#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1brg s ILE 4 N 0.00 5.22 0.00 0.00 -1.09 -1.26 -4.82 121.20 119.25 1brg s ILE 4 Ca 0.00 -0.98 0.00 0.00 -2.23 0.00 0.00 60.65 57.44 1brg s ILE 4 Cb 0.00 -4.11 0.00 0.00 -1.58 0.00 0.00 42.46 36.77 1brg s ILE 4 CO 0.00 -0.56 0.34 -0.46 -1.23 0.00 0.00 174.94 173.03 1brg n ASN 5 N 5.25 0.00 -4.88 3.58 6.94 -1.26 -4.82 115.26 120.07 1brg n ASN 5 Ca -0.12 -1.00 -0.30 0.00 -0.02 0.00 0.00 54.58 53.14 1brg n ASN 5 Cb 0.44 0.00 0.00 0.00 -2.36 0.00 0.00 39.78 37.86 1brg n ASN 5 CO 0.00 0.00 0.00 0.42 -1.03 0.00 0.00 177.26 176.65 1brg s THR 6 N 0.00 4.78 0.10 5.53 -4.23 -1.26 -2.23 115.64 118.33 1brg s THR 6 Ca 0.00 0.62 -0.33 0.00 -1.18 0.00 0.00 61.69 60.80 1brg s THR 6 Cb 0.00 -3.86 -0.13 0.00 1.34 0.00 0.00 72.50 69.85 1brg s THR 6 CO 0.00 -1.01 1.58 0.25 -0.54 0.00 0.00 174.62 174.90 1brg h LEU 7 N -0.04 -1.32 -0.55 4.79 5.85 -1.98 -2.11 115.31 119.95 1brg h LEU 7 Ca -0.45 0.13 -0.08 0.00 0.84 0.00 0.00 57.88 58.32 1brg h LEU 7 Cb 1.20 0.47 -0.02 0.00 0.37 0.00 0.00 40.66 42.68 1brg h LEU 7 CO 0.62 -0.55 0.04 0.44 -0.34 0.00 0.00 178.44 178.65 1brg h ASP 8 N -0.77 0.91 0.24 1.25 3.32 -1.97 -1.12 116.42 118.28 1brg h ASP 8 Ca -0.01 -0.29 0.01 0.00 0.02 0.00 0.00 57.03 56.76 1brg h ASP 8 Cb 0.74 -0.24 -0.04 0.00 0.22 0.00 0.00 39.33 40.01 1brg h ASP 8 CO -0.19 0.97 -0.46 1.23 -1.72 0.00 0.00 179.24 179.07 1brg h GLY 9 N 0.83 -1.02 1.07 2.75 0.00 -1.95 1.79 103.07 106.53 1brg h GLY 9 Ca 0.16 0.55 -0.13 0.00 0.00 0.00 0.00 47.33 47.91 1brg h GLY 9 CO 0.02 -0.30 -0.28 -2.08 0.00 0.00 0.00 176.54 173.90 1brg h VAL 10 N -0.78 1.28 -0.20 4.60 2.07 -1.46 -0.27 116.25 121.49 1brg h VAL 10 Ca -0.01 -1.44 0.04 0.00 0.82 0.00 0.00 66.70 66.11 1brg h VAL 10 Cb 0.75 1.34 -0.04 0.00 -1.52 0.00 0.00 31.29 31.82 1brg h VAL 10 CO -0.19 0.48 -0.05 0.00 0.02 0.00 0.00 177.57 177.83 1brg h ALA 11 N 0.79 0.13 -0.55 1.67 0.00 -0.81 0.38 119.26 120.87 1brg h ALA 11 Ca 0.08 0.08 -0.09 0.00 0.00 0.00 0.00 54.91 54.98 1brg h ALA 11 Cb 0.86 0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.79 1brg h ALA 11 CO 0.08 -0.48 0.00 -0.44 0.00 0.00 0.00 179.25 178.41 1brg h ASP 12 N -0.01 0.96 -0.42 0.00 3.32 0.29 -3.18 116.42 117.37 1brg h ASP 12 Ca 0.10 -0.31 0.08 0.00 0.02 0.00 0.00 57.03 56.92 1brg h ASP 12 Cb 0.16 -0.26 -0.07 0.00 0.22 0.00 0.00 39.33 39.38 1brg h ASP 12 CO -0.21 1.03 0.01 0.22 -1.72 0.00 0.00 179.24 178.57 1brg h TYR 13 N 0.86 -0.00 -0.80 4.55 5.03 -0.61 -2.40 116.97 123.59 1brg h TYR 13 Ca 0.16 0.03 -0.01 0.00 2.58 0.00 0.00 58.73 61.49 1brg h TYR 13 Cb 0.54 0.07 -0.04 0.00 