#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bse s ILE 4 N 0.00 5.22 -0.03 1.34 1.01 -1.26 -4.87 121.20 122.61 1bse s ILE 4 Ca 0.00 -0.94 0.13 0.00 0.00 0.00 0.00 60.65 59.84 1bse s ILE 4 Cb 0.00 -4.10 0.23 0.00 0.01 0.00 0.00 42.46 38.60 1bse s ILE 4 CO 0.00 -0.54 1.11 -0.46 0.00 0.00 0.00 174.94 175.05 1bse n ASN 5 N 5.26 -0.03 -4.79 3.58 6.94 -1.26 -4.82 115.26 120.14 1bse n ASN 5 Ca -0.12 -2.01 -0.25 0.00 -0.02 0.00 0.00 54.58 52.18 1bse n ASN 5 Cb 0.44 0.02 -0.05 0.00 -2.36 0.00 0.00 39.78 37.83 1bse n ASN 5 CO 0.00 0.00 0.00 0.42 -1.03 0.00 0.00 177.26 176.65 1bse s THR 6 N -0.17 4.42 0.18 5.53 -4.23 -1.26 -0.05 115.64 120.06 1bse s THR 6 Ca 0.17 -1.18 -0.17 0.00 -1.18 0.00 0.00 61.69 59.32 1bse s THR 6 Cb 0.21 -3.28 0.13 0.00 1.34 0.00 0.00 72.50 70.90 1bse s THR 6 CO -0.08 -0.16 1.64 -0.26 -0.54 0.00 0.00 174.62 175.21 1bse h PHE 7 N 2.22 -0.41 -0.23 3.99 0.04 -1.98 0.15 116.94 120.72 1bse h PHE 7 Ca -0.48 0.05 -0.20 0.00 2.80 0.00 0.00 57.97 60.14 1bse h PHE 7 Cb 1.21 0.25 0.00 0.00 2.20 0.00 0.00 35.95 39.62 1bse h PHE 7 CO 0.58 -0.26 -0.64 -0.44 -0.60 0.00 0.00 178.31 176.95 1bse h ASP 8 N -0.07 0.93 -0.48 2.17 3.32 -1.98 0.14 116.42 120.44 1bse h ASP 8 Ca 0.22 -0.54 -0.11 0.00 0.02 0.00 0.00 57.03 56.63 1bse h ASP 8 Cb 0.41 -0.27 -0.02 0.00 0.22 0.00 0.00 39.33 39.68 1bse h ASP 8 CO -0.52 1.34 -0.11 1.23 -1.72 0.00 0.00 179.24 179.46 1bse h GLY 9 N 0.69 1.01 0.44 2.75 0.00 -1.87 -1.65 103.07 104.44 1bse h GLY 9 Ca -0.01 -0.82 -0.07 0.00 0.00 0.00 0.00 47.33 46.42 1bse h GLY 9 CO 0.14 0.75 -0.30 -2.08 0.00 0.00 0.00 176.54 175.05 1bse h VAL 10 N 0.78 1.57 -0.58 4.60 2.07 -1.02 -1.60 116.25 122.08 1bse h VAL 10 Ca 0.12 -2.07 0.12 0.00 0.82 0.00 0.00 66.70 65.69 1bse h VAL 10 Cb 0.66 2.89 -0.11 0.00 -1.52 0.00 0.00 31.29 33.21 1bse h VAL 10 CO 0.05 0.57 -0.15 0.00 0.02 0.00 0.00 177.57 178.05 1bse h ALA 11 N 0.21 0.36 -0.20 1.67 0.00 -0.71 -0.27 119.26 120.32 1bse h ALA 11 Ca -0.04 0.22 -0.03 0.00 0.00 0.00 0.00 54.91 55.07 1bse h ALA 11 Cb 1.09 0.45 -0.01 0.00 0.00 0.00 0.00 17.79 19.33 1bse h ALA 11 CO 0.06 -0.44 0.03 -0.44 0.00 0.00 0.00 179.25 178.46 1bse h ASP 12 N -0.01 0.33 -0.30 0.00 3.32 -1.36 -2.96 116.42 115.43 1bse h ASP 12 Ca 0.28 -0.27 0.05 0.00 0.02 0.00 0.00 57.03 57.11 1bse h ASP 12 Cb 0.43 -0.09 -0.05 0.00 0.22 0.00 0.00 39.33 39.84 1bse h ASP 12 CO -0.60 0.51 -0.02 0.22 -1.72 0.00 0.00 179.24 177.63 1bse h TYR 13 N 0.13 -0.06 -0.87 4.55 5.03 -0.63 -2.99 116.97 122.13 1bse h TYR 13 Ca 0.06 0.02 0.14 0.00 2.58 0.00 0.00 58.73 61.53 1bse h TYR 13 Cb 0.33 0.07 -0.07 0.00 1.55 0.00 0.00 36.73 38.61 1bse h TYR 13 CO 0.02 -0.08 0.56 -0.07 -1.32 0.00 0.00 178.16 177.28 1bse h LEU 14 N 0.06 0.64 0.00 2.82 3.38 -0.92 -1.00 115.31 120.29 1bse h LEU 14 Ca 0.14 0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.15 1bse h LEU 14 Cb 0.20 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 40.86 1bse h LEU 14 CO -0.26 0.33 -0.33 1.56 0.09 0.00 0.00 178.44 179.83 1bse h GLN 15 N 0.68 0.00 0.00 1.13 4.20 -1.43 -1.78 115.11 117.91 1bse h GLN 15 Ca 0.43 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.14 1bse h GLN 15 Cb 0.69 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.47 1bse h GLN 15 CO -0.19 0.00 0.00 2.41 -0.67 0.00 0.00 178.83 180.38 1bse n THR 16 N -2.76 0.00 0.87 -0.54 -1.04 -0.90 -4.65 114.28 105.26 1bse n THR 16 Ca 0.03 0.37 0.14 0.00 -2.04 0.00 0.00 64.05 62.54 1bse n THR 16 Cb 0.51 -1.20 0.54 0.00 -1.82 0.00 0.00 70.33 68.37 1bse n THR 16 CO 0.00 0.00 0.00 -1.22 -0.64 0.00 0.00 175.07 173.21 1bse n TYR 