#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bns s ILE 4 N 0.00 4.33 0.00 1.34 1.01 -1.26 -4.86 121.20 121.76 1bns s ILE 4 Ca 0.00 -1.05 0.00 0.00 0.00 0.00 0.00 60.65 59.61 1bns s ILE 4 Cb 0.00 -3.48 0.01 0.00 0.01 0.00 0.00 42.46 38.99 1bns s ILE 4 CO 0.00 -0.29 0.90 -0.46 0.00 0.00 0.00 174.94 175.09 1bns n ASN 5 N 4.94 0.01 -4.89 3.58 6.94 -1.26 -4.83 115.26 119.75 1bns n ASN 5 Ca -0.12 -1.79 -0.25 0.00 -0.02 0.00 0.00 54.58 52.40 1bns n ASN 5 Cb 0.45 -0.16 -0.04 0.00 -2.36 0.00 0.00 39.78 37.67 1bns n ASN 5 CO 0.00 0.00 0.00 0.42 -1.03 0.00 0.00 177.26 176.65 1bns s THR 6 N 0.00 4.99 0.14 5.53 -4.23 -1.26 -0.29 115.64 120.53 1bns s THR 6 Ca 0.01 -0.91 -0.29 0.00 -1.18 0.00 0.00 61.69 59.31 1bns s THR 6 Cb 0.01 -3.60 -0.05 0.00 1.34 0.00 0.00 72.50 70.20 1bns s THR 6 CO -0.00 -0.15 1.57 -0.26 -0.54 0.00 0.00 174.62 175.23 1bns h PHE 7 N 2.02 -1.40 -0.52 3.99 -1.00 -1.98 0.25 116.94 118.30 1bns h PHE 7 Ca -0.49 0.07 -0.05 0.00 2.81 0.00 0.00 57.97 60.31 1bns h PHE 7 Cb 1.21 0.66 -0.02 0.00 3.61 0.00 0.00 35.95 41.40 1bns h PHE 7 CO 0.54 -0.47 0.14 -0.44 -1.61 0.00 0.00 178.31 176.46 1bns h ASP 8 N -0.39 0.78 -0.10 2.17 3.32 -1.98 -1.46 116.42 118.76 1bns h ASP 8 Ca 0.10 -0.22 0.03 0.00 0.02 0.00 0.00 57.03 56.96 1bns h ASP 8 Cb 0.61 -0.20 -0.04 0.00 0.22 0.00 0.00 39.33 39.91 1bns h ASP 8 CO -0.55 0.80 -0.11 1.23 -1.72 0.00 0.00 179.24 178.89 1bns h GLY 9 N 0.72 -0.04 1.28 2.75 0.00 -1.83 0.80 103.07 106.75 1bns h GLY 9 Ca 0.16 0.14 -0.16 0.00 0.00 0.00 0.00 47.33 47.47 1bns h GLY 9 CO -0.00 -0.12 -0.48 -2.08 0.00 0.00 0.00 176.54 173.86 1bns h VAL 10 N -0.14 1.29 0.17 4.60 2.07 -0.54 -0.98 116.25 122.72 1bns h VAL 10 Ca 0.08 -1.68 0.01 0.00 0.82 0.00 0.00 66.70 65.93 1bns h VAL 10 Cb 0.25 1.58 -0.02 0.00 -1.52 0.00 0.00 31.29 31.59 1bns h VAL 10 CO -0.19 0.54 -0.19 0.00 0.02 0.00 0.00 177.57 177.75 1bns h ALA 11 N 0.85 -0.37 -0.38 1.67 0.00 -0.73 0.22 119.26 120.52 1bns h ALA 11 Ca 0.03 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 1bns h ALA 11 Cb 1.05 0.28 -0.02 0.00 0.00 0.00 0.00 17.79 19.10 1bns h ALA 11 CO 0.10 -0.73 0.16 -0.44 0.00 0.00 0.00 179.25 178.34 1bns h ASP 12 N -0.40 0.47 -0.30 0.00 3.32 0.75 -2.57 116.42 117.69 1bns h ASP 12 Ca 0.01 -0.04 -0.08 0.00 0.02 0.00 0.00 57.03 56.93 1bns h ASP 12 Cb 0.38 -0.12 -0.01 0.00 0.22 0.00 0.00 39.33 39.81 1bns h ASP 12 CO -0.06 0.43 -0.14 0.22 -1.72 0.00 0.00 179.24 177.97 1bns h TYR 13 N 0.53 0.72 -0.02 4.55 3.20 -0.74 -2.63 116.97 122.58 1bns h TYR 13 Ca 0.13 -0.18 -0.02 0.00 3.14 0.00 0.00 58.73 61.81 1bns h TYR 13 Cb 0.09 -0.17 -0.00 0.00 1.54 0.00 0.00 36.73 38.19 1bns h TYR 13 CO 0.00 0.85 -0.06 -0.07 -1.64 0.00 0.00 178.16 177.25 1bns h LEU 14 N 0.38 0.03 0.07 2.82 3.38 -0.55 -1.88 115.31 119.56 1bns h LEU 14 Ca 0.07 -0.00 -0.28 0.00 0.09 0.00 0.00 57.88 57.76 1bns h LEU 14 Cb 0.66 -0.01 -0.02 0.00 0.09 0.00 0.00 40.66 41.39 1bns h LEU 14 CO 0.04 0.09 -1.43 1.56 0.09 0.00 0.00 178.44 178.80 1bns h GLN 15 N 0.03 0.15 0.00 1.13 4.20 -1.48 0.89 115.11 120.03 1bns h GLN 15 Ca 0.01 -0.25 0.00 0.00 0.06 0.00 0.00 58.65 58.46 1bns h GLN 15 Cb 0.12 0.09 0.00 0.00 0.30 0.00 0.00 27.48 28.00 1bns h GLN 15 CO 0.01 0.99 0.00 2.41 -0.67 0.00 0.00 178.83 181.56 1bns n THR 16 N -3.36 0.00 0.47 -0.54 -1.04 -0.92 -4.33 114.28 104.56 1bns n THR 16 Ca -0.12 1.21 0.13 0.00 -2.04 0.00 0.00 64.05 63.22 1bns n THR 16 Cb 1.02 -2.20 0.29 0.00 -1.82 0.00 0.00 70.33 67.62 1bns n THR 16 CO 0.00 0.00 0.00 1.88 -0.64 0.00 0.00 175.07 176.31 1bns h TYR 17 N 0.00 0.00 -1.26 -1.42 0.05 -1.53 -3.48 