1.55 0.00 0.00 36.73 38.84 1brg h TYR 13 CO 0.04 -0.07 0.46 -0.07 -1.32 0.00 0.00 178.16 177.19 1brg h LEU 14 N 0.12 0.99 -1.45 2.82 3.38 -0.92 0.62 115.31 120.87 1brg h LEU 14 Ca 0.21 -0.08 -0.06 0.00 0.09 0.00 0.00 57.88 58.04 1brg h LEU 14 Cb 0.29 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.79 1brg h LEU 14 CO -0.34 0.78 -0.27 1.56 0.09 0.00 0.00 178.44 180.27 1brg h GLN 15 N 1.11 0.00 0.00 1.13 4.20 -1.47 -1.75 115.11 118.32 1brg h GLN 15 Ca 0.28 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.99 1brg h GLN 15 Cb 0.00 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.78 1brg h GLN 15 CO -0.05 0.27 -0.15 2.41 -0.67 0.00 0.00 178.83 180.64 1brg n THR 16 N -3.84 0.41 1.26 -0.54 -1.04 -0.93 -4.55 114.28 105.04 1brg n THR 16 Ca -0.02 0.42 0.13 0.00 -2.04 0.00 0.00 64.05 62.54 1brg n THR 16 Cb 0.35 -1.76 0.67 0.00 -1.82 0.00 0.00 70.33 67.78 1brg n THR 16 CO 0.00 0.00 0.00 -1.22 -0.64 0.00 0.00 175.07 173.21 1brg n TYR 17 N -2.94 0.00 -2.44 -1.42 4.01 0.21 -4.93 117.16 109.65 1brg n TYR 17 Ca -0.02 0.00 -0.19 0.00 -0.16 0.00 0.00 57.90 57.53 1brg n TYR 17 Cb 0.08 -0.29 -0.01 0.00 -0.31 0.00 0.00 39.34 38.81 1brg n TYR 17 CO 0.00 0.00 0.00 0.72 -0.46 0.00 0.00 176.86 177.12 1brg n HIS 18 N -1.29 -1.14 -3.72 -0.72 8.25 -0.66 -4.95 115.22 110.99 1brg n HIS 18 Ca 0.13 0.02 -0.08 0.00 -0.26 0.00 0.00 57.72 57.53 1brg n HIS 18 Cb 0.21 -3.72 -0.02 0.00 1.12 0.00 0.00 29.99 27.58 1brg n HIS 18 CO 0.00 0.00 0.00 -1.59 0.64 0.00 0.00 176.34 175.39 1brg s LYS 19 N -5.08 1.59 0.52 -0.41 -2.85 -1.26 -5.03 119.74 107.23 1brg s LYS 19 Ca 0.01 -0.81 -0.15 0.00 -1.00 0.00 0.00 55.97 54.03 1brg s LYS 19 Cb -0.01 0.59 -0.07 0.00 -2.06 0.00 0.00 37.83 36.28 1brg s LYS 19 CO 0.02 -0.72 0.97 -0.51 0.10 0.00 0.00 175.35 175.21 1brg s LEU 20 N -2.86 3.57 0.67 2.77 1.43 -1.26 -4.05 118.68 118.95 1brg s LEU 20 Ca 0.08 1.49 -0.16 0.00 -1.03 0.00 0.00 54.13 54.51 1brg s LEU 20 Cb -0.04 -4.44 0.01 0.00 0.03 0.00 0.00 46.19 41.74 1brg s LEU 20 CO 0.01 -0.62 1.19 -2.84 0.23 0.00 0.00 176.35 174.31 1brg s PRO 21 N -4.26 2.54 0.57 1.29 0.02 -1.26 -4.92 135.00 128.97 1brg s PRO 21 Ca 0.57 1.70 0.23 0.00 0.02 0.00 0.00 61.00 63.52 1brg s PRO 21 Cb -0.10 -1.89 1.25 0.00 0.02 0.00 0.00 34.50 33.78 1brg s PRO 21 CO 0.36 -1.51 1.68 -0.44 -0.33 0.00 0.00 177.00 176.75 1brg h ASP 22 N 0.14 0.00 -0.24 2.53 3.32 -1.95 -2.07 116.42 118.14 1brg h ASP 22 Ca -0.48 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.57 1brg h ASP 22 Cb 1.29 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.84 1brg h ASP 22 CO 0.52 0.00 0.00 -0.46 -1.72 0.00 