17 N -1.83 0.32 -2.52 -1.42 4.02 -0.43 -4.94 117.16 110.36 1bse n TYR 17 Ca 0.00 0.09 -0.19 0.00 -0.01 0.00 0.00 57.90 57.80 1bse n TYR 17 Cb 0.00 -0.65 -0.00 0.00 -0.02 0.00 0.00 39.34 38.66 1bse n TYR 17 CO 0.00 0.00 0.00 0.72 -1.01 0.00 0.00 176.86 176.57 1bse n HIS 18 N -1.76 -1.26 -3.68 -0.72 8.25 -0.67 -4.94 115.22 110.44 1bse n HIS 18 Ca 0.06 0.08 -0.10 0.00 -0.26 0.00 0.00 57.72 57.51 1bse n HIS 18 Cb 0.37 -3.68 -0.04 0.00 1.12 0.00 0.00 29.99 27.76 1bse n HIS 18 CO 0.00 0.00 0.00 0.21 0.64 0.00 0.00 176.34 177.19 1bse s LYS 19 N -5.16 1.29 0.53 -0.41 2.36 -1.25 -5.05 119.74 112.04 1bse s LYS 19 Ca 0.05 -0.78 -0.08 0.00 -2.55 0.00 0.00 55.97 52.61 1bse s LYS 19 Cb -0.02 0.51 -0.04 0.00 -1.05 0.00 0.00 37.83 37.23 1bse s LYS 19 CO 0.07 -0.54 0.87 -0.51 1.55 0.00 0.00 175.35 176.79 1bse s LEU 20 N -2.84 3.50 0.94 5.43 1.43 -1.26 -4.03 118.68 121.85 1bse s LEU 20 Ca 0.07 1.12 -0.11 0.00 -1.03 0.00 0.00 54.13 54.18 1bse s LEU 20 Cb -0.00 -4.11 0.16 0.00 0.03 0.00 0.00 46.19 42.27 1bse s LEU 20 CO -0.06 -0.67 1.11 -2.84 0.23 0.00 0.00 176.35 174.11 1bse s PRO 21 N -4.84 0.82 0.00 1.29 0.02 -1.26 -4.92 135.00 126.11 1bse s PRO 21 Ca 0.50 1.27 0.30 0.00 0.02 0.00 0.00 61.00 63.09 1bse s PRO 21 Cb -0.11 -1.73 1.53 0.00 0.02 0.00 0.00 34.50 34.22 1bse s PRO 21 CO 0.47 -2.67 2.04 -0.40 -0.33 0.00 0.00 177.00 176.11 1bse n ASP 22 N -4.23 0.00 -0.66 2.53 5.68 -1.26 -2.86 116.55 115.75 1bse n ASP 22 Ca 0.09 -0.24 0.07 0.00 -0.50 0.00 0.00 54.79 54.20 1bse n ASP 22 Cb 0.53 -0.25 0.20 0.00 -1.14 0.00 0.00 41.12 40.46 1bse n ASP 22 CO 0.00 0.00 0.00 -0.46 -1.33 0.00 0.00 177.20 175.41 1bse n ASN 23 N -1.25 1.91 -4.80 -1.12 6.94 -1.26 -4.89 115.26 110.80 1bse n ASN 23 Ca 0.15 -1.95 -0.34 0.00 -0.02 0.00 0.00 54.58 52.42 1bse n ASN 23 Cb 0.22 -0.22 -0.07 0.00 -2.36 0.00 0.00 39.78 37.35 1bse n ASN 23 CO 0.00 0.00 0.00 -0.31 -1.03 0.00 0.00 177.26 175.92 1bse s TYR 24 N -1.56 3.35 0.01 -2.53 1.51 -1.14 -1.03 117.35 115.98 1bse s TYR 24 Ca 0.26 0.28 -0.02 0.00 -1.01 0.00 0.00 57.07 56.57 1bse s TYR 24 Cb 0.14 -1.79 -0.01 0.00 -0.11 0.00 0.00 41.96 40.18 1bse s TYR 24 CO 0.18 0.58 0.02 0.96 -1.11 0.00 0.00 175.55 176.19 1bse s ILE 25 N -1.13 0.10 0.85 2.71 -4.36 -0.44 -4.88 121.20 114.05 1bse s ILE 25 Ca 0.20 -0.82 -0.12 0.00 -0.26 0.00 0.00 60.65 59.65 1bse s ILE 25 Cb -0.12 -0.31 0.10 0.00 1.25 0.00 0.00 42.46 43.38 1bse s ILE 25 CO 0.11 -0.45 1.13 0.42 0.24 0.00 0.00 174.94 176.39 1bse s THR 26 N -1.40 2.38 0.09 8.37 -4.23 -1.24 -1.13 115.64 118.48 1bse s THR 26 Ca -0.15 0.12 -0.23 0.00 -1.18 0.00 0.00 61.69 60.25 1bse s THR 26 Cb -0.09 -2.94 -0.15 0.00 1.34 0.00 0.00 72.50 70.66 1bse s THR 26 CO -0.00 -0.16 1.72 0.11 -0.54 0.00 0.00 174.62 175.75 1bse h LYS 27 N -1.25 -0.02 -0.08 3.99 1.57 -1.97 -1.24 116.57 117.58 1bse h LYS 27 Ca -0.48 0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.27 1bse h LYS 27 Cb 1.31 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.62 1bse h LYS 27 CO 0.62 -0.00 -0.10 0.66 -0.57 0.00 0.00 179.45 180.06 1bse h SER 28 N -0.04 0.10 -0.37 0.86 4.64 -1.99 -0.35 113.55 116.41 1bse h SER 28 Ca -0.00 -0.02 -0.05 0.00 -0.47 0.00 0.00 61.79 61.26 1bse h SER 28 Cb 0.03 -0.03 -0.01 0.00 -0.31 0.00 0.00 62.40 62.08 1bse h SER 28 CO 0.00 0.23 0.05 -0.33 -0.87 0.00 0.00 176.83 175.91 1bse h GLU 29 N 0.11 0.62 -0.15 4.77 5.08 -1.84 -0.81 114.58 122.36 1bse h GLU 29 Ca 0.02 -0.17 -0.01 0.00 -1.00 0.00 0.00 59.36 58.20 1bse h GLU 29 Cb 0.26 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.43 1bse h GLU 29 CO 0.02 0.70 0.07 0.00 -1.00 0.00 