116.97 109.34 1bns h TYR 17 Ca 0.00 0.00 -0.26 0.00 0.05 0.00 0.00 58.73 58.52 1bns h TYR 17 Cb 0.00 0.00 -0.06 0.00 1.01 0.00 0.00 36.73 37.68 1bns h TYR 17 CO 0.16 0.00 -0.29 0.72 -1.05 0.00 0.00 178.16 177.70 1bns n HIS 18 N -2.51 -0.32 -3.61 4.88 8.25 0.31 -4.97 115.22 117.25 1bns n HIS 18 Ca 0.05 0.00 -0.11 0.00 -0.26 0.00 0.00 57.72 57.40 1bns n HIS 18 Cb 0.47 -2.60 -0.04 0.00 1.12 0.00 0.00 29.99 28.93 1bns n HIS 18 CO 0.00 0.00 0.00 -1.59 0.64 0.00 0.00 176.34 175.39 1bns s LYS 19 N -3.91 1.08 0.49 -0.41 -2.85 -1.25 -5.05 119.74 107.84 1bns s LYS 19 Ca 0.00 -0.64 -0.21 0.00 -1.00 0.00 0.00 55.97 54.12 1bns s LYS 19 Cb 0.00 0.48 -0.07 0.00 -2.06 0.00 0.00 37.83 36.18 1bns s LYS 19 CO 0.00 -0.43 1.13 -0.51 0.10 0.00 0.00 175.35 175.64 1bns s LEU 20 N -2.72 3.91 0.73 2.77 1.43 -1.26 -4.10 118.68 119.44 1bns s LEU 20 Ca 0.02 2.19 -0.14 0.00 -1.03 0.00 0.00 54.13 55.17 1bns s LEU 20 Cb 0.01 -4.40 0.04 0.00 0.03 0.00 0.00 46.19 41.87 1bns s LEU 20 CO -0.11 -0.97 1.15 -2.84 0.23 0.00 0.00 176.35 173.81 1bns s PRO 21 N -2.95 2.30 0.57 1.29 0.02 -1.26 -4.91 135.00 130.05 1bns s PRO 21 Ca 0.67 1.52 0.30 0.00 0.02 0.00 0.00 61.00 63.51 1bns s PRO 21 Cb -0.25 -1.88 1.46 0.00 0.02 0.00 0.00 34.50 33.85 1bns s PRO 21 CO 0.29 -1.66 1.87 -0.44 -0.33 0.00 0.00 177.00 176.73 1bns h ASP 22 N -0.43 0.00 0.29 2.53 3.45 -1.95 -2.13 116.42 118.17 1bns h ASP 22 Ca -0.46 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.00 1bns h ASP 22 Cb 1.27 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 40.04 1bns h ASP 22 CO 0.51 0.00 0.00 -0.46 -1.57 0.00 0.00 179.24 177.72 1bns n ASN 23 N -3.95 0.00 -4.91 6.45 6.94 -1.26 -4.79 115.26 113.74 1bns n ASN 23 Ca 0.14 0.13 -0.29 0.00 -0.02 0.00 0.00 54.58 54.54 1bns n ASN 23 Cb 0.85 -0.31 -0.04 0.00 -2.36 0.00 0.00 39.78 37.92 1bns n ASN 23 CO 0.00 0.00 0.00 -0.31 -1.03 0.00 0.00 177.26 175.92 1bns s TYR 24 N -2.62 3.48 -0.04 -2.53 1.51 -0.80 -1.36 117.35 114.99 1bns s TYR 24 Ca 0.12 0.46 -0.09 0.00 -1.01 0.00 0.00 57.07 56.55 1bns s TYR 24 Cb 0.09 -1.94 0.01 0.00 -0.11 0.00 0.00 41.96 40.02 1bns s TYR 24 CO 0.22 0.39 0.21 0.96 -1.11 0.00 0.00 175.55 176.22 1bns s ILE 25 N -1.79 0.05 0.52 2.71 -4.36 -0.61 -4.90 121.20 112.82 1bns s ILE 25 Ca 0.40 -0.38 -0.20 0.00 -0.26 0.00 0.00 60.65 60.20 1bns s ILE 25 Cb -0.11 -0.44 -0.06 0.00 1.25 0.00 0.00 42.46 43.10 1bns s ILE 25 CO 0.27 -0.21 1.16 0.00 0.24 0.00 0.00 174.94 176.40 1bns s ALA 26 N -0.80 2.76 0.52 2.27 0.00 -1.17 -0.71 121.76 124.63 1bns s ALA 26 Ca -0.09 0.90 0.19 0.00 0.00 0.00 0.00 51.96 52.96 1bns s ALA 26 Cb -0.05 -3.39 1.31 0.00 0.00 0.00 0.00 23.12 20.99 1bns s ALA 26 CO 0.02 -0.80 2.11 0.87 0.00 0.00 0.00 175.76 177.95 1bns h LYS 27 N 1.42 0.00 -0.44 0.00 1.57 -1.97 -1.74 116.57 115.42 1bns h LYS 27 Ca -0.50 0.00 -0.06 0.00 -1.87 0.00 0.00 60.65 58.22 1bns h LYS 27 Cb 1.26 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 33.56 1bns h LYS 27 CO 0.58 0.00 0.04 0.66 -0.57 0.00 0.00 179.45 180.15 1bns h SER 28 N 0.00 0.73 -0.16 0.86 4.64 -1.99 0.20 113.55 117.83 1bns h SER 28 Ca 0.07 -0.28 -0.02 0.00 -0.47 0.00 0.00 61.79 61.08 1bns h SER 28 Cb 0.28 -0.20 -0.01 0.00 -0.31 0.00 0.00 62.40 62.17 1bns h SER 28 CO -0.00 0.83 0.02 -0.33 -0.87 0.00 0.00 176.83 176.48 1bns h GLU 29 N 0.61 0.28 -0.52 4.77 5.08 -1.79 -1.48 114.58 121.53 1bns h GLU 29 Ca 0.13 -0.08 0.05 0.00 -1.00 0.00 0.00 59.36 58.46 1bns h GLU 29 Cb 0.44 -0.03 -0.05 0.00 0.50 0.00 0.00 28.75 29.61 1bns h GLU 29 CO 0.02 0.47 0.25 0.00 -1.00 0.00 0.00 179.01 178.75 1bns h ALA 30 N 0.80 0.67 -0.84 