 65 Ca -0.21 -0.59 -0.08 0.00 0.00 0.00 0.00 47.33 46.44 1l9b h GLY 65 CO 0.11 0.53 -0.28 0.00 0.00 0.00 0.00 176.54 176.89 1l9b h ALA 66 N 0.93 1.25 -0.13 3.60 0.00 -1.47 -1.07 119.26 122.37 1l9b h ALA 66 Ca -0.04 -0.33 0.00 0.00 0.00 0.00 0.00 54.91 54.54 1l9b h ALA 66 Cb 1.37 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 19.07 1l9b h ALA 66 CO 0.13 0.50 0.00 1.63 0.00 0.00 0.00 179.25 181.51 1l9b n LYS 67 N -4.13 1.35 -1.54 0.00 5.02 -1.02 -4.87 118.16 112.97 1l9b n LYS 67 Ca -0.01 -0.49 0.00 0.00 -2.02 0.00 0.00 58.31 55.79 1l9b n LYS 67 Cb 0.39 -1.16 0.00 0.00 -0.02 0.00 0.00 35.03 34.24 1l9b n LYS 67 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1l9b n GLY 68 N 0.65 0.83 3.67 0.72 0.00 -0.41 -5.05 105.19 105.61 1l9b n GLY 68 Ca 0.05 -0.63 -0.41 0.00 0.00 0.00 0.00 46.02 45.03 1l9b n GLY 68 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1l9b s LEU 69 N -0.13 4.18 -0.07 0.99 2.96 0.04 -5.00 118.68 121.65 1l9b s LEU 69 Ca 0.00 1.12 0.03 0.00 -0.22 0.00 0.00 54.13 55.06 1l9b s LEU 69 Cb 0.00 -3.18 0.01 0.00 0.50 0.00 0.00 46.19 43.52 1l9b s LEU 69 CO 0.00 -0.37 -0.15 0.00 -1.32 0.00 0.00 176.35 174.51 1l9b s ALA 70 N 2.06 1.50 0.09 5.97 0.00 -1.26 -1.64 121.76 128.47 1l9b s ALA 70 Ca 0.37 -0.57 -0.31 0.00 0.00 0.00 0.00 51.96 51.45 1l9b s ALA 70 Cb -0.16 -0.61 -0.09 0.00 0.00 0.00 0.00 23.12 22.25 1l9b s ALA 70 CO 0.12 0.17 1.68 -1.58 0.00 0.00 0.00 175.76 176.16 1l9b s TRP 71 N 0.52 2.42 0.31 0.00 0.52 0.09 -4.87 118.94 117.93 1l9b s TRP 71 Ca -0.14 0.28 0.06 0.00 0.02 0.00 0.00 56.10 56.32 1l9b s TRP 71 Cb -0.16 -4.00 -0.03 0.00 -1.15 0.00 0.00 33.47 28.13 1l9b s TRP 71 CO 0.05 -4.03 0.26 0.16 0.02 0.00 0.00 176.95 173.41 1l9b s ASP 72 N 2.36 1.49 0.17 2.95 1.47 -1.26 -0.11 116.67 123.74 1l9b s ASP 72 Ca 0.75 -1.71 -0.11 0.00 1.18 0.00 0.00 52.55 52.66 1l9b s ASP 72 Cb -0.41 0.53 0.06 0.00 -0.34 0.00 0.00 42.92 42.76 1l9b s ASP 72 CO 0.33 -1.03 1.66 -0.08 0.68 0.00 0.00 175.17 176.72 1l9b h GLU 73 N 2.20 0.98 0.36 2.11 4.81 -1.98 -1.62 114.58 121.44 1l9b h GLU 73 Ca -0.26 -0.27 -0.00 0.00 -0.13 0.00 0.00 59.36 58.70 1l9b h GLU 73 Cb 1.23 -0.11 -0.03 0.00 0.63 0.00 0.00 28.75 30.47 1l9b h GLU 73 CO 0.38 0.93 -0.44 1.49 -0.73 0.00 0.00 179.01 180.65 1l9b h GLU 74 N 0.88 -0.81 -0.15 1.92 4.81 -1.98 -0.72 114.58 118.54 1l9b h GLU 74 Ca 0.18 0.05 -0.14 0.00 -0.13 0.00 0.00 59.36 59.33 1l9b h GLU 74 Cb 0.43 0.18 -0.01 0.00 0.63 0.00 0.00 28.75 29.98 1l9b h GLU 74 CO 0.01 -0.54 -0.49 0.45 -0.73 0.00 0.00 179.01 177.71 1l9b h HIS 75 N -0.84 0.48 0.30 0.92 3.86 -1.93 -3.09 115.15 114.86 1l9b h HIS 75 Ca -0.03 -0.16 0.00 0.00 -1.16 0.00 0.00 60.37 59.03 1l9b h HIS 75 Cb 0.76 -0.10 -0.02 0.00 1.06 0.00 0.00 27.41 29.11 1l9b h HIS 75 CO -0.27 0.81 -0.30 0.35 0.86 0.00 0.00 177.93 179.39 1l9b h PHE 76 N 0.32 -0.80 -0.77 2.45 3.57 -1.05 -1.07 116.94 119.58 1l9b h PHE 76 Ca 0.02 0.01 0.09 0.00 3.53 0.00 0.00 57.97 61.61 1l9b h PHE 76 Cb 0.98 0.31 -0.05 0.00 2.79 0.00 0.00 35.95 39.98 1l9b h PHE 76 CO 0.03 -0.43 0.51 0.28 -2.23 0.00 0.00 178.31 176.47 1l9b h VAL 77 N -0.63 0.96 -0.16 1.41 2.07 -1.16 -2.41 116.25 116.34 1l9b h VAL 77 Ca -0.01 -0.25 -0.05 0.00 0.82 0.00 0.00 66.70 67.21 1l9b h VAL 77 Cb 0.57 0.17 -0.00 0.00 -1.52 0.00 0.00 31.29 30.51 1l9b h VAL 77 CO -0.06 0.13 -0.10 1.56 0.02 0.00 0.00 177.57 179.12 1l9b h GLN 78 N 0.73 0.35 -0.34 1.57 1.08 -1.37 -3.30 115.11 113.84 1l9b h GLN 78 Ca 0.35 -0.16 0.00 0.00 -1.45 0.00 0.00 58.65 57.39 1l9b h GLN 78 Cb 0.40 -0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 27.81 1l9b h GLN 78 CO -0.13 0.69 0.21 -0.92 -0.95 0.00 0.00 178.83 177.73 1l9b h TYR 79 N 0.01 0.44 0.00 2.96 3.20 -0.79 -2.98 116.97 119.81 1l9b h TYR 79 Ca 0.03 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.91 1l9b h TYR 79 Cb 0.60 -0.15 0.00 0.00 1.54 0.00 0.00 36.73 38.72 1l9b h TYR 79 CO 0.07 0.30 0.00 -0.39 -1.64 0.00 0.00 178.16 176.50 1l9b h VAL 80 N 0.45 0.00 0.04 1.81 -1.51 -1.55 -1.00 116.25 114.48 1l9b h VAL 80 Ca 0.12 -0.24 -0.23 0.00 -1.23 0.00 0.00 66.70 65.13 1l9b h VAL 80 Cb -0.02 1.02 -0.02 0.00 -2.13 0.00 0.00 31.29 30.14 1l9b h VAL 80 CO -0.02 0.00 -1.07 1.56 -1.23 0.00 0.00 177.57 176.81 1l9b h GLN 81 N 0.00 0.10 -0.76 5.19 4.20 -1.59 0.21 115.11 122.46 1l9b h GLN 81 Ca 0.00 -0.16 0.06 0.00 0.06 0.00 0.00 58.65 58.60 1l9b h GLN 81 Cb 0.30 0.06 -0.20 0.00 0.30 0.00 0.00 27.48 27.94 1l9b h GLN 81 CO 0.00 1.06 -0.29 0.34 -0.67 0.00 0.00 178.83 179.27 1l9b s ASP 82 N -6.87 -1.22 0.22 1.46 -1.08 -0.93 -4.28 116.67 103.98 1l9b s ASP 82 Ca -0.01 -0.13 -0.07 0.00 -0.52 0.00 