0.00 179.01 178.79 1bse h ALA 30 N 0.90 0.19 -0.81 3.43 0.00 -0.82 -2.53 119.26 119.63 1bse h ALA 30 Ca 0.11 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 1bse h ALA 30 Cb 0.38 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 18.07 1bse h ALA 30 CO 0.01 -0.23 0.46 1.96 0.00 0.00 0.00 179.25 181.45 1bse h GLN 31 N 0.10 1.11 -0.87 0.00 4.20 -0.97 -2.07 115.11 116.61 1bse h GLN 31 Ca 0.05 -0.11 0.05 0.00 0.06 0.00 0.00 58.65 58.69 1bse h GLN 31 Cb 0.15 -0.23 -0.06 0.00 0.30 0.00 0.00 27.48 27.65 1bse h GLN 31 CO -0.01 0.79 0.55 0.00 -0.67 0.00 0.00 178.83 179.50 1bse h ALA 32 N 1.39 1.17 0.00 3.87 0.00 -0.81 -1.30 119.26 123.57 1bse h ALA 32 Ca 0.29 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.17 1bse h ALA 32 Cb -0.01 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 17.51 1bse h ALA 32 CO -0.05 0.36 0.00 1.28 0.00 0.00 0.00 179.25 180.84 1bse n LEU 33 N -4.57 0.00 0.00 0.00 4.77 -0.83 -4.89 117.00 111.47 1bse n LEU 33 Ca 0.12 0.23 0.00 0.00 -0.03 0.00 0.00 56.01 56.33 1bse n LEU 33 Cb 0.13 -0.23 0.00 0.00 -2.33 0.00 0.00 43.42 40.98 1bse n LEU 33 CO 0.33 -0.06 0.00 0.61 -1.33 0.00 0.00 177.39 176.94 1bse n GLY 34 N 0.60 1.03 3.72 -0.72 0.00 -0.49 -4.86 105.19 104.46 1bse n GLY 34 Ca 0.12 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.72 1bse n GLY 34 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 1bse s TRP 35 N -2.00 3.25 -0.23 1.61 -0.00 -0.87 -4.94 118.94 115.76 1bse s TRP 35 Ca 0.00 1.03 -0.01 0.00 -0.00 0.00 0.00 56.10 57.12 1bse s TRP 35 Cb 0.00 -3.66 0.07 0.00 -0.00 0.00 0.00 33.47 29.88 1bse s TRP 35 CO 0.00 -2.22 0.02 0.08 -0.00 0.00 0.00 176.95 174.82 1bse s VAL 36 N 0.83 0.99 0.36 5.86 1.01 -1.26 -4.43 120.40 123.76 1bse s VAL 36 Ca 0.62 -0.99 0.13 0.00 0.00 0.00 0.00 61.98 61.75 1bse s VAL 36 Cb -0.37 -1.46 0.35 0.00 0.00 0.00 0.00 36.38 34.90 1bse s VAL 36 CO 0.32 -0.27 1.76 0.00 0.00 0.00 0.00 175.10 176.92 1bse h ALA 37 N 8.10 1.99 0.00 5.51 0.00 -1.99 -2.01 119.26 130.86 1bse h ALA 37 Ca -0.16 0.08 -0.06 0.00 0.00 0.00 0.00 54.91 54.77 1bse h ALA 37 Cb 1.08 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.87 1bse h ALA 37 CO 0.39 -0.41 -0.29 0.77 0.00 0.00 0.00 179.25 179.71 1bse h SER 38 N 0.52 0.00 -0.18 0.00 0.02 -2.03 -2.97 113.55 108.90 1bse h SER 38 Ca 0.61 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.56 1bse h SER 38 Cb 1.31 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.85 1bse h SER 38 CO -0.37 0.29 0.00 0.29 -1.14 0.00 0.00 176.83 175.90 1bse n LYS 39 N -4.05 2.40 -4.13 3.45 5.02 -0.76 -5.00 118.16 115.09 1bse n LYS 39 Ca -0.02 -2.06 -0.32 0.00 -2.02 0.00 0.00 58.31 53.89 1bse n LYS 39 Cb 0.35 -1.48 -0.03 0.00 -0.02 0.00 0.00 35.03 33.85 1bse n LYS 39 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1bse n GLY 40 N 1.42 -0.35 1.61 0.72 0.00 -1.12 -4.88 105.19 102.58 1bse n GLY 40 Ca 0.16 0.14 0.08 0.00 0.00 0.00 0.00 46.02 46.41 1bse n GLY 40 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1bse n ASN 41 N -2.79 5.14 -0.17 1.61 6.94 -1.26 -3.84 115.26 120.89 1bse n ASN 41 Ca -0.09 -2.84 -0.02 0.00 -0.02 0.00 0.00 54.58 51.61 1bse n ASN 41 Cb 0.57 -0.63 0.04 0.00 -2.36 0.00 0.00 39.78 37.41 1bse n ASN 41 CO 0.00 0.00 0.00 0.25 -1.03 0.00 0.00 177.26 176.48 1bse h LEU 42 N 3.53 -0.44 -1.97 -4.53 5.85 -1.88 0.76 115.31 116.64 1bse h LEU 42 Ca 0.00 0.15 -0.02 0.00 0.84 0.00 0.00 57.88 58.85 1bse h LEU 42 Cb 1.75 0.30 -0.00 0.00 0.37 0.00 0.00 40.66 43.08 1bse h LEU 42 CO 0.38 -0.16 -0.10 0.00 -0.34 0.00 0.00 178.44 178.22 1bse h ALA 43 N 1.51 1.53 0.12 1.25 0.00 -1.83 0.53 119.26 122.36 1bse h ALA 43 Ca 0.25 -0.09 -0.28 0.00 0.00 0.00 0.00 54.91 54.79 1bse h ALA 43 Cb 0.39 -0.02 0.02 0.00 0.00 0.00 0.00 17.79 18.18 1bse h ALA 43 CO -0.52 0.13 -1.22 -0.44 0.00 0.00 0.00 179.25 177.20 1bse h ASP 44 N 0.00 0.64 0.37 0.00 3.32 -1.21 -3.24 116.42 116.30 1bse h ASP 44 Ca -0.00 -0.62 0.00 0.00 0.02 0.00 0.00 57.03 56.43 1bse h ASP 44 Cb 0.22 -0.20 0.00 0.00 0.22 0.00 0.00 39.33 39.57 1bse h ASP 44 CO 0.01 1.45 -1.32 1.33 -1.72 0.00 0.00 179.24 179.00 1bse n VAL 45 N -3.68 0.19 -3.17 -1.35 0.24 -0.86 -4.56 118.33 105.14 1bse n VAL 45 Ca -0.11 -0.36 -0.22 0.00 -2.04 0.00 0.00 64.34 61.61 1bse n VAL 45 Cb 0.99 0.11 -0.06 0.00 -1.47 0.00 0.00 33.84 33.41 1bse n VAL 45 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1bse n ALA 46 N -2.00 2.22 -1.64 2.33 0.00 0.12 -4.93 120.51 116.61 1bse n ALA 46 Ca -0.00 -3.33 -0.47 0.00 0.00 0.00 0.00 53.44 49.64 1bse n ALA 46 Cb 0.49 -0.85 -0.04 0.00 0.00 0.00 0.00 19.45 19.05 1bse n ALA 46 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 1bse n PRO 47 N 1.19 1.75 -1.04 0.00 -0.02 -1.22 -2.49 135.00 133.16 1bse n PRO 47 Ca 0.21 0.62 -0.01 0.00 -2.02 0.00 0.00 63.50 62.30 1bse n PRO 47 Cb 0.56 -2.26 -0.01 0.00 -0.02 0.00 0.00 33.50 31.77 1bse n PRO 47 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1bse n GLY 48 N 2.41 0.27 3.83 -1.23 0.00 -1.26 -5.01 105.19 104.20 1bse n GLY 48 Ca 0.14 -0.03 -0.30 0.00 0.00 0.00 0.00 46.02 45.83 1bse n GLY 48 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1bse s LYS 49 N -1.60 3.07 0.12 1.61 -0.14 -1.04 -4.80 119.74 116.96 1bse s LYS 49 Ca 0.00 -0.63 0.07 0.00 -1.36 0.00 0.00 55.97 54.04 1bse s LYS 49 Cb 0.00 -2.82 -0.04 0.00 -1.68 0.00 0.00 37.83 33.29 1bse s LYS 49 CO 0.00 0.57 -0.16 -1.12 -0.76 0.00 0.00 175.35 173.88 1bse s SER 50 N -2.54 2.17 0.19 2.83 0.01 -0.19 -4.82 113.70 111.33 1bse s SER 50 Ca 0.31 -0.78 -0.26 0.00 1.31 0.00 0.00 55.95 56.54 1bse s SER 50 Cb -0.12 -0.09 -0.08 0.00 0.21 0.00 0.00 66.02 65.93 1bse s SER 50 CO 0.24 -0.08 0.81 -0.63 0.41 0.00 0.00 173.24 173.99 1bse s ILE 51 N -1.86 4.31 -0.28 1.44 -1.09 -1.26 -1.33 121.20 121.13 1bse s ILE 51 Ca 0.08 1.77 -0.30 0.00 -2.23 0.00 0.00 60.65 59.98 1bse s ILE 51 Cb -0.06 -4.17 0.19 0.00 -1.58 0.00 0.00 42.46 36.83 1bse s ILE 51 CO 0.04 0.50 1.33 -0.83 -1.23 0.00 0.00 174.94 174.75 1bse s GLY 52 N -1.18 0.04 0.00 6.18 0.00 -0.28 -1.35 107.32 110.72 1bse s GLY 52 Ca 0.37 2.71 0.00 0.00 0.00 0.00 0.00 44.72 47.80 1bse s GLY 52 CO 0.27 1.07 0.00 0.61 0.00 0.00 0.00 173.10 175.05 1bse n GLY 53 N 0.50 0.49 3.78 0.20 0.00 -0.22 -3.61 105.19 106.34 1bse n GLY 53 Ca -0.00 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.65 1bse n GLY 53 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1bse s ASP 54 N -2.02 6.98 0.22 1.61 1.01 -1.24 -4.84 116.67 118.39 1bse s ASP 54 Ca 0.00 1.95 -0.30 0.00 0.71 0.00 0.00 52.55 54.91 1bse s ASP 54 Cb 0.00 -2.58 -0.09 0.00 1.01 0.00 0.00 42.92 41.26 1bse s ASP 54 CO 0.00 -0.33 1.17 -0.63 0.21 0.00 0.00 175.17 175.59 1bse s ILE 55 N -1.67 3.50 -0.26 0.77 -1.09 -1.26 -1.47 121.20 119.72 1bse s ILE 55 Ca 0.55 1.34 -0.09 0.00 -2.23 0.00 0.00 60.65 60.22 1bse s ILE 55 Cb -0.20 -3.86 -0.04 0.00 -1.58 0.00 0.00 42.46 36.78 1bse s ILE 55 CO 0.25 0.25 0.13 0.12 -1.23 0.00 0.00 174.94 174.47 1bse s PHE 56 N -0.46 3.18 0.22 3.97 5.36 0.07 -4.82 117.98 125.49 1bse s PHE 56 Ca 0.50 -0.08 0.05 0.00 -0.96 0.00 0.00 56.93 56.43 1bse s PHE 56 Cb -0.33 -2.30 0.20 0.00 -0.34 0.00 0.00 43.02 40.25 1bse s PHE 56 CO 0.39 -0.19 1.52 0.66 -1.46 0.00 0.00 