3.43 0.00 -1.27 -2.25 119.26 119.80 1bns h ALA 30 Ca 0.05 0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.98 1bns h ALA 30 Cb 0.34 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 18.04 1bns h ALA 30 CO 0.01 -0.11 0.50 1.96 0.00 0.00 0.00 179.25 181.60 1bns h GLN 31 N 0.48 1.14 -0.16 0.00 4.20 -0.65 -1.54 115.11 118.59 1bns h GLN 31 Ca 0.24 -0.11 0.05 0.00 0.06 0.00 0.00 58.65 58.88 1bns h GLN 31 Cb 0.17 -0.24 -0.01 0.00 0.30 0.00 0.00 27.48 27.71 1bns h GLN 31 CO -0.18 0.81 0.12 0.00 -0.67 0.00 0.00 178.83 178.91 1bns h ALA 32 N 1.27 2.07 -0.21 3.87 0.00 -0.72 -0.76 119.26 124.78 1bns h ALA 32 Ca 0.30 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.20 1bns h ALA 32 Cb -0.03 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.77 1bns h ALA 32 CO -0.05 -0.20 0.00 1.28 0.00 0.00 0.00 179.25 180.28 1bns n LEU 33 N -4.36 1.69 0.00 0.00 4.77 -0.66 -4.91 117.00 113.53 1bns n LEU 33 Ca 0.01 -0.74 0.00 0.00 -0.03 0.00 0.00 56.01 55.24 1bns n LEU 33 Cb 0.25 -0.13 0.00 0.00 -2.33 0.00 0.00 43.42 41.20 1bns n LEU 33 CO 0.33 0.37 0.00 0.61 -1.33 0.00 0.00 177.39 177.38 1bns n GLY 34 N 1.11 0.79 3.72 -0.72 0.00 -0.29 -4.84 105.19 104.95 1bns n GLY 34 Ca 0.15 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.75 1bns n GLY 34 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 1bns s TRP 35 N -2.11 2.98 -0.22 1.61 -0.00 -0.72 -4.99 118.94 115.50 1bns s TRP 35 Ca 0.00 0.55 0.02 0.00 -0.00 0.00 0.00 56.10 56.67 1bns s TRP 35 Cb 0.00 -3.96 0.04 0.00 -0.00 0.00 0.00 33.47 29.55 1bns s TRP 35 CO 0.00 -3.60 -0.15 0.08 -0.00 0.00 0.00 176.95 173.28 1bns s VAL 36 N 1.28 2.05 0.24 5.86 1.01 -1.26 -4.56 120.40 125.02 1bns s VAL 36 Ca 0.71 -1.25 -0.05 0.00 0.00 0.00 0.00 61.98 61.40 1bns s VAL 36 Cb -0.44 -2.02 0.21 0.00 0.00 0.00 0.00 36.38 34.13 1bns s VAL 36 CO 0.31 0.25 1.81 0.00 0.00 0.00 0.00 175.10 177.47 1bns h ALA 37 N 7.87 1.15 0.00 5.51 0.00 -2.00 -2.07 119.26 129.72 1bns h ALA 37 Ca -0.32 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.62 1bns h ALA 37 Cb 1.09 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.75 1bns h ALA 37 CO 0.54 0.09 0.00 0.77 0.00 0.00 0.00 179.25 180.65 1bns h SER 38 N 0.77 0.00 0.00 0.00 0.02 -2.03 -2.65 113.55 109.67 1bns h SER 38 Ca 0.39 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.34 1bns h SER 38 Cb 0.35 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.89 1bns h SER 38 CO -0.24 0.00 -0.87 0.29 -1.14 0.00 0.00 176.83 174.87 1bns n LYS 39 N -2.41 1.70 -3.90 3.45 5.02 -0.79 -4.99 118.16 116.24 1bns n LYS 39 Ca -0.01 -0.02 -0.28 0.00 -2.02 0.00 0.00 58.31 55.98 1bns n LYS 39 Cb 0.07 -1.25 0.02 0.00 -0.02 0.00 0.00 35.03 33.85 1bns n LYS 39 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1bns n GLY 40 N 1.40 -0.41 1.30 0.72 0.00 -1.00 -4.89 105.19 102.31 1bns n GLY 40 Ca 0.02 0.17 0.09 0.00 0.00 0.00 0.00 46.02 46.30 1bns n GLY 40 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1bns n ASN 41 N -2.89 3.80 -0.28 1.61 6.94 -1.26 -3.95 115.26 119.24 1bns n ASN 41 Ca -0.08 -2.17 0.10 0.00 -0.02 0.00 0.00 54.58 52.40 1bns n ASN 41 Cb 0.58 -0.48 0.24 0.00 -2.36 0.00 0.00 39.78 37.76 1bns n ASN 41 CO 0.00 0.00 0.00 0.25 -1.03 0.00 0.00 177.26 176.48 1bns h LEU 42 N 3.69 0.03 -1.68 -4.53 5.85 -1.87 0.23 115.31 117.02 1bns h LEU 42 Ca 0.00 0.17 -0.01 0.00 0.84 0.00 0.00 57.88 58.88 1bns h LEU 42 Cb 1.06 0.23 -0.01 0.00 0.37 0.00 0.00 40.66 42.31 1bns h LEU 42 CO 0.09 -0.09 0.07 0.00 -0.34 0.00 0.00 178.44 178.17 1bns h ALA 43 N 1.71 1.75 -0.16 1.25 0.00 -1.83 -0.69 119.26 121.28 1bns h ALA 43 