0.00 179.24 177.58 1brg n ASN 23 N -2.62 1.32 -4.69 6.45 6.94 -1.26 -4.88 115.26 116.52 1brg n ASN 23 Ca -0.02 -1.99 -0.33 0.00 -0.02 0.00 0.00 54.58 52.23 1brg n ASN 23 Cb 0.40 -0.16 -0.09 0.00 -2.36 0.00 0.00 39.78 37.57 1brg n ASN 23 CO 0.00 0.00 0.00 -0.31 -1.03 0.00 0.00 177.26 175.92 1brg s TYR 24 N -1.68 3.10 0.04 -2.53 2.02 -0.78 -0.71 117.35 116.81 1brg s TYR 24 Ca 0.17 0.11 -0.04 0.00 -0.37 0.00 0.00 57.07 56.94 1brg s TYR 24 Cb 0.09 -1.70 -0.02 0.00 -0.40 0.00 0.00 41.96 39.93 1brg s TYR 24 CO 0.12 0.46 0.06 0.96 -1.57 0.00 0.00 175.55 175.58 1brg s ILE 25 N -1.05 0.15 0.87 2.71 -4.36 -0.73 -4.90 121.20 113.89 1brg s ILE 25 Ca 0.18 -1.26 -0.13 0.00 -0.26 0.00 0.00 60.65 59.18 1brg s ILE 25 Cb -0.11 -1.02 0.13 0.00 1.25 0.00 0.00 42.46 42.70 1brg s ILE 25 CO 0.09 -0.70 1.23 0.42 0.24 0.00 0.00 174.94 176.23 1brg s THR 26 N -2.93 2.00 0.28 8.37 -4.23 -1.22 -1.37 115.64 116.54 1brg s THR 26 Ca -0.02 -0.00 -0.03 0.00 -1.18 0.00 0.00 61.69 60.45 1brg s THR 26 Cb 0.01 -3.00 0.23 0.00 1.34 0.00 0.00 72.50 71.07 1brg s THR 26 CO -0.06 0.00 1.91 0.11 -0.54 0.00 0.00 174.62 176.04 1brg h LYS 27 N -1.28 1.09 -0.12 3.99 1.57 -1.97 -1.86 116.57 117.98 1brg h LYS 27 Ca -0.45 -0.11 -0.06 0.00 -1.87 0.00 0.00 60.65 58.16 1brg h LYS 27 Cb 1.29 -0.22 -0.00 0.00 0.08 0.00 0.00 32.23 33.38 1brg h LYS 27 CO 0.55 0.79 -0.15 0.66 -0.57 0.00 0.00 179.45 180.73 1brg h SER 28 N 1.10 0.35 -0.70 0.86 4.64 -1.99 -0.24 113.55 117.57 1brg h SER 28 Ca 0.28 -0.51 0.05 0.00 -0.47 0.00 0.00 61.79 61.15 1brg h SER 28 Cb -0.00 -0.10 -0.05 0.00 -0.31 0.00 0.00 62.40 61.94 1brg h SER 28 CO -0.05 0.78 0.41 -0.33 -0.87 0.00 0.00 176.83 176.78 1brg h GLU 29 N -0.08 0.76 -0.92 4.77 5.08 -1.87 -0.55 114.58 121.76 1brg h GLU 29 Ca 0.02 -0.05 0.04 0.00 -1.00 0.00 0.00 59.36 58.37 1brg h GLU 29 Cb 0.70 -0.17 -0.06 0.00 0.50 0.00 0.00 28.75 29.72 1brg h GLU 29 CO 0.04 0.50 0.59 0.00 -1.00 0.00 0.00 179.01 179.14 1brg h ALA 30 N 1.34 1.24 -0.49 3.43 0.00 -1.19 -1.63 119.26 121.96 1brg h ALA 30 Ca 0.30 -0.03 -0.13 0.00 0.00 0.00 0.00 54.91 55.05 1brg h ALA 30 Cb 0.13 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 1brg h ALA 30 CO -0.15 0.43 -0.21 1.96 0.00 0.00 0.00 179.25 181.27 1brg h GLN 31 N 1.13 1.00 -0.80 0.00 4.20 -0.43 0.17 115.11 120.38 1brg h GLN 31 Ca 0.38 -0.42 -0.01 0.00 0.06 0.00 0.00 58.65 58.65 1brg h GLN 31 Cb 0.06 -0.04 -0.04 0.00 0.30 0.00 0.00 27.48 27.77 1brg h GLN 31 CO -0.14 1.10 0.45 0.00 -0.67 0.00 0.00 178.83 179.57 1brg h ALA 32 N 0.88 1.29 0.00 3.87 0.00 -0.70 -1.78 119.26 122.82 1brg h ALA 32 Ca 0.11 