175.22 176.14 1bse h SER 57 N 8.13 0.23 -0.22 6.13 4.64 -1.95 -3.37 113.55 127.14 1bse h SER 57 Ca -0.37 -0.15 -0.06 0.00 -0.47 0.00 0.00 61.79 60.75 1bse h SER 57 Cb 1.18 -0.07 -0.02 0.00 -0.31 0.00 0.00 62.40 63.19 1bse h SER 57 CO 0.58 0.84 -0.06 -3.20 -0.87 0.00 0.00 176.83 174.12 1bse n ASN 58 N -3.81 -2.74 0.21 4.97 5.15 -1.26 -4.92 115.26 112.86 1bse n ASN 58 Ca -0.02 0.04 0.15 0.00 -0.60 0.00 0.00 54.58 54.15 1bse n ASN 58 Cb 0.66 -1.07 0.66 0.00 -0.53 0.00 0.00 39.78 39.50 1bse n ASN 58 CO 0.00 0.00 0.00 0.03 1.40 0.00 0.00 177.26 178.69 1bse h ARG 59 N 0.00 0.00 -0.86 1.20 -0.00 -1.99 -1.92 114.38 110.80 1bse h ARG 59 Ca -0.06 0.00 -0.09 0.00 -0.50 0.00 0.00 59.98 59.33 1bse h ARG 59 Cb 0.48 0.00 -0.05 0.00 0.00 0.00 0.00 29.97 30.40 1bse h ARG 59 CO 0.08 0.00 0.11 -0.85 0.00 0.00 0.00 179.97 179.31 1bse n GLU 60 N -2.59 2.48 -0.15 0.04 0.00 -1.26 -4.89 120.64 114.27 1bse n GLU 60 Ca 0.00 -1.52 0.00 0.00 0.00 0.00 0.00 57.16 55.64 1bse n GLU 60 Cb 0.19 -1.78 0.00 0.00 0.00 0.00 0.00 31.44 29.86 1bse n GLU 60 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1bse n GLY 61 N 0.10 0.00 0.30 -1.84 0.00 -0.72 -4.82 105.19 98.21 1bse n GLY 61 Ca 0.19 0.00 0.16 0.00 0.00 0.00 0.00 46.02 46.37 1bse n GLY 61 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1bse h LYS 62 N 0.00 0.00 -5.81 1.61 1.57 -1.90 -3.42 116.57 108.61 1bse h LYS 62 Ca 0.00 0.00 -0.63 0.00 -1.87 0.00 0.00 60.65 58.15 1bse h LYS 62 Cb 0.09 0.00 -0.07 0.00 0.08 0.00 0.00 32.23 32.34 1bse h LYS 62 CO 0.00 0.00 -0.32 -0.51 -0.57 0.00 0.00 179.45 178.05 1bse s LEU 63 N -7.56 4.42 -0.23 2.94 1.43 -1.26 -5.01 118.68 113.41 1bse s LEU 63 Ca -0.05 0.73 -0.35 0.00 -1.03 0.00 0.00 54.13 53.43 1bse s LEU 63 Cb 0.15 -2.37 -0.11 0.00 0.03 0.00 0.00 46.19 43.89 1bse s LEU 63 CO 0.54 0.33 2.02 -0.81 0.23 0.00 0.00 176.35 178.66 1bse n PRO 64 N 2.08 1.59 -1.91 1.29 -0.04 -1.26 -4.96 135.00 131.79 1bse n PRO 64 Ca -0.16 0.52 -0.30 0.00 -0.04 0.00 0.00 63.50 63.52 1bse n PRO 64 Cb 0.53 -2.56 0.03 0.00 -0.04 0.00 0.00 33.50 31.46 1bse n PRO 64 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 1bse s GLY 65 N 5.74 1.64 0.00 0.55 0.00 -1.26 -5.06 107.32 108.92 1bse s GLY 65 Ca 1.01 -0.26 0.00 0.00 0.00 0.00 0.00 44.72 45.47 1bse s GLY 65 CO 0.51 0.07 0.00 1.17 0.00 0.00 0.00 173.10 174.85 1bse n LYS 66 N -2.88 0.00 -3.27 2.90 3.00 -1.26 -5.06 118.16 111.59 1bse n LYS 66 Ca 0.06 0.00 -0.39 0.00 -0.00 0.00 0.00 58.31 57.99 1bse n LYS 66 Cb 0.56 0.00 -0.06 0.00 0.00 0.00 0.00 35.03 35.53 1bse n LYS 66 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.40 176.28 1bse s SER 67 N 0.00 6.91 0.00 3.14 0.01 -1.26 -2.62 113.70 119.87 1bse s SER 67 Ca 0.00 1.08 0.00 0.00 1.31 0.00 0.00 55.95 58.34 1bse s SER 67 Cb 0.00 -2.34 0.00 0.00 0.21 0.00 0.00 66.02 63.89 1bse s SER 67 CO 0.00 0.13 0.00 0.61 0.41 0.00 0.00 173.24 174.39 1bse n GLY 68 N 2.46 2.79 3.82 3.44 0.00 -1.26 -5.03 105.19 111.40 1bse n GLY 68 Ca -0.08 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.57 1bse n GLY 68 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1bse s ARG 69 N -0.95 3.88 -0.11 1.61 3.52 -1.08 -4.87 118.95 120.96 1bse s ARG 69 Ca 0.00 0.20 0.02 0.00 -0.13 0.00 0.00 55.73 55.82 1bse s ARG 69 Cb 0.00 -3.26 0.01 0.00 -1.56 0.00 0.00 34.95 30.14 1bse s ARG 69 CO 0.00 0.60 -0.15 0.99 -0.81 0.00 0.00 175.30 175.92 1bse s THR 70 N -0.67 1.51 0.01 4.11 2.01 -1.26 -4.79 115.64 116.55 1bse s THR 70 Ca 0.20 -0.65 -0.16 0.00 0.31 0.00 0.00 61.69 61.39 1bse s THR 70 Cb -0.15 -1.38 -0.06 0.00 0.01 0.00 0.00 72.50 70.93 1bse