Ca 0.50 -0.07 -0.06 0.00 0.00 0.00 0.00 54.91 55.28 1bns h ALA 43 Cb 0.93 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.63 1bns h ALA 43 CO -0.59 0.20 -0.12 -0.44 0.00 0.00 0.00 179.25 178.30 1bns h ASP 44 N 0.28 0.39 1.03 0.00 3.45 -0.91 -2.98 116.42 117.68 1bns h ASP 44 Ca 0.07 -0.45 -0.06 0.00 0.43 0.00 0.00 57.03 57.02 1bns h ASP 44 Cb 0.08 -0.11 -0.01 0.00 -0.56 0.00 0.00 39.33 38.73 1bns h ASP 44 CO -0.01 0.76 -1.00 -0.37 -1.57 0.00 0.00 179.24 177.05 1bns h VAL 45 N 0.03 0.21 -1.39 -1.35 -1.51 -1.25 -3.40 116.25 107.59 1bns h VAL 45 Ca 0.03 -1.39 -0.40 0.00 -1.23 0.00 0.00 66.70 63.71 1bns h VAL 45 Cb 0.63 1.77 -0.28 0.00 -2.13 0.00 0.00 31.29 31.29 1bns h VAL 45 CO 0.03 0.12 -0.79 0.00 -1.23 0.00 0.00 177.57 175.70 1bns n ALA 46 N -2.24 0.67 -1.69 5.19 0.00 -0.29 -4.99 120.51 117.16 1bns n ALA 46 Ca -0.02 -2.32 -0.44 0.00 0.00 0.00 0.00 53.44 50.65 1bns n ALA 46 Cb 0.65 -1.07 -0.03 0.00 0.00 0.00 0.00 19.45 19.00 1bns n ALA 46 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 1bns n PRO 47 N 2.17 2.30 -0.99 0.00 -0.02 -1.13 -2.11 135.00 135.22 1bns n PRO 47 Ca 0.20 0.82 0.00 0.00 -2.02 0.00 0.00 63.50 62.50 1bns n PRO 47 Cb 0.55 -2.56 0.00 0.00 -0.02 0.00 0.00 33.50 31.47 1bns n PRO 47 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1bns n GLY 48 N 2.70 0.91 3.90 -1.23 0.00 -1.26 -5.02 105.19 105.20 1bns n GLY 48 Ca 0.13 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.91 1bns n GLY 48 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1bns s LYS 49 N -0.02 3.25 0.11 1.61 -0.14 -0.90 -4.79 119.74 118.87 1bns s LYS 49 Ca 0.00 -0.78 0.05 0.00 -1.36 0.00 0.00 55.97 53.89 1bns s LYS 49 Cb 0.00 -2.81 -0.04 0.00 -1.68 0.00 0.00 37.83 33.30 1bns s LYS 49 CO 0.00 0.47 -0.14 -1.12 -0.76 0.00 0.00 175.35 173.80 1bns s SER 50 N -3.55 1.88 -0.03 2.83 0.01 -0.46 -4.88 113.70 109.51 1bns s SER 50 Ca 0.33 -0.78 -0.30 0.00 1.31 0.00 0.00 55.95 56.51 1bns s SER 50 Cb -0.10 -0.06 -0.03 0.00 0.21 0.00 0.00 66.02 66.05 1bns s SER 50 CO 0.27 -0.15 1.06 -0.63 0.41 0.00 0.00 173.24 174.20 1bns s ILE 51 N -2.05 4.61 -0.13 1.44 -1.09 -1.26 -1.58 121.20 121.15 1bns s ILE 51 Ca 0.07 1.88 -0.30 0.00 -2.23 0.00 0.00 60.65 60.07 1bns s ILE 51 Cb -0.05 -4.21 0.12 0.00 -1.58 0.00 0.00 42.46 36.74 1bns s ILE 51 CO 0.02 0.09 0.95 -0.83 -1.23 0.00 0.00 174.94 173.94 1bns s GLY 52 N 1.11 -0.33 0.00 6.18 0.00 0.11 -1.21 107.32 113.18 1bns s GLY 52 Ca 0.53 1.81 0.00 0.00 0.00 0.00 0.00 44.72 47.06 1bns s GLY 52 CO 0.25 0.93 0.00 0.61 0.00 0.00 0.00 173.10 174.89 1bns n GLY 53 N 0.62 0.47 3.86 0.20 0.00 0.10 -3.02 105.19 107.42 1bns n GLY 53 Ca -0.11 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.60 1bns n GLY 53 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1bns s ASP 54 N -2.83 6.40 0.23 1.61 1.01 -1.23 -4.73 116.67 117.13 1bns s ASP 54 Ca 0.00 1.45 -0.30 0.00 0.71 0.00 0.00 52.55 54.41 1bns s ASP 54 Cb 0.00 -2.47 -0.09 0.00 1.01 0.00 0.00 42.92 41.37 1bns s ASP 54 CO 0.00 -0.73 1.31 -0.63 0.21 0.00 0.00 175.17 175.33 1bns s ILE 55 N -2.92 3.07 -0.33 0.77 -1.09 -1.26 -1.03 121.20 118.41 1bns s ILE 55 Ca 0.56 0.92 -0.10 0.00 -2.23 0.00 0.00 60.65 59.80 1bns s ILE 55 Cb -0.11 -3.59 0.01 0.00 -1.58 0.00 0.00 42.46 37.19 1bns s ILE 55 CO 0.44 0.16 0.17 0.12 -1.23 0.00 0.00 174.94 174.60 1bns s PHE 56 N -0.21 3.20 -1.00 3.97 5.36 0.31 -4.87 117.98 124.75 1bns s PHE 56 Ca 0.55 -0.73 0.20 0.00 -0.96 0.00 0.00 56.93 55.99 1bns s PHE 56 Cb -0.37 -2.38 0.86 0.00 -0.34 0.00 0.00 43.02 40.79 1bns s PHE 56 CO 0.42 -0.53 1.65 -1.13 -1.46 0.00 0.00 175.22 