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1brg h ALA 32 Cb 0.79 -0.32 0.00 0.00 0.00 0.00 0.00 17.79 18.26 1brg h ALA 32 CO 0.07 0.59 0.00 1.28 0.00 0.00 0.00 179.25 181.19 1brg n LEU 33 N -4.36 0.00 0.00 0.00 4.77 -0.65 -4.86 117.00 111.90 1brg n LEU 33 Ca 0.08 0.40 0.00 0.00 -0.03 0.00 0.00 56.01 56.46 1brg n LEU 33 Cb 0.09 -0.40 0.00 0.00 -2.33 0.00 0.00 43.42 40.78 1brg n LEU 33 CO 0.38 -0.14 0.00 0.61 -1.33 0.00 0.00 177.39 176.91 1brg n GLY 34 N 0.40 1.35 3.69 -0.72 0.00 -0.67 -4.90 105.19 104.34 1brg n GLY 34 Ca 0.07 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.66 1brg n GLY 34 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 1brg s TRP 35 N -2.00 3.10 -0.36 1.61 -0.00 0.57 -4.94 118.94 116.92 1brg s TRP 35 Ca 0.00 1.12 0.03 0.00 -0.00 0.00 0.00 56.10 57.25 1brg s TRP 35 Cb 0.00 -3.48 0.10 0.00 -0.00 0.00 0.00 33.47 30.10 1brg s TRP 35 CO 0.00 -1.57 0.09 0.08 -0.00 0.00 0.00 176.95 175.54 1brg s VAL 36 N 2.32 2.49 0.33 5.86 1.01 -1.26 -4.42 120.40 126.74 1brg s VAL 36 Ca 0.57 -2.32 0.13 0.00 0.00 0.00 0.00 61.98 60.37 1brg s VAL 36 Cb -0.26 -2.81 0.33 0.00 0.00 0.00 0.00 36.38 33.64 1brg s VAL 36 CO 0.22 -0.62 1.66 0.00 0.00 0.00 0.00 175.10 176.36 1brg h ALA 37 N 7.67 1.85 0.00 5.51 0.00 -2.00 0.78 119.26 133.07 1brg h ALA 37 Ca -0.06 0.20 0.00 0.00 0.00 0.00 0.00 54.91 55.05 1brg h ALA 37 Cb 1.02 0.19 0.00 0.00 0.00 0.00 0.00 17.79 19.00 1brg h ALA 37 CO 0.56 -0.57 0.00 0.43 0.00 0.00 0.00 179.25 179.67 1brg n SER 38 N -5.09 0.54 -0.49 0.00 7.64 -1.26 -2.91 113.62 112.05 1brg n SER 38 Ca 0.30 0.60 0.06 0.00 1.01 0.00 0.00 58.87 60.84 1brg n SER 38 Cb 0.95 -0.72 0.06 0.00 -1.01 0.00 0.00 64.21 63.49 1brg n SER 38 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 1brg n LYS 39 N -2.06 0.93 -4.04 1.43 4.01 0.26 -5.02 118.16 113.68 1brg n LYS 39 Ca 0.04 -1.32 -0.29 0.00 -0.51 0.00 0.00 58.31 56.23 1brg n LYS 39 Cb 0.29 -1.23 -0.02 0.00 -0.51 0.00 0.00 35.03 33.56 1brg n LYS 39 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 1brg n GLY 40 N 0.64 -0.30 1.14 0.72 0.00 -1.15 -4.90 105.19 101.36 1brg n GLY 40 Ca 0.08 0.15 0.11 0.00 0.00 0.00 0.00 46.02 46.35 1brg n GLY 40 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1brg n ASN 41 N -2.88 3.54 -0.31 1.61 6.94 -1.26 -4.01 115.26 118.90 1brg n ASN 41 Ca -0.18 -1.97 0.15 0.00 -0.02 0.00 0.00 54.58 52.55 1brg n ASN 41 Cb 0.62 -0.34 0.32 0.00 -2.36 0.00 0.00 39.78 38.03 1brg n ASN 41 CO 0.00 0.00 0.00 0.25 -1.03 0.00 0.00 177.26 176.48 1brg h LEU 42 N 3.97 0.20 -1.34 -4.53 5.85 -1.88 -0.59 115.31 116.97 1brg h LEU 42 Ca 0.00 0.18 -0.05 0.00 0.84 0.00 