s THR 70 CO 0.09 0.44 0.44 0.26 -0.69 0.00 0.00 174.62 175.16 1bse s TRP 71 N 0.98 3.74 0.05 4.92 0.52 -1.26 -2.54 118.94 125.34 1bse s TRP 71 Ca -0.07 1.04 0.06 0.00 0.02 0.00 0.00 56.10 57.15 1bse s TRP 71 Cb -0.15 -2.33 -0.02 0.00 -1.15 0.00 0.00 33.47 29.82 1bse s TRP 71 CO -0.01 0.63 -0.17 1.03 0.02 0.00 0.00 176.95 178.44 1bse s ARG 72 N -1.05 1.11 0.24 4.98 0.52 0.12 -0.75 118.95 124.13 1bse s ARG 72 Ca 0.25 -0.86 0.10 0.00 -0.52 0.00 0.00 55.73 54.70 1bse s ARG 72 Cb -0.17 -1.18 -0.04 0.00 0.52 0.00 0.00 34.95 34.07 1bse s ARG 72 CO 0.14 0.29 -0.09 -1.83 0.02 0.00 0.00 175.30 173.84 1bse s GLU 73 N -1.22 2.05 -0.07 3.54 -1.05 -0.54 0.54 118.70 121.95 1bse s GLU 73 Ca 0.04 -1.46 -0.09 0.00 -0.15 0.00 0.00 54.97 53.31 1bse s GLU 73 Cb -0.08 -2.05 0.02 0.00 -0.44 0.00 0.00 34.13 31.57 1bse s GLU 73 CO 0.02 0.38 0.23 0.00 0.95 0.00 0.00 175.26 176.83 1bse s ALA 74 N -2.17 -0.57 0.28 -0.84 0.00 -0.72 -1.06 121.76 116.70 1bse s ALA 74 Ca 0.29 0.51 -0.29 0.00 0.00 0.00 0.00 51.96 52.47 1bse s ALA 74 Cb -0.07 -0.27 -0.09 0.00 0.00 0.00 0.00 23.12 22.69 1bse s ALA 74 CO 0.17 -0.14 1.06 -0.51 0.00 0.00 0.00 175.76 176.34 1bse s ASP 75 N -0.25 7.30 0.05 0.00 1.11 -0.46 -1.02 116.67 123.39 1bse s ASP 75 Ca -0.04 2.17 0.09 0.00 0.18 0.00 0.00 52.55 54.96 1bse s ASP 75 Cb -0.03 -2.62 -0.03 0.00 1.07 0.00 0.00 42.92 41.31 1bse s ASP 75 CO 0.01 -0.11 -0.24 -0.63 1.18 0.00 0.00 175.17 175.38 1bse s ILE 76 N -1.22 2.31 -1.73 0.77 -1.09 -0.56 -4.70 121.20 114.98 1bse s ILE 76 Ca 0.45 -1.35 0.00 0.00 -2.23 0.00 0.00 60.65 57.52 1bse s ILE 76 Cb -0.30 -1.92 0.00 0.00 -1.58 0.00 0.00 42.46 38.66 1bse s ILE 76 CO 0.38 0.35 0.00 0.59 -1.23 0.00 0.00 174.94 175.03 1bse n ASN 77 N 1.69 -5.06 -4.84 3.58 3.02 0.93 -4.62 115.26 109.97 1bse n ASN 77 Ca -0.17 0.32 -0.37 0.00 -0.03 0.00 0.00 54.58 54.33 1bse n ASN 77 Cb 0.52 -4.09 -0.06 0.00 -0.61 0.00 0.00 39.78 35.54 1bse n ASN 77 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 1bse s TYR 78 N -2.69 3.70 0.00 3.10 5.04 -1.26 -4.91 117.35 120.32 1bse s TYR 78 Ca 0.00 1.06 0.00 0.00 -2.44 0.00 0.00 57.07 55.69 1bse s TYR 78 Cb 0.00 -2.35 0.00 0.00 0.35 0.00 0.00 41.96 39.96 1bse s TYR 78 CO 0.00 0.55 0.00 0.25 -1.34 0.00 0.00 175.55 175.01 1bse n THR 79 N 1.37 0.00 -3.69 4.34 -2.24 -1.26 -4.94 114.28 107.86 1bse n THR 79 Ca -0.10 0.00 -0.02 0.00 -2.27 0.00 0.00 64.05 61.66 1bse n THR 79 Cb 0.52 -0.64 -0.01 0.00 -2.10 0.00 0.00 70.33 68.10 1bse n THR 79 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1bse s SER 80 N -4.27 -0.14 0.00 3.42 1.04 -1.26 -4.80 113.70 107.69 1bse s SER 80 Ca 0.00 -0.28 0.00 0.00 0.48 0.00 0.00 55.95 56.15 1bse s SER 80 Cb 0.00 0.36 0.00 0.00 0.10 0.00 0.00 66.02 66.48 1bse s SER 80 CO 0.00 -0.65 0.00 0.61 0.98 0.00 0.00 173.24 174.18 1bse n GLY 81 N -0.46 -1.65 3.78 7.32 0.00 -1.25 -4.90 105.19 108.03 1bse n GLY 81 Ca -0.07 -1.55 -0.35 0.00 0.00 0.00 0.00 46.02 44.05 1bse n GLY 81 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1bse s PHE 82 N 0.00 2.69 0.52 1.61 0.08 -1.26 -4.51 117.98 117.11 1bse s PHE 82 Ca 0.00 1.55 -0.22 0.00 0.12 0.00 0.00 56.93 58.38 1bse s PHE 82 Cb 0.00 -3.27 -0.06 0.00 -0.57 0.00 0.00 43.02 39.12 1bse s PHE 82 CO 0.00 -1.54 1.29 1.03 -0.10 0.00 0.00 175.22 175.90 1bse s ARG 83 N -3.33 3.34 0.00 0.44 0.52 -1.26 -5.02 118.95 113.64 1bse s ARG 83 Ca 0.72 2.06 0.00 0.00 -0.52 0.00 0.00 55.73 58.00 1bse s ARG 83 Cb -0.23 -2.29 0.00 0.00 0.52 0.00 0.00 34.95 32.94 1bse s ARG 83 CO 0.27 -0.98 0.00 0.27 0.02 0.00 0.00 175.30 174.88 1bse n ASN 84 N -0.87 0.00 -0.93 