174.16 1bns n SER 57 N 4.98 0.00 -3.99 6.13 3.41 -1.26 -4.26 113.62 118.64 1bns n SER 57 Ca -0.13 0.50 -0.39 0.00 -0.26 0.00 0.00 58.87 58.58 1bns n SER 57 Cb 0.48 -0.50 0.01 0.00 -0.26 0.00 0.00 64.21 63.94 1bns n SER 57 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 1bns n ASN 58 N -1.50 -3.62 -0.30 4.04 5.15 -1.26 -4.82 115.26 112.94 1bns n ASN 58 Ca 0.05 -1.20 -0.04 0.00 -0.60 0.00 0.00 54.58 52.79 1bns n ASN 58 Cb 0.24 -2.24 0.08 0.00 -0.53 0.00 0.00 39.78 37.33 1bns n ASN 58 CO 0.00 0.00 0.00 -0.09 1.40 0.00 0.00 177.26 178.57 1bns h ARG 59 N -2.30 1.09 -0.44 1.20 1.12 -2.01 -2.83 114.38 110.20 1bns h ARG 59 Ca -0.69 -0.07 0.00 0.00 -1.11 0.00 0.00 59.98 58.11 1bns h ARG 59 Cb 1.39 -0.24 0.00 0.00 -0.01 0.00 0.00 29.97 31.11 1bns h ARG 59 CO 0.54 0.73 0.00 0.39 -3.11 0.00 0.00 179.97 178.51 1bns n GLU 60 N -4.50 1.34 -2.68 0.20 4.71 -1.26 -4.91 120.64 113.53 1bns n GLU 60 Ca 0.08 -0.37 -0.09 0.00 -0.01 0.00 0.00 57.16 56.78 1bns n GLU 60 Cb 0.02 -1.29 -0.01 0.00 -1.01 0.00 0.00 31.44 29.15 1bns n GLU 60 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1bns n GLY 61 N 0.42 -0.49 0.22 0.62 0.00 -1.07 -4.81 105.19 100.07 1bns n GLY 61 Ca 0.03 0.01 -0.12 0.00 0.00 0.00 0.00 46.02 45.95 1bns n GLY 61 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1bns h LYS 62 N -0.15 0.65 -6.44 1.61 1.57 -1.91 -3.44 116.57 108.47 1bns h LYS 62 Ca -0.17 -0.44 -0.54 0.00 -1.87 0.00 0.00 60.65 57.62 1bns h LYS 62 Cb 1.12 0.06 -0.03 0.00 0.08 0.00 0.00 32.23 33.46 1bns h LYS 62 CO 0.22 1.06 0.01 -0.51 -0.57 0.00 0.00 179.45 179.67 1bns s LEU 63 N -8.38 4.36 0.12 2.94 1.43 -1.26 -5.00 118.68 112.88 1bns s LEU 63 Ca -0.08 1.26 -0.36 0.00 -1.03 0.00 0.00 54.13 53.92 1bns s LEU 63 Cb 0.10 -3.39 -0.16 0.00 0.03 0.00 0.00 46.19 42.77 1bns s LEU 63 CO 0.86 0.08 1.39 -0.81 0.23 0.00 0.00 176.35 178.10 1bns n PRO 64 N 0.84 1.42 -3.01 1.29 -0.04 -1.26 -4.96 135.00 129.28 1bns n PRO 64 Ca -0.04 0.51 -0.17 0.00 -0.04 0.00 0.00 63.50 63.76 1bns n PRO 64 Cb 0.51 -2.18 0.01 0.00 -0.04 0.00 0.00 33.50 31.81 1bns n PRO 64 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 1bns s GLY 65 N 0.54 1.93 0.00 0.55 0.00 -1.26 -5.09 107.32 103.99 1bns s GLY 65 Ca 0.82 -1.70 0.00 0.00 0.00 0.00 0.00 44.72 43.84 1bns s GLY 65 CO 0.45 -1.50 0.00 1.17 0.00 0.00 0.00 173.10 173.22 1bns n LYS 66 N -1.89 0.00 -2.01 2.90 4.81 -1.26 -5.04 118.16 115.67 1bns n LYS 66 Ca 0.09 0.00 -0.42 0.00 -0.87 0.00 0.00 58.31 57.10 1bns n LYS 66 Cb 0.59 0.00 -0.03 0.00 0.02 0.00 0.00 35.03 35.61 1bns n LYS 66 CO 0.00 0.00 0.00 0.45 1.17 0.00 0.00 177.40 179.02 1bns s SER 67 N 0.00 6.67 0.00 3.14 0.15 -1.26 -2.16 113.70 120.24 1bns s SER 67 Ca 0.00 2.35 0.00 0.00 0.70 0.00 0.00 55.95 59.00 1bns s SER 67 Cb 0.00 -2.56 0.00 0.00 -1.71 0.00 0.00 66.02 61.75 1bns s SER 67 CO 0.00 -0.86 0.00 0.61 1.20 0.00 0.00 173.24 174.19 1bns n GLY 68 N 3.94 0.60 3.57 9.45 0.00 -1.26 -5.04 105.19 116.45 1bns n GLY 68 Ca 0.15 -0.44 -0.36 0.00 0.00 0.00 0.00 46.02 45.37 1bns n GLY 68 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1bns s ARG 69 N -0.93 3.89 -0.07 1.61 3.52 -0.92 -4.94 118.95 121.11 1bns s ARG 69 Ca 0.00 -0.37 0.01 0.00 -0.13 0.00 0.00 55.73 55.25 1bns s ARG 69 Cb 0.00 -3.38 -0.03 0.00 -1.56 0.00 0.00 34.95 29.98 1bns s ARG 69 CO 0.00 0.02 -0.09 0.99 -0.81 0.00 0.00 175.30 175.41 1bns s THR 70 N 1.10 3.47 -0.07 4.11 2.01 -1.26 -4.82 115.64 120.18 1bns s THR 70 Ca 0.05 -0.56 -0.01 0.00 0.31 0.00 0.00 61.69 61.48 1bns s THR 70 Cb -0.14 -2.41 -0.03 0.00 0.01 0.00 0.00 72.50 69.93 1bns s THR 70 CO 