0.00 52.55 51.82 1l9b s ASP 82 Cb 0.09 1.68 0.29 0.00 -1.46 0.00 0.00 42.92 43.52 1l9b s ASP 82 CO 0.84 -0.19 1.82 -0.65 0.52 0.00 0.00 175.17 177.51 1l9b h PRO 83 N 7.29 0.78 0.20 4.34 0.11 -1.45 -2.00 132.00 141.28 1l9b h PRO 83 Ca -0.01 -0.05 -0.01 0.00 0.11 0.00 0.00 66.00 66.04 1l9b h PRO 83 Cb 1.19 -0.18 0.00 0.00 0.11 0.00 0.00 31.00 32.13 1l9b h PRO 83 CO 0.06 0.52 -0.10 1.15 -0.21 0.00 0.00 178.00 179.42 1l9b h THR 84 N 0.80 0.89 -0.16 -1.15 2.02 -1.88 -2.00 112.91 111.43 1l9b h THR 84 Ca 0.34 -0.57 0.03 0.00 0.77 0.00 0.00 66.41 66.98 1l9b h THR 84 Cb 0.19 1.23 -0.03 0.00 -1.74 0.00 0.00 68.15 67.80 1l9b h THR 84 CO -0.18 0.13 -0.05 0.50 0.37 0.00 0.00 175.52 176.28 1l9b h LYS 85 N -0.56 -0.02 -0.54 6.66 3.64 -1.91 -1.32 116.57 122.52 1l9b h LYS 85 Ca -0.03 0.00 0.10 0.00 -1.27 0.00 0.00 60.65 59.45 1l9b h LYS 85 Cb 0.42 0.01 -0.08 0.00 -0.41 0.00 0.00 32.23 32.16 1l9b h LYS 85 CO 0.05 -0.01 0.08 0.35 -2.27 0.00 0.00 179.45 177.64 1l9b h PHE 86 N -0.02 0.11 0.00 1.91 3.57 -1.36 -1.75 116.94 119.39 1l9b h PHE 86 Ca 0.08 0.03 -0.07 0.00 3.53 0.00 0.00 57.97 61.55 1l9b h PHE 86 Cb 0.15 0.03 -0.01 0.00 2.79 0.00 0.00 35.95 38.91 1l9b h PHE 86 CO -0.20 -0.05 -0.31 -0.07 -2.23 0.00 0.00 178.31 175.44 1l9b h LEU 87 N 0.20 0.00 -0.10 0.59 3.38 -0.99 -2.64 115.31 115.75 1l9b h LEU 87 Ca 0.28 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 58.19 1l9b h LEU 87 Cb 0.40 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.15 1l9b h LEU 87 CO -0.39 0.31 -0.15 0.11 0.09 0.00 0.00 178.44 178.41 1l9b h LYS 88 N 0.00 0.28 0.16 1.13 1.57 -0.39 -2.60 116.57 116.72 1l9b h LYS 88 Ca -0.00 -0.17 -0.01 0.00 -1.87 0.00 0.00 60.65 58.60 1l9b h LYS 88 Cb 0.81 0.02 0.00 0.00 0.08 0.00 0.00 32.23 33.14 1l9b h LYS 88 CO 0.04 0.74 -0.08 0.93 -0.57 0.00 0.00 179.45 180.51 1l9b h GLU 89 N -0.15 -0.21 -0.80 3.15 5.08 -1.39 -2.45 114.58 117.81 1l9b h GLU 89 Ca 0.01 0.01 0.12 0.00 -1.00 0.00 0.00 59.36 58.50 1l9b h GLU 89 Cb 0.71 0.05 -0.13 0.00 0.50 0.00 0.00 28.75 29.88 1l9b h GLU 89 CO 0.04 -0.14 -0.41 -0.92 -1.00 0.00 0.00 179.01 176.57 1l9b h TYR 90 N -0.24 -1.20 0.00 4.33 3.20 -1.61 0.25 116.97 121.71 1l9b h TYR 90 Ca -0.02 0.10 -0.01 0.00 3.14 0.00 0.00 58.73 61.94 1l9b h TYR 90 Cb 0.17 0.64 -0.00 0.00 1.54 0.00 0.00 36.73 