0.00 57.88 58.85 1brg h LEU 42 Cb 0.93 0.20 -0.01 0.00 0.37 0.00 0.00 40.66 42.15 1brg h LEU 42 CO 0.00 -0.10 -0.23 0.00 -0.34 0.00 0.00 178.44 177.78 1brg h ALA 43 N 1.76 1.11 0.02 1.25 0.00 -1.84 0.28 119.26 121.85 1brg h ALA 43 Ca 0.58 -0.20 -0.22 0.00 0.00 0.00 0.00 54.91 55.07 1brg h ALA 43 Cb 1.18 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.91 1brg h ALA 43 CO -0.60 0.28 -1.02 -0.44 0.00 0.00 0.00 179.25 177.47 1brg h ASP 44 N 0.00 0.09 0.21 0.00 3.32 -1.47 -3.04 116.42 115.53 1brg h ASP 44 Ca -0.00 -0.10 -0.30 0.00 0.02 0.00 0.00 57.03 56.66 1brg h ASP 44 Cb 0.64 -0.03 -0.05 0.00 0.22 0.00 0.00 39.33 40.10 1brg h ASP 44 CO 0.03 1.05 -2.06 1.33 -1.72 0.00 0.00 179.24 177.87 1brg n VAL 45 N -3.42 1.32 -3.18 -1.35 0.24 -1.00 -4.71 118.33 106.22 1brg n VAL 45 Ca -0.02 -0.79 -0.22 0.00 -2.04 0.00 0.00 64.34 61.27 1brg n VAL 45 Cb 0.93 -0.61 -0.05 0.00 -1.47 0.00 0.00 33.84 32.64 1brg n VAL 45 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1brg n ALA 46 N -2.62 2.61 -1.62 2.33 0.00 0.96 -4.92 120.51 117.25 1brg n ALA 46 Ca -0.24 -3.65 -0.47 0.00 0.00 0.00 0.00 53.44 49.08 1brg n ALA 46 Cb 1.05 -0.86 -0.03 0.00 0.00 0.00 0.00 19.45 19.60 1brg n ALA 46 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1brg n PRO 47 N 0.66 1.59 -0.61 0.00 -0.04 -1.15 -1.41 135.00 134.05 1brg n PRO 47 Ca 0.25 0.57 0.00 0.00 -0.04 0.00 0.00 63.50 64.27 1brg n PRO 47 Cb 0.56 -2.14 0.00 0.00 -0.04 0.00 0.00 33.50 31.89 1brg n PRO 47 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1brg n GLY 48 N 2.07 1.13 3.89 0.55 0.00 -1.26 -5.01 105.19 106.56 1brg n GLY 48 Ca 0.13 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.84 1brg n GLY 48 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1brg s LYS 49 N -0.20 3.72 0.11 1.61 3.01 -0.50 -4.84 119.74 122.65 1brg s LYS 49 Ca 0.00 0.14 0.07 0.00 -1.01 0.00 0.00 55.97 55.16 1brg s LYS 49 Cb 0.00 -2.68 -0.04 0.00 -1.01 0.00 0.00 37.83 34.10 1brg s LYS 49 CO 0.00 0.32 -0.17 -1.12 0.51 0.00 0.00 175.35 174.89 1brg s SER 50 N -2.58 2.17 0.08 2.83 0.01 0.11 -4.88 113.70 111.43 1brg s SER 50 Ca 0.45 -0.74 -0.30 0.00 1.31 0.00 0.00 55.95 56.67 1brg s SER 50 Cb -0.11 -0.10 -0.05 0.00 0.21 0.00 0.00 66.02 65.97 1brg s SER 50 CO 0.24 -0.06 1.11 -0.63 0.41 0.00 0.00 173.24 174.31 1brg s ILE 51 N -1.66 4.24 -0.24 1.44 -1.09 -1.26 -1.78 121.20 120.85 1brg s ILE 51 Ca 0.07 1.68 -0.29 0.00 -2.23 0.00 0.00 60.65 59.88 1brg s ILE 51 Cb -0.08 -4.08 0.17 0.00 -1.58 0.00 0.00 42.46 36.89 1brg s ILE 51 CO 0.04 0.17 1.22 -0.83 -1.23 0.00 0.00 174.94 174.32 1brg s GLY 52 N 0.72 -0.02 0.00 6.18 