0.23 0.23 -1.26 -5.03 115.26 107.62 1bse n ASN 84 Ca 0.09 -0.82 0.09 0.00 -0.53 0.00 0.00 54.58 53.42 1bse n ASN 84 Cb 0.46 0.00 0.18 0.00 -2.08 0.00 0.00 39.78 38.34 1bse n ASN 84 CO 0.00 0.00 0.00 -1.54 -0.93 0.00 0.00 177.26 174.79 1bse n SER 85 N -2.46 3.11 -4.66 0.53 3.41 -1.26 -4.97 113.62 107.32 1bse n SER 85 Ca 0.00 -1.90 -0.40 0.00 -0.26 0.00 0.00 58.87 56.31 1bse n SER 85 Cb 0.00 -0.21 -0.06 0.00 -0.26 0.00 0.00 64.21 63.67 1bse n SER 85 CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 1bse s ASP 86 N -1.26 6.63 0.05 4.04 1.01 -1.26 -1.93 116.67 123.96 1bse s ASP 86 Ca 0.31 0.77 0.02 0.00 0.71 0.00 0.00 52.55 54.36 1bse s ASP 86 Cb 0.18 -2.32 -0.03 0.00 1.01 0.00 0.00 42.92 41.76 1bse s ASP 86 CO 0.25 -0.23 -0.07 -0.13 0.21 0.00 0.00 175.17 175.21 1bse s ARG 87 N 1.78 0.58 -0.12 8.23 1.81 -0.27 -1.50 118.95 129.46 1bse s ARG 87 Ca 0.27 -0.91 -0.02 0.00 -1.72 0.00 0.00 55.73 53.34 1bse s ARG 87 Cb -0.16 -0.18 -0.03 0.00 -0.45 0.00 0.00 34.95 34.13 1bse s ARG 87 CO 0.10 0.01 -0.05 -1.50 -0.68 0.00 0.00 175.30 173.18 1bse s ILE 88 N -2.12 3.79 -0.16 1.52 2.07 -0.19 -2.24 121.20 123.86 1bse s ILE 88 Ca -0.04 -0.42 0.01 0.00 -1.41 0.00 0.00 60.65 58.79 1bse s ILE 88 Cb -0.05 -2.61 0.01 0.00 0.13 0.00 0.00 42.46 39.94 1bse s ILE 88 CO -0.02 0.54 -0.19 -0.69 -1.91 0.00 0.00 174.94 172.67 1bse s VAL 89 N -0.12 2.22 0.12 4.00 1.01 0.53 -1.75 120.40 126.41 1bse s VAL 89 Ca 0.02 -0.91 0.09 0.00 0.00 0.00 0.00 61.98 61.18 1bse s VAL 89 Cb -0.13 -1.92 -0.04 0.00 0.00 0.00 0.00 36.38 34.29 1bse s VAL 89 CO 0.03 0.53 -0.21 -0.72 0.00 0.00 0.00 175.10 174.73 1bse s TYR 90 N 1.04 1.90 0.49 5.22 1.13 0.19 -1.46 117.35 125.86 1bse s TYR 90 Ca -0.01 -0.42 0.07 0.00 -1.41 0.00 0.00 57.07 55.29 1bse s TYR 90 Cb -0.14 -1.01 0.01 0.00 -1.10 0.00 0.00 41.96 39.71 1bse s TYR 90 CO -0.06 0.27 0.38 -1.54 -2.51 0.00 0.00 175.55 172.09 1bse s SER 91 N -2.13 4.75 0.34 -0.18 1.04 -0.25 0.14 113.70 117.42 1bse s SER 91 Ca 0.10 -1.05 0.04 0.00 0.48 0.00 0.00 55.95 55.52 1bse s SER 91 Cb -0.09 -0.02 0.63 0.00 0.10 0.00 0.00 66.02 66.64 1bse s SER 91 CO 0.05 -0.90 1.92 0.28 0.98 0.00 0.00 173.24 175.57 1bse h SER 92 N 0.90 0.56 -0.90 7.02 0.02 -1.83 -2.42 113.55 116.90 1bse h SER 92 Ca -0.39 -0.07 -0.48 0.00 -0.84 0.00 0.00 61.79 60.01 1bse h SER 92 Cb 1.28 -0.14 -0.28 0.00 0.14 0.00 0.00 62.40 63.40 1bse h SER 92 CO 0.58 0.54 0.62 -0.90 -1.14 0.00 0.00 176.83 176.53 1bse n ASP 93 N -4.34 4.12 -2.60 3.07 5.75 -1.26 -4.93 116.55 116.37 1bse n ASP 93 Ca 0.03 -3.47 -0.20 0.00 -0.01 0.00 0.00 54.79 51.14 1bse n ASP 93 Cb 0.18 -0.83 0.00 0.00 -1.03 0.00 0.00 41.12 39.44 1bse n ASP 93 CO 0.00 0.00 0.00 0.79 -0.11 0.00 0.00 177.20 177.88 1bse n TRP 94 N -0.94 -1.33 -2.93 2.11 7.02 -0.91 -5.00 117.44 115.45 1bse n TRP 94 Ca 0.54 0.15 -0.37 0.00 -1.02 0.00 0.00 57.50 56.81 1bse n TRP 94 Cb 1.45 -3.92 -0.06 0.00 -2.42 0.00 0.00 31.31 26.35 1bse n TRP 94 CO 0.00 0.00 0.00 -0.51 -2.02 0.00 0.00 177.69 175.16 1bse s LEU 95 N -6.17 4.35 -0.11 -0.99 1.43 -1.26 -4.84 118.68 111.09 1bse s LEU 95 Ca 0.09 1.64 0.01 0.00 -1.03 0.00 0.00 54.13 54.84 1bse s LEU 95 Cb -0.04 -3.80 0.02 0.00 0.03 0.00 0.00 46.19 42.40 1bse s LEU 95 CO 0.11 -0.01 -0.12 -0.63 0.23 0.00 0.00 176.35 175.93 1bse s ILE 96 N -1.56 1.28 0.26 -0.59 1.01 -0.79 -1.09 121.20 119.72 1bse s ILE 96 Ca 0.46 -0.49 0.11 0.00 0.00 0.00 0.00 60.65 60.73 1bse s ILE 96 Cb -0.18 -1.21 -0.05 0.00 0.01 0.00 0.00 42.46 41.04 1bse s ILE 96 CO 0.23 0.40 -0.18 -0.31 0.00 0.00 0.00 174.94 175.08 1bse s TYR 97 N 1.20 2.13 0.12 3.97 1.51 -0.53 