39.07 1l9b h TYR 90 CO 0.16 -0.40 -0.04 0.00 -1.64 0.00 0.00 178.16 176.24 1l9b h THR 91 N -0.09 0.24 0.00 1.81 1.03 -1.56 -3.46 112.91 110.88 1l9b h THR 91 Ca 0.26 -0.28 0.00 0.00 -0.01 0.00 0.00 66.41 66.38 1l9b h THR 91 Cb 0.56 1.22 0.00 0.00 -1.07 0.00 0.00 68.15 68.85 1l9b h THR 91 CO -0.84 0.04 0.00 0.61 -0.01 0.00 0.00 175.52 175.32 1l9b n GLY 92 N -0.75 2.30 3.43 2.99 0.00 0.89 -4.99 105.19 109.06 1l9b n GLY 92 Ca -0.02 -0.19 -0.29 0.00 0.00 0.00 0.00 46.02 45.53 1l9b n GLY 92 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1l9b n ASP 93 N 1.08 -1.98 -0.01 1.61 -0.08 -1.23 -4.90 116.55 111.04 1l9b n ASP 93 Ca 0.00 -0.21 -0.01 0.00 -1.51 0.00 0.00 54.79 53.06 1l9b n ASP 93 Cb 0.00 -1.20 -0.01 0.00 2.34 0.00 0.00 41.12 42.25 1l9b n ASP 93 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1l9b n ALA 94 N -4.98 1.96 -0.29 -1.67 0.00 -1.26 -4.48 120.51 109.79 1l9b n ALA 94 Ca 0.02 -0.09 -0.02 0.00 0.00 0.00 0.00 53.44 53.35 1l9b n ALA 94 Cb 0.55 0.32 0.22 0.00 0.00 0.00 0.00 19.45 20.53 1l9b n ALA 94 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.50 177.86 1l9b n LYS 95 N -2.26 2.99 -2.63 0.00 2.85 -1.26 -4.91 118.16 112.93 1l9b n LYS 95 Ca -0.03 -2.00 -0.41 0.00 -1.05 0.00 0.00 58.31 54.82 1l9b n LYS 95 Cb 0.54 -1.92 -0.04 0.00 -0.65 0.00 0.00 35.03 32.96 1l9b n LYS 95 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 1l9b s ALA 96 N -2.13 3.27 -0.00 0.58 0.00 -1.26 -5.04 121.76 117.17 1l9b s ALA 96 Ca 0.36 0.66 0.08 0.00 0.00 0.00 0.00 51.96 53.05 1l9b s ALA 96 Cb 0.28 -3.34 -0.02 0.00 0.00 0.00 0.00 23.12 20.04 1l9b s ALA 96 CO 0.09 -0.19 -0.24 0.21 0.00 0.00 0.00 175.76 175.64 1l9b s LYS 97 N 0.38 1.87 -0.03 0.00 2.47 -1.26 -4.59 119.74 118.58 1l9b s LYS 97 Ca 0.51 -0.91 -0.05 0.00 -1.56 0.00 0.00 55.97 53.96 1l9b s LYS 97 Cb -0.25 -1.86 -0.04 0.00 -1.46 0.00 0.00 37.83 34.22 1l9b s LYS 97 CO 0.30 0.50 0.20 0.20 0.16 0.00 0.00 175.35 176.72 1l9b s GLY 98 N -0.73 2.20 0.00 5.54 0.00 -1.26 -4.29 107.32 108.78 1l9b s GLY 98 Ca 0.09 -0.67 0.25 0.00 0.00 0.00 0.00 44.72 44.40 1l9b s GLY 98 CO -0.00 -0.49 1.43 0.28 0.00 0.00 0.00 173.10 174.31 1l9b n LYS 99 N 1.26 0.05 -2.53 2.90 5.02 -1.26 -4.79 118.16 118.81 1l9b n LYS 99 Ca -0.13 -0.03 -0.43 0.00 -2.02 0.00 0.00 58.31 55.70 1l9b n LYS 99 Cb 0.53 -1.50 -0.02 0.00 -0.02 0.00 0.00 35.03 34.02 1l9b n LYS 99 CO 0.00 0.00 0.00 1.41 -0.52 0.00 0.00 177.40 178.29 1l9b s MET 100 N -2.97 3.64 -1.18 1.97 1.75 -1.26 -4.92 119.30 116.33 1l9b s MET 100 Ca 0.12 0.59 -0.04 0.00 -1.25 0.00 0.00 55.69 55.11 1l9b s MET 100 Cb 0.18 -3.96 0.18 0.00 2.84 0.00 0.00 34.83 34.06 1l9b s MET 100 CO 0.69 -1.50 2.25 0.25 -0.65 0.00 0.00 175.02 176.05 1l9b n THR 101 N 6.88 5.36 -3.66 10.11 -2.24 -1.26 -4.77 114.28 124.70 1l9b n THR 101 Ca 0.12 -4.72 -0.15 0.00 -2.27 0.00 0.00 64.05 57.04 1l9b n THR 101 Cb 0.49 -1.88 -0.08 0.00 -2.10 0.00 0.00 70.33 66.76 1l9b n THR 101 CO 0.00 0.00 0.00 0.12 -0.57 0.00 0.00 175.07 174.62 1l9b s PHE 102 N -2.14 -0.40 -0.06 4.78 5.36 -1.26 -5.16 117.98 119.10 1l9b s PHE 102 Ca 0.50 0.69 -0.01 0.00 -0.96 0.00 0.00 56.93 57.16 1l9b s PHE 102 Cb 0.20 0.23 0.03 0.00 -0.34 0.00 0.00 43.02 43.14 1l9b s PHE 102 CO -0.12 -0.47 -0.01 0.15 -1.46 0.00 0.00 175.22 173.32 1l9b s LYS 103 N -1.15 0.60 -0.30 10.12 1.02 -1.26 -4.59 119.74 124.18 1l9b s LYS 103 Ca -0.12 0.07 -0.22 0.00 0.02 0.00 0.00 55.97 55.73 1l9b s LYS 103 Cb -0.03 -0.88 -0.01 0.00 -0.52 0.00 0.00 37.83 36.39 1l9b s LYS 103 CO 0.06 -0.24 0.70 -1.17 -0.92 0.00 0.00 175.35 173.78 1l9b s LEU 104 N 1.68 4.11 -0.01 3.17 2.96 0.75 -4.97 118.68 126.36 1l9b s LEU 104 Ca 0.00 0.58 -0.13 0.00 -0.22 0.00 0.00 54.13 54.37 1l9b s LEU 104 Cb -0.13 -2.94 -0.07 0.00 0.50 0.00 0.00 46.19 43.55 1l9b s LEU 104 CO -0.04 -0.52 0.70 0.11 -1.32 0.00 0.00 176.35 175.29 1l9b h LYS 105 N 8.10 -0.46 -6.31 1.98 1.79 -1.88 -3.35 116.57 116.44 1l9b h LYS 105 Ca -0.26 0.03 -0.54 0.00 -2.18 0.00 0.00 60.65 57.70 1l9b h LYS 105 Cb 1.11 0.10 -0.00 0.00 -1.58 0.00 0.00 32.23 31.86 1l9b h LYS 105 CO 0.83 -0.30 1.03 0.15 -1.08 0.00 0.00 179.45 180.07 1l9b s LYS 106 N -3.23 4.20 0.53 3.15 1.02 -1.26 -4.90 119.74 119.25 1l9b s LYS 106 Ca -0.07 2.16 0.30 0.00 0.02 0.00 0.00 55.97 58.39 1l9b s LYS 106 Cb 0.01 -3.85 1.42 0.00 -0.52 0.00 0.00 37.83 34.89 1l9b s LYS 106 CO 0.21 -0.78 2.03 1.49 -0.92 0.00 0.00 175.35 177.37 1l9b h GLU 107 N 9.01 0.00 -0.24 1.68 4.81 -1.97 -2.80 114.58 125.08 1l9b h GLU 107 Ca -0.39 0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 58.82 1l9b h GLU 107 Cb 1.18 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.55 