0.04 0.59 0.01 0.26 -0.69 0.00 0.00 174.62 174.82 1bns s TRP 71 N -0.65 3.16 0.15 4.92 0.52 -1.26 -0.74 118.94 125.04 1bns s TRP 71 Ca 0.10 0.18 0.06 0.00 0.02 0.00 0.00 56.10 56.46 1bns s TRP 71 Cb -0.11 -1.77 -0.04 0.00 -1.15 0.00 0.00 33.47 30.39 1bns s TRP 71 CO 0.01 0.47 -0.12 1.03 0.02 0.00 0.00 176.95 178.37 1bns s ARG 72 N -1.00 1.12 0.24 4.98 0.52 0.25 -0.53 118.95 124.52 1bns s ARG 72 Ca 0.14 -1.42 0.05 0.00 -0.52 0.00 0.00 55.73 53.98 1bns s ARG 72 Cb -0.11 -0.83 -0.05 0.00 0.52 0.00 0.00 34.95 34.47 1bns s ARG 72 CO 0.04 0.13 -0.05 -1.83 0.02 0.00 0.00 175.30 173.61 1bns s GLU 73 N -3.40 1.39 -0.17 3.54 -1.05 -0.20 -0.94 118.70 117.87 1bns s GLU 73 Ca 0.16 -1.69 -0.21 0.00 -0.15 0.00 0.00 54.97 53.07 1bns s GLU 73 Cb -0.00 -0.87 0.06 0.00 -0.44 0.00 0.00 34.13 32.87 1bns s GLU 73 CO 0.03 -0.00 0.57 0.00 0.95 0.00 0.00 175.26 176.81 1bns s ALA 74 N -3.21 -1.43 0.26 -0.84 0.00 -0.56 0.01 121.76 115.98 1bns s ALA 74 Ca 0.27 1.46 -0.30 0.00 0.00 0.00 0.00 51.96 53.40 1bns s ALA 74 Cb 0.04 -0.70 -0.09 0.00 0.00 0.00 0.00 23.12 22.37 1bns s ALA 74 CO 0.09 -0.29 1.28 -0.51 0.00 0.00 0.00 175.76 176.33 1bns s ASP 75 N -0.09 6.90 0.10 0.00 1.11 -0.35 -0.73 116.67 123.61 1bns s ASP 75 Ca -0.03 2.49 0.10 0.00 0.18 0.00 0.00 52.55 55.29 1bns s ASP 75 Cb -0.03 -2.63 -0.04 0.00 1.07 0.00 0.00 42.92 41.29 1bns s ASP 75 CO 0.03 -0.48 -0.25 -0.63 1.18 0.00 0.00 175.17 175.02 1bns s ILE 76 N -0.53 2.33 -1.91 0.77 -1.09 -0.45 -4.77 121.20 115.55 1bns s ILE 76 Ca 0.52 -1.58 0.00 0.00 -2.23 0.00 0.00 60.65 57.36 1bns s ILE 76 Cb -0.37 -2.00 0.00 0.00 -1.58 0.00 0.00 42.46 38.51 1bns s ILE 76 CO 0.44 0.19 0.00 0.59 -1.23 0.00 0.00 174.94 174.93 1bns n ASN 77 N 1.20 -5.52 -4.76 3.58 3.02 0.60 -4.59 115.26 108.79 1bns n ASN 77 Ca -0.17 0.25 -0.39 0.00 -0.03 0.00 0.00 54.58 54.23 1bns n ASN 77 Cb 0.53 -4.67 -0.05 0.00 -0.61 0.00 0.00 39.78 34.98 1bns n ASN 77 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 1bns s TYR 78 N -2.86 3.71 0.05 3.10 5.04 -1.26 -4.93 117.35 120.20 1bns s TYR 78 Ca 0.00 1.30 0.00 0.00 -2.44 0.00 0.00 57.07 55.93 1bns s TYR 78 Cb 0.00 -2.68 0.00 0.00 0.35 0.00 0.00 41.96 39.63 1bns s TYR 78 CO 0.00 0.34 0.00 0.25 -1.34 0.00 0.00 175.55 174.80 1bns n THR 79 N 2.70 0.21 -3.85 4.34 -2.24 -1.26 -4.94 114.28 109.24 1bns n THR 79 Ca -0.05 0.07 -0.08 0.00 -2.27 0.00 0.00 64.05 61.71 1bns n THR 79 Cb 0.51 -1.16 -0.00 0.00 -2.10 0.00 0.00 70.33 67.58 1bns n THR 79 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1bns s SER 80 N -5.17 -0.09 0.14 3.42 1.04 -1.26 -4.83 113.70 106.95 1bns s SER 80 Ca 0.00 -0.90 0.00 0.00 0.48 0.00 0.00 55.95 55.53 1bns s SER 80 Cb 0.00 0.78 0.00 0.00 0.10 0.00 0.00 66.02 66.90 1bns s SER 80 CO 0.00 -1.50 0.00 0.61 0.98 0.00 0.00 173.24 173.33 1bns n GLY 81 N -0.49 -0.55 3.75 7.32 0.00 -1.25 -4.87 105.19 109.10 1bns n GLY 81 Ca -0.06 -1.12 -0.35 0.00 0.00 0.00 0.00 46.02 44.50 1bns n GLY 81 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1bns s PHE 82 N 0.00 2.43 0.65 1.61 0.40 -1.26 -4.57 117.98 117.24 1bns s PHE 82 Ca 0.00 1.55 -0.17 0.00 -0.60 0.00 0.00 56.93 57.71 1bns s PHE 82 Cb 0.00 -3.36 -0.01 0.00 0.51 0.00 0.00 43.02 40.16 1bns s PHE 82 CO 0.00 -2.05 1.16 1.03 0.70 0.00 0.00 175.22 176.07 1bns s ARG 83 N -3.65 2.74 0.00 0.44 0.52 -1.26 -4.98 118.95 112.75 1bns s ARG 83 Ca 0.73 1.63 0.00 0.00 -0.52 0.00 0.00 55.73 57.57 1bns s ARG 83 Cb -0.26 -1.92 0.00 0.00 0.52 0.00 0.00 34.95 33.29 1bns s ARG 83 CO 0.37 -1.34 0.00 0.27 0.02 0.00 0.00 175.30 174.61 1bns n ASN 84 N -2.14 0.00 -0.60 0.23 0.23 -1.26 -5.04 115.26 106.68 1bns n ASN 84 Ca 0.12 0.00 0.07 0.00 -0.53 0.00 0.00 54.58 54.24 1bns n ASN 84 Cb 0.51 0.00 0.08 0.00 -2.08 0.00 0.00 39.78 38.29 1bns n ASN 84 CO 0.00 0.00 0.00 -1.54 -0.93 0.00 0.00 177.26 174.79 1bns n SER 85 N 0.00 2.32 -4.73 0.53 3.41 -1.26 -4.97 113.62 108.92 1bns n SER 85 Ca 0.00 -1.65 -0.38 0.00 -0.26 0.00 0.00 58.87 56.58 1bns n SER 85 Cb 0.00 -0.04 -0.06 0.00 -0.26 0.00 0.00 64.21 63.85 1bns n SER 85 CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 1bns s ASP 86 N -1.15 6.76 0.03 4.04 1.01 -1.26 -1.64 116.67 124.45 1bns s ASP 86 Ca 0.18 0.90 -0.11 0.00 0.71 0.00 0.00 52.55 54.24 1bns s ASP 86 Cb 0.12 -2.31 0.01 0.00 1.01 0.00 0.00 42.92 41.75 1bns s ASP 86 CO 0.18 0.01 0.23 -0.13 0.21 0.00 0.00 175.17 175.67 1bns s ARG 87 N 0.49 0.69 -0.03 8.23 1.81 -0.36 -1.34 118.95 128.45 1bns s ARG 87 Ca 0.28 -0.51 0.04 0.00 -1.72 0.00 0.00 55.73 53.81 1bns s ARG 87 Cb -0.16 0.29 -0.03 0.00 -0.45 0.00 0.00 34.95 34.61 1bns s ARG 87 CO 0.12 -0.20 -0.12 -1.50 -0.68 0.00 0.00 175.30 172.92 1bns s ILE 88 N -2.24 3.27 -0.14 1.52 2.07 0.09 -1.94 121.20 123.83 1bns s ILE 88 Ca -0.07 -0.77 0.02 0.00 -1.41 0.00 0.00 60.65 58.42 1bns s ILE 88 Cb -0.02 -2.34 0.00 0.00 0.13 0.00 0.00 42.46 40.23 1bns s ILE 88 CO -0.02 0.51 -0.19 -0.76 -1.91 0.00 0.00 174.94 172.57 1bns s LEU 89 N -1.02 2.28 -0.02 8.50 1.02 -0.13 -1.50 118.68 127.81 1bns s LEU 89 Ca 0.13 -0.53 0.01 0.00 0.02 0.00 0.00 54.13 53.77 1bns s LEU 89 Cb -0.11 -1.50 0.01 0.00 0.02 0.00 0.00 46.19 44.61 1bns s LEU 89 CO 0.03 0.09 -0.04 -0.72 0.02 0.00 0.00 176.35 175.73 1bns s TYR 90 N 0.74 0.52 0.35 0.29 -0.85 -0.12 -0.69 117.35 117.60 1bns s TYR 90 Ca -0.08 -0.10 0.03 0.00 -0.52 0.00 0.00 57.07 56.40 1bns s TYR 90 Cb -0.16 -0.40 -0.02 0.00 0.38 0.00 0.00 41.96 41.76 1bns s TYR 90 CO 0.00 -0.06 0.53 -1.54 -1.52 0.00 0.00 175.55 172.96 1bns s SER 91 N 0.26 6.10 0.55 -0.18 1.04 -0.92 0.85 113.70 121.40 1bns s SER 91 Ca -0.03 0.19 0.28 0.00 0.48 0.00 0.00 55.95 56.88 1bns s SER 91 Cb -0.06 -1.69 1.60 0.00 0.10 0.00 0.00 66.02 65.97 1bns s SER 91 CO -0.00 -0.40 2.14 0.77 0.98 0.00 0.00 173.24 176.73 1bns h SER 92 N 0.76 0.00 -0.48 7.02 4.64 -1.30 0.16 113.55 124.35 1bns h SER 92 Ca -0.48 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.84 1bns h SER 92 Cb 1.24 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.33 1bns h SER 92 CO 0.58 0.07 0.00 -0.90 -0.87 0.00 0.00 176.83 175.72 1bns n ASP 93 N -3.71 4.26 -3.46 4.97 5.75 -1.26 -4.93 116.55 118.17 1bns n ASP 93 Ca -0.02 -2.53 -0.20 0.00 -0.01 0.00 0.00 54.79 52.03 1bns n ASP 93 Cb 0.18 -0.58 0.08 0.00 -1.03 0.00 0.00 41.12 39.78 1bns n ASP 93 CO 0.00 0.00 0.00 0.79 -0.11 0.00 0.00 177.20 177.88 1bns n TRP 94 N 0.68 -2.45 -3.11 2.11 7.02 0.04 -5.02 117.44 116.71 1bns n TRP 94 Ca 0.21 0.96 -0.39 0.00 -1.02 0.00 0.00 57.50 57.26 1bns n TRP 94 Cb 0.85 -5.02 -0.05 0.00 -2.42 0.00 0.00 31.31 24.67 1bns n TRP 94 CO 0.00 0.00 0.00 -0.51 -2.02 0.00 0.00 177.69 175.16 1bns s LEU 95 N -6.69 4.36 -0.14 -0.99 1.43 -1.26 -4.88 118.68 110.52 1bns s LEU 95 Ca 0.24 1.17 0.02 0.00 -1.03 0.00 0.00 54.13 54.53 1bns s LEU 95 Cb -0.11 -3.01 0.00 0.00 0.03 0.00 0.00 46.19 43.10 1bns s LEU 95 CO 0.72 -0.03 -0.20 -0.63 0.23 0.00 0.00 176.35 176.44 1bns s ILE 96 N 0.40 2.30 0.27 -0.59 1.01 -1.01 -2.17 121.20 121.42 1bns s ILE 96 Ca 0.35 -0.90 0.12 0.00 0.00 0.00 0.00 60.65 60.21 1bns s ILE 96 Cb -0.18 -1.93 -0.05 0.00 0.01 0.00 0.00 42.46 40.31 1bns s ILE 96 CO 0.18 0.54 -0.20 -0.31 0.00 0.00 0.00 174.94 175.14 1bns s TYR 97 N 0.69 2.26 0.06 3.97 