0.00 -0.47 0.11 107.32 113.84 1brg s GLY 52 Ca 0.54 2.60 0.00 0.00 0.00 0.00 0.00 44.72 47.87 1brg s GLY 52 CO 0.30 1.18 0.00 0.61 0.00 0.00 0.00 173.10 175.19 1brg n GLY 53 N 0.76 0.73 3.86 0.20 0.00 0.62 -3.46 105.19 107.89 1brg n GLY 53 Ca -0.05 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.65 1brg n GLY 53 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1brg s ASP 54 N -1.67 6.65 0.29 1.61 1.01 -1.24 -4.83 116.67 118.48 1brg s ASP 54 Ca 0.00 1.31 -0.30 0.00 0.71 0.00 0.00 52.55 54.27 1brg s ASP 54 Cb 0.00 -2.39 -0.11 0.00 1.01 0.00 0.00 42.92 41.43 1brg s ASP 54 CO 0.00 -0.38 1.55 -0.63 0.21 0.00 0.00 175.17 175.92 1brg s ILE 55 N -2.30 2.20 -0.21 0.77 -1.09 -1.26 -2.37 121.20 116.93 1brg s ILE 55 Ca 0.55 0.17 -0.06 0.00 -2.23 0.00 0.00 60.65 59.07 1brg s ILE 55 Cb -0.10 -3.11 -0.03 0.00 -1.58 0.00 0.00 42.46 37.64 1brg s ILE 55 CO 0.26 0.03 0.04 0.12 -1.23 0.00 0.00 174.94 174.16 1brg s PHE 56 N -0.07 3.11 0.15 3.97 5.36 -0.34 -4.88 117.98 125.29 1brg s PHE 56 Ca 0.62 -0.27 0.15 0.00 -0.96 0.00 0.00 56.93 56.47 1brg s PHE 56 Cb -0.46 -2.13 0.44 0.00 -0.34 0.00 0.00 43.02 40.52 1brg s PHE 56 CO 0.48 -0.15 1.62 0.66 -1.46 0.00 0.00 175.22 176.37 1brg h SER 57 N 7.46 0.00 -5.45 6.13 4.64 -1.95 -3.39 113.55 121.00 1brg h SER 57 Ca -0.36 0.00 -0.14 0.00 -0.47 0.00 0.00 61.79 60.82 1brg h SER 57 Cb 1.18 0.00 0.10 0.00 -0.31 0.00 0.00 62.40 63.36 1brg h SER 57 CO 0.62 0.51 -0.45 -3.20 -0.87 0.00 0.00 176.83 173.45 1brg n ASN 58 N -3.55 -7.16 -0.00 4.97 5.15 -1.26 -4.90 115.26 108.51 1brg n ASN 58 Ca -0.00 -0.41 -0.15 0.00 -0.60 0.00 0.00 54.58 53.42 1brg n ASN 58 Cb 0.60 -5.17 -0.04 0.00 -0.53 0.00 0.00 39.78 34.64 1brg n ASN 58 CO 0.00 0.00 0.00 0.03 1.40 0.00 0.00 177.26 178.69 1brg h ARG 59 N -0.34 0.69 -0.76 1.20 -0.00 -2.00 -3.26 114.38 109.92 1brg h ARG 59 Ca -0.31 -0.56 -0.09 0.00 -0.50 0.00 0.00 59.98 58.52 1brg h ARG 59 Cb 1.16 0.12 -0.05 0.00 0.00 0.00 0.00 29.97 31.20 1brg h ARG 59 CO 0.37 1.17 0.11 0.39 0.00 0.00 0.00 179.97 182.02 1brg n GLU 60 N -3.91 3.47 -0.90 0.04 1.02 -1.26 -4.90 120.64 114.20 1brg n GLU 60 Ca -0.06 -2.32 -0.04 0.00 -0.02 0.00 0.00 57.16 54.72 1brg n GLU 60 Cb 0.73 -2.03 -0.02 0.00 -0.02 0.00 0.00 31.44 30.11 1brg n GLU 60 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1brg n GLY 61 N 0.20 0.35 0.30 0.62 0.00 -1.23 -4.85 105.19 100.58 1brg n GLY 61 Ca 0.26 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.39 1brg n GLY 61 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1brg h LYS 62 N 0.00 0.06 -5.84 1.61 1.57 -1.90 -3.42 116.57 108.65 1brg h LYS 62 Ca -0.07 -0.00 -0.64 0.00 -1.87 0.00 0.00 60.65 58.06 1brg h LYS 62 Cb 0.79 -0.01 -0.06 0.00 0.08 0.00 0.00 32.23 33.03 1brg h LYS 62 CO 0.11 0.04 -0.51 -0.51 -0.57 0.00 0.00 179.45 178.01 1brg s LEU 63 N -9.02 4.28 0.04 2.94 1.43 -1.26 -5.02 118.68 112.06 1brg s LEU 63 Ca -0.05 0.31 -0.30 0.00 -1.03 0.00 0.00 54.13 53.06 1brg s LEU 63 Cb 0.18 -2.53 -0.08 0.00 0.03 0.00 0.00 46.19 43.79 1brg s LEU 63 CO 0.70 0.27 1.85 -2.16 0.23 0.00 0.00 176.35 177.24 1brg s PRO 64 N -1.86 4.15 0.47 1.29 0.04 -1.26 -4.97 135.00 132.86 1brg s PRO 64 Ca 0.26 2.49 -0.10 0.00 0.04 0.00 0.00 61.00 63.69 1brg s PRO 64 Cb -0.12 -3.98 -0.06 0.00 0.04 0.00 0.00 34.50 30.38 1brg s PRO 64 CO 0.17 -0.89 0.85 0.20 0.04 0.00 0.00 177.00 177.37 1brg s GLY 65 N 3.72 1.82 -0.27 0.56 0.00 -1.26 -5.06 107.32 106.83 1brg s GLY 65 Ca 0.83 -0.18 -0.26 0.00 0.00 0.00 0.00 44.72 45.10 1brg s GLY 65 CO 0.37 0.03 1.15 1.25 0.00 0.00 0.00 173.10 175.90 1brg s LYS 66 N -4.29 0.38 -0.03 2.90 2.20 -1.26 -5.08 119.74 114.56 1brg s LYS 66 Ca 0.52 0.36 -0.30 0.00 -0.36 0.00 0.00 55.97 56.19 1brg s LYS 66 Cb -0.10 0.18 -0.04 0.00 -1.51 0.00 0.00 37.83 36.36 1brg s LYS 66 CO 0.38 -0.06 1.15 0.45 -0.36 0.00 0.00 175.35 176.91 1brg s SER 67 N -0.09 7.12 0.00 1.43 0.15 -1.26 -1.77 113.70 119.27 1brg s SER 67 Ca 0.04 1.81 0.00 0.00 0.70 0.00 0.00 55.95 58.50 1brg s SER 67 Cb -0.04 -2.56 0.00 0.00 -1.71 0.00 0.00 66.02 61.70 1brg s SER 67 CO -0.08 -0.50 0.00 0.61 1.20 0.00 0.00 173.24 174.47 1brg n GLY 68 N 3.24 3.40 3.67 9.45 0.00 -1.26 -5.05 105.19 118.65 1brg n GLY 68 Ca 0.10 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.71 1brg n GLY 68 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1brg s ARG 69 N -0.90 4.27 0.01 1.61 3.52 -0.73 -4.94 118.95 121.78 1brg s ARG 69 Ca 0.00 0.74 0.07 0.00 -0.13 0.00 0.00 55.73 56.41 1brg s ARG 69 Cb 0.00 -3.55 -0.03 0.00 -1.56 0.00 0.00 34.95 29.81 1brg s ARG 69 CO 0.00 -0.21 -0.19 0.95 -0.81 0.00 0.00 175.30 175.04 1brg s THR 70 N 1.78 2.65 -0.09 4.11 -4.23 -1.26 -4.74 115.64 113.86 1brg s THR 70 Ca 0.32 -1.07 -0.02 0.00 -1.18 0.00 0.00 61.69 59.74 1brg s THR 70 Cb -0.16 -2.05 -0.03 0.00 1.34 0.00 0.00 72.50 71.59 1brg s THR 70 CO 0.12 0.45 -0.01 0.26 -0.54 0.00 0.00 174.62 174.90 1brg s TRP 71 N -0.80 3.13 0.13 3.99 0.52 -1.26 -0.64 118.94 124.01 1brg s TRP 71 Ca 0.13 0.13 0.05 0.00 0.02 0.00 0.00 56.10 56.42 1brg s TRP 71 Cb -0.10 -1.81 -0.04 0.00 -1.15 0.00 0.00 33.47 30.37 1brg s TRP 71 CO 0.02 0.40 -0.11 1.03 0.02 0.00 0.00 176.95 178.31 1brg s ARG 72 N -0.72 1.02 0.16 4.98 0.52 0.25 -1.19 118.95 123.97 1brg s ARG 72 Ca 0.11 -1.36 