1l9b h GLU 107 CO 0.94 0.10 0.07 0.00 -0.73 0.00 0.00 179.01 179.39 1l9b h ALA 108 N 1.90 0.31 0.00 2.92 0.00 -1.99 -2.48 119.26 119.92 1l9b h ALA 108 Ca -0.00 -0.15 -0.02 0.00 0.00 0.00 0.00 54.91 54.74 1l9b h ALA 108 Cb 0.44 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.14 1l9b h ALA 108 CO 0.01 -0.05 -0.08 -0.44 0.00 0.00 0.00 179.25 178.69 1l9b h ASP 109 N 0.21 0.00 -0.52 0.00 3.32 -1.90 -1.14 116.42 116.39 1l9b h ASP 109 Ca 0.08 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 57.10 1l9b h ASP 109 Cb 0.26 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.78 1l9b h ASP 109 CO -0.00 0.08 0.23 0.00 -1.72 0.00 0.00 179.24 177.84 1l9b h ALA 110 N 1.92 0.67 -0.19 3.45 0.00 -1.41 0.24 119.26 123.93 1l9b h ALA 110 Ca -0.00 -0.13 -0.18 0.00 0.00 0.00 0.00 54.91 54.59 1l9b h ALA 110 Cb 0.16 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 17.75 1l9b h ALA 110 CO 0.01 0.25 -0.62 0.45 0.00 0.00 0.00 179.25 179.33 1l9b h HIS 111 N 0.69 0.86 -0.45 0.00 3.86 -1.15 -2.34 115.15 116.61 1l9b h HIS 111 Ca 0.18 -0.33 -0.05 0.00 -1.16 0.00 0.00 60.37 59.00 1l9b h HIS 111 Cb 0.15 -0.15 -0.02 0.00 1.06 0.00 0.00 27.41 28.45 1l9b h HIS 111 CO -0.00 1.12 0.09 -0.91 0.86 0.00 0.00 177.93 179.09 1l9b h ASN 112 N 0.49 0.70 -0.57 2.45 4.21 -1.01 -1.55 115.58 120.30 1l9b h ASN 112 Ca -0.01 -0.24 -0.10 0.00 1.21 0.00 0.00 56.30 57.16 1l9b h ASN 112 Cb 1.21 -0.19 -0.02 0.00 -1.12 0.00 0.00 38.32 38.20 1l9b h ASN 112 CO 0.12 0.76 -0.03 0.40 -1.29 0.00 0.00 177.43 177.40 1l9b h ILE 113 N 0.61 1.27 -0.33 2.81 2.04 -0.97 -1.91 117.51 121.03 1l9b h ILE 113 Ca 0.14 -1.18 -0.03 0.00 1.00 0.00 0.00 64.86 64.79 1l9b h ILE 113 Cb 0.35 0.84 -0.02 0.00 -0.74 0.00 0.00 36.82 37.25 1l9b h ILE 113 CO 0.00 0.43 0.07 -0.25 0.00 0.00 0.00 178.15 178.40 1l9b h TRP 114 N 0.95 0.49 0.00 1.37 2.91 -1.22 0.23 115.95 120.68 1l9b h TRP 114 Ca 0.16 -0.03 -0.07 0.00 1.13 0.00 0.00 58.89 60.08 1l9b h TRP 114 Cb 0.59 -0.15 -0.01 0.00 -0.51 0.00 0.00 29.16 29.08 1l9b h TRP 114 CO 0.04 0.44 -0.33 0.00 -1.03 0.00 0.00 178.44 177.56 1l9b h ALA 115 N 1.60 1.00 0.04 2.65 0.00 -0.91 -2.31 119.26 121.34 1l9b h ALA 115 Ca 0.11 -0.30 -0.22 0.00 0.00 0.00 0.00 54.91 54.50 1l9b h ALA 115 Cb 0.21 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 