1.51 0.13 0.17 117.35 126.15 1bns s TYR 97 Ca -0.09 -0.35 0.02 0.00 -1.01 0.00 0.00 57.07 55.64 1bns s TYR 97 Cb -0.16 -1.00 -0.03 0.00 -0.11 0.00 0.00 41.96 40.66 1bns s TYR 97 CO 0.01 0.68 -0.07 -1.59 -1.11 0.00 0.00 175.55 173.47 1bns s LYS 98 N -3.42 0.62 -0.05 -0.62 0.00 -0.16 -0.96 119.74 115.16 1bns s LYS 98 Ca 0.29 -0.99 -0.03 0.00 0.00 0.00 0.00 55.97 55.24 1bns s LYS 98 Cb -0.05 -0.18 0.02 0.00 0.00 0.00 0.00 37.83 37.61 1bns s LYS 98 CO 0.14 0.00 0.11 -0.08 0.00 0.00 0.00 175.35 175.53 1bns s THR 99 N -2.39 -0.01 -0.09 3.79 -1.32 -0.82 -1.28 115.64 113.53 1bns s THR 99 Ca -0.01 0.04 0.13 0.00 -1.21 0.00 0.00 61.69 60.64 1bns s THR 99 Cb -0.03 -0.17 0.22 0.00 -1.51 0.00 0.00 72.50 71.00 1bns s THR 99 CO -0.02 0.02 1.11 0.35 -2.21 0.00 0.00 174.62 173.86 1bns n THR 100 N 3.30 1.23 -2.77 5.08 -2.24 -1.26 -1.22 114.28 116.41 1bns n THR 100 Ca -0.16 -1.58 -0.02 0.00 -2.27 0.00 0.00 64.05 60.03 1bns n THR 100 Cb 0.57 0.05 0.08 0.00 -2.10 0.00 0.00 70.33 68.93 1bns n THR 100 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 1bns n ASP 101 N -0.87 0.45 -3.37 3.42 3.85 -1.19 -4.65 116.55 114.18 1bns n ASP 101 Ca 0.11 -2.15 -0.18 0.00 -0.71 0.00 0.00 54.79 51.86 1bns n ASP 101 Cb 0.69 -0.05 0.07 0.00 -1.35 0.00 0.00 41.12 40.47 1bns n ASP 101 CO 0.00 0.00 0.00 1.41 -1.01 0.00 0.00 177.20 177.60 1bns n HIS 102 N -0.87 -2.30 -1.85 2.11 8.25 -0.65 -2.48 115.22 117.42 1bns n HIS 102 Ca -0.01 0.81 -0.16 0.00 -0.26 0.00 0.00 57.72 58.10 1bns n HIS 102 Cb 0.83 -4.19 -0.04 0.00 1.12 0.00 0.00 29.99 27.70 1bns n HIS 102 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 1bns n TYR 103 N -3.59 -0.65 0.01 4.41 4.02 -1.26 -4.86 117.16 115.25 1bns n TYR 103 Ca -0.12 0.00 -0.18 0.00 -0.01 0.00 0.00 57.90 57.59 1bns n TYR 103 Cb 0.63 -3.04 -0.14 0.00 -0.02 0.00 0.00 39.34 36.77 1bns n TYR 103 CO 0.00 0.00 0.00 1.96 -1.01 0.00 0.00 176.86 177.81 1bns h GLN 104 N 0.00 0.23 -5.61 -0.72 4.20 -1.90 -3.46 115.11 107.84 1bns h GLN 104 Ca -0.35 -0.35 -0.51 0.00 0.06 0.00 0.00 58.65 57.50 1bns h GLN 104 Cb 1.13 0.13 -0.27 0.00 0.30 0.00 0.00 27.48 28.77 1bns h GLN 104 CO 0.46 1.14 -0.82 0.99 -0.67 0.00 0.00 178.83 179.93 1bns s THR 105 N -2.54 1.33 -0.02 -0.54 2.01 -1.26 -5.12 115.64 109.50 1bns s THR 105 Ca -0.15 -0.93 0.04 0.00 0.31 0.00 0.00 61.69 60.97 1bns s THR 105 Cb 0.00 -1.15 -0.01 0.00 0.01 0.00 0.00 72.50 71.35 1bns s THR 105 CO 0.79 0.21 -0.15 -0.36 -0.69 0.00 0.00 174.62 174.42 1bns s PHE 106 N -0.64 1.35 0.01 4.92 0.40 -1.26 -4.25 117.98 118.52 1bns s PHE 106 Ca 0.05 -0.28 0.03 0.00 -0.60 0.00 0.00 56.93 56.14 1bns s PHE 106 Cb -0.07 -0.88 -0.01 0.00 0.51 0.00 0.00 43.02 42.57 1bns s PHE 106 CO 0.01 -0.04 -0.10 0.95 0.70 0.00 0.00 175.22 176.73 1bns s THR 107 N -0.27 0.79 0.40 0.64 -4.23 -0.40 -4.94 115.64 107.63 1bns s THR 107 Ca 0.04 -0.66 -0.25 0.00 -1.18 0.00 0.00 61.69 59.64 1bns s THR 107 Cb -0.07 -0.71 -0.08 0.00 1.34 0.00 0.00 72.50 72.98 1bns s THR 107 CO -0.00 0.05 1.20 -0.75 -0.54 0.00 0.00 174.62 174.58 1bns s LYS 108 N -0.68 4.03 0.00 3.99 2.20 -1.26 -0.99 119.74 127.03 1bns s LYS 108 Ca 0.01 1.91 0.00 0.00 -0.36 0.00 0.00 55.97 57.52 1bns s LYS 108 Cb -0.06 -2.69 0.00 0.00 -1.51 0.00 0.00 37.83 33.57 1bns s LYS 108 CO 0.00 -0.36 0.00 0.44 -0.36 0.00 0.00 175.35 175.08 1bns n ILE 109 N 0.09 0.00 -1.33 5.43 -5.35 0.13 -4.89 119.36 113.44 1bns n ILE 109 Ca 0.04 -0.16 0.00 0.00 -0.27 0.00 0.00 62.75 62.36 1bns n ILE 109 Cb 0.46 0.68 0.00 0.00 -1.74 0.00 0.00 39.64 39.03 1bns n ILE 109 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33