0.72 117.35 126.47 1bse s TYR 97 Ca -0.03 -0.41 0.03 0.00 -1.01 0.00 0.00 57.07 55.65 1bse s TYR 97 Cb -0.14 -0.96 -0.04 0.00 -0.11 0.00 0.00 41.96 40.70 1bse s TYR 97 CO -0.04 0.61 -0.08 -1.59 -1.11 0.00 0.00 175.55 173.34 1bse s LYS 98 N -3.56 0.95 -0.05 -0.62 -2.85 0.70 -0.35 119.74 113.97 1bse s LYS 98 Ca 0.28 -1.39 -0.03 0.00 -1.00 0.00 0.00 55.97 53.83 1bse s LYS 98 Cb -0.03 -0.42 0.03 0.00 -2.06 0.00 0.00 37.83 35.34 1bse s LYS 98 CO 0.13 0.03 0.11 -0.08 0.10 0.00 0.00 175.35 175.64 1bse s THR 99 N -3.45 -0.03 -0.10 3.79 -1.32 -0.95 -1.77 115.64 111.81 1bse s THR 99 Ca 0.14 0.13 0.14 0.00 -1.21 0.00 0.00 61.69 60.89 1bse s THR 99 Cb 0.04 -0.19 0.21 0.00 -1.51 0.00 0.00 72.50 71.06 1bse s THR 99 CO -0.02 0.05 1.11 0.35 -2.21 0.00 0.00 174.62 173.90 1bse n THR 100 N 3.81 1.66 -2.57 5.08 -2.24 -1.26 -1.11 114.28 117.64 1bse n THR 100 Ca -0.22 -1.94 -0.03 0.00 -2.27 0.00 0.00 64.05 59.59 1bse n THR 100 Cb 0.54 -0.05 0.05 0.00 -2.10 0.00 0.00 70.33 68.77 1bse n THR 100 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 1bse n ASP 101 N -1.19 2.05 -3.29 3.42 5.68 -1.16 -4.58 116.55 117.47 1bse n ASP 101 Ca 0.12 -2.41 -0.16 0.00 -0.50 0.00 0.00 54.79 51.84 1bse n ASP 101 Cb 0.54 -0.43 0.08 0.00 -1.14 0.00 0.00 41.12 40.18 1bse n ASP 101 CO 0.00 0.00 0.00 1.41 -1.33 0.00 0.00 177.20 177.28 1bse n HIS 102 N -0.45 -2.12 -1.52 2.11 8.25 -0.81 -3.27 115.22 117.41 1bse n HIS 102 Ca 0.14 0.88 -0.17 0.00 -0.26 0.00 0.00 57.72 58.31 1bse n HIS 102 Cb 0.89 -4.82 -0.07 0.00 1.12 0.00 0.00 29.99 27.11 1bse n HIS 102 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 1bse n TYR 103 N -3.87 -0.24 0.07 4.41 4.02 -1.26 -4.87 117.16 115.42 1bse n TYR 103 Ca -0.25 0.00 -0.13 0.00 -0.01 0.00 0.00 57.90 57.52 1bse n TYR 103 Cb 0.66 -3.01 -0.09 0.00 -0.02 0.00 0.00 39.34 36.88 1bse n TYR 103 CO 0.00 0.00 0.00 1.96 -1.01 0.00 0.00 176.86 177.81 1bse h GLN 104 N 0.00 -0.20 -6.37 -0.72 4.20 -1.97 -3.46 115.11 106.59 1bse h GLN 104 Ca -0.34 0.01 -0.65 0.00 0.06 0.00 0.00 58.65 57.73 1bse h GLN 104 Cb 1.10 0.04 -0.28 0.00 0.30 0.00 0.00 27.48 28.64 1bse h GLN 104 CO 0.50 0.20 -0.87 0.99 -0.67 0.00 0.00 178.83 178.98 1bse s THR 105 N -4.27 1.88 0.00 -0.54 2.01 -1.26 -5.07 115.64 108.39 1bse s THR 105 Ca -0.14 -1.14 0.03 0.00 0.31 0.00 0.00 61.69 60.75 1bse s THR 105 Cb 0.02 -1.59 -0.01 0.00 0.01 0.00 0.00 72.50 70.93 1bse s THR 105 CO 0.58 0.42 -0.09 -0.36 -0.69 0.00 0.00 174.62 174.48 1bse s PHE 106 N -0.66 0.79 0.00 4.92 0.08 -1.26 -4.36 117.98 117.49 1bse s PHE 106 Ca 0.09 -0.20 0.05 0.00 0.12 0.00 0.00 56.93 57.00 1bse s PHE 106 Cb -0.09 -0.49 -0.02 0.00 -0.57 0.00 0.00 43.02 41.85 1bse s PHE 106 CO 0.00 -0.01 -0.17 0.99 -0.10 0.00 0.00 175.22 175.93 1bse s THR 107 N -0.39 1.35 0.16 0.64 2.01 -0.73 -4.94 115.64 113.73 1bse s THR 107 Ca 0.02 -0.82 -0.31 0.00 0.31 0.00 0.00 61.69 60.89 1bse s THR 107 Cb -0.04 -1.14 -0.08 0.00 0.01 0.00 0.00 72.50 71.24 1bse s THR 107 CO -0.00 0.30 1.32 -0.75 -0.69 0.00 0.00 174.62 174.81 1bse s LYS 108 N -0.60 4.37 0.00 4.92 2.20 -1.26 -0.21 119.74 129.16 1bse s LYS 108 Ca 0.06 2.03 0.00 0.00 -0.36 0.00 0.00 55.97 57.70 1bse s LYS 108 Cb -0.07 -3.23 0.00 0.00 -1.51 0.00 0.00 37.83 33.02 1bse s LYS 108 CO -0.00 -0.31 0.00 0.44 -0.36 0.00 0.00 175.35 175.12 1bse n ILE 109 N 3.20 0.00 -0.85 5.43 -5.35 0.22 -4.90 119.36 117.12 1bse n ILE 109 Ca 0.08 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.56 1bse n ILE 109 Cb 0.43 -0.25 0.00 0.00 -1.74 0.00 0.00 39.64 38.08 1bse n ILE 109 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33