1l9b h ALA 115 CO -0.00 0.41 -1.03 -0.92 0.00 0.00 0.00 179.25 177.71 1l9b h TYR 116 N 0.00 0.24 -0.02 0.00 3.20 -0.28 -2.97 116.97 117.14 1l9b h TYR 116 Ca -0.00 -0.16 -0.14 0.00 3.14 0.00 0.00 58.73 61.56 1l9b h TYR 116 Cb 0.86 -0.02 -0.02 0.00 1.54 0.00 0.00 36.73 39.09 1l9b h TYR 116 CO 0.00 1.07 -0.65 -0.07 -1.64 0.00 0.00 178.16 176.87 1l9b h LEU 117 N 0.06 0.11 -0.44 2.82 3.38 -0.70 -2.22 115.31 118.32 1l9b h LEU 117 Ca -0.06 -0.07 -0.12 0.00 0.09 0.00 0.00 57.88 57.72 1l9b h LEU 117 Cb 1.73 -0.03 -0.02 0.00 0.09 0.00 0.00 40.66 42.43 1l9b h LEU 117 CO 0.15 0.73 -0.58 1.56 0.09 0.00 0.00 178.44 180.40 1l9b h GLN 118 N 0.07 0.00 0.01 1.13 4.20 -1.46 0.63 115.11 119.68 1l9b h GLN 118 Ca -0.01 0.00 -0.20 0.00 0.06 0.00 0.00 58.65 58.50 1l9b h GLN 118 Cb 1.16 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 28.91 1l9b h GLN 118 CO 0.09 0.58 -0.97 0.37 -0.67 0.00 0.00 178.83 178.23 1l9b h GLN 119 N 0.00 0.02 0.00 1.46 4.15 -1.34 -3.40 115.11 116.00 1l9b h GLN 119 Ca -0.01 -0.03 0.00 0.00 0.77 0.00 0.00 58.65 59.39 1l9b h GLN 119 Cb 1.25 0.01 0.00 0.00 0.21 0.00 0.00 27.48 28.95 1l9b h GLN 119 CO 0.07 0.97 0.00 1.33 -1.93 0.00 0.00 178.83 179.27 1l9b n VAL 120 N -3.42 0.00 -0.16 2.39 0.24 -0.85 -4.86 118.33 111.67 1l9b n VAL 120 Ca -0.01 -0.18 0.04 0.00 -2.04 0.00 0.00 64.34 62.16 1l9b n VAL 120 Cb 0.90 1.20 0.11 0.00 -1.47 0.00 0.00 33.84 34.58 1l9b n VAL 120 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1l9b n ALA 121 N -0.24 2.15 -2.65 2.33 0.00 0.22 -4.92 120.51 117.40 1l9b n ALA 121 Ca 0.00 -1.16 -0.41 0.00 0.00 0.00 0.00 53.44 51.87 1l9b n ALA 121 Cb 0.05 -0.31 -0.05 0.00 0.00 0.00 0.00 19.45 19.15 1l9b n ALA 121 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1l9b s VAL 122 N -1.09 4.87 -0.62 0.00 1.01 -1.12 0.72 120.40 124.18 1l9b s VAL 122 Ca 0.17 1.51 -0.27 0.00 0.00 0.00 0.00 61.98 63.39 1l9b s VAL 122 Cb 0.09 -4.09 0.03 0.00 0.00 0.00 0.00 36.38 32.42 1l9b s VAL 122 CO 0.10 -0.03 1.16 -0.60 0.00 0.00 0.00 175.10 175.73 1l9b s ARG 123 N 2.60 3.38 0.00 2.72 3.52 -1.26 -4.87 118.95 125.03 1l9b s ARG 123 Ca 0.34 -0.01 0.00 0.00 -0.13 0.00 0.00 55.73 55.93 1l9b s ARG 123 Cb -0.16 -4.07 0.00 0.00 -1.56 0.00 0.00 34.95 29.16 1l9b s ARG 123 CO 0.09 -1.77 0.01 -0.35 -0.81 0.00 0.00 175.30 172.47