0.05 0.00 -0.52 0.00 0.00 55.73 54.01 1brg s ARG 72 Cb -0.12 -0.65 -0.05 0.00 0.52 0.00 0.00 34.95 34.66 1brg s ARG 72 CO 0.02 0.09 -0.11 -1.83 0.02 0.00 0.00 175.30 173.50 1brg s GLU 73 N -3.40 1.13 -0.07 3.54 -1.05 -1.00 0.14 118.70 117.99 1brg s GLU 73 Ca 0.13 -1.49 -0.15 0.00 -0.15 0.00 0.00 54.97 53.32 1brg s GLU 73 Cb 0.00 -0.73 0.03 0.00 -0.44 0.00 0.00 34.13 32.99 1brg s GLU 73 CO 0.01 0.09 0.35 0.00 0.95 0.00 0.00 175.26 176.67 1brg s ALA 74 N -3.25 -0.89 0.50 -0.84 0.00 -0.91 -0.28 121.76 116.09 1brg s ALA 74 Ca 0.18 0.68 -0.19 0.00 0.00 0.00 0.00 51.96 52.64 1brg s ALA 74 Cb 0.02 -0.22 -0.08 0.00 0.00 0.00 0.00 23.12 22.83 1brg s ALA 74 CO 0.02 -0.23 1.02 -0.51 0.00 0.00 0.00 175.76 176.06 1brg s ASP 75 N -0.66 6.41 0.01 0.00 1.11 0.31 -1.62 116.67 122.23 1brg s ASP 75 Ca -0.08 1.81 0.07 0.00 0.18 0.00 0.00 52.55 54.53 1brg s ASP 75 Cb -0.04 -2.54 -0.02 0.00 1.07 0.00 0.00 42.92 41.39 1brg s ASP 75 CO 0.03 -0.73 -0.21 -0.63 1.18 0.00 0.00 175.17 174.81 1brg s ILE 76 N -2.19 1.64 -1.11 0.77 -1.09 -0.40 -4.76 121.20 114.06 1brg s ILE 76 Ca 0.64 -1.02 -0.04 0.00 -2.23 0.00 0.00 60.65 58.00 1brg s ILE 76 Cb -0.14 -1.39 0.00 0.00 -1.58 0.00 0.00 42.46 39.36 1brg s ILE 76 CO 0.23 0.34 0.53 0.59 -1.23 0.00 0.00 174.94 175.40 1brg n ASN 77 N 2.24 -4.97 -4.74 3.58 3.02 -0.95 -4.68 115.26 108.76 1brg n ASN 77 Ca -0.16 -0.25 -0.38 0.00 -0.03 0.00 0.00 54.58 53.76 1brg n ASN 77 Cb 0.53 -3.77 -0.06 0.00 -0.61 0.00 0.00 39.78 35.87 1brg n ASN 77 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 1brg s TYR 78 N -3.05 3.56 0.00 3.10 5.04 -1.26 -4.92 117.35 119.82 1brg s TYR 78 Ca 0.26 0.96 0.00 0.00 -2.44 0.00 0.00 57.07 55.85 1brg s TYR 78 Cb -0.12 -2.54 0.00 0.00 0.35 0.00 0.00 41.96 39.66 1brg s TYR 78 CO 0.33 0.24 0.00 0.25 -1.34 0.00 0.00 175.55 175.03 1brg n THR 79 N 3.34 0.00 -3.69 4.34 -2.24 -1.26 -4.89 114.28 109.88 1brg n THR 79 Ca -0.08 0.00 -0.01 0.00 -2.27 0.00 0.00 64.05 61.69 1brg n THR 79 Cb 0.52 -0.62 -0.01 0.00 -2.10 0.00 0.00 70.33 68.11 1brg n THR 79 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1brg s SER 80 N -4.22 -0.12 0.00 3.42 1.04 -1.26 -4.80 113.70 107.76 1brg s SER 80 Ca 0.00 -0.27 0.00 0.00 0.48 0.00 0.00 55.95 56.16 1brg s SER 80 Cb 0.00 0.33 0.00 0.00 0.10 0.00 0.00 66.02 66.45 1brg s SER 80 CO 0.00 -0.60 0.00 0.61 0.98 0.00 0.00 173.24 174.23 1brg n GLY 81 N -0.48 -1.46 3.76 7.32 0.00 -1.26 -4.90 105.19 108.18 1brg n GLY 81 Ca -0.07 -1.40 -0.34 0.00 0.00 0.00 0.00 46.02 44.20 1brg n GLY 81 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1brg s PHE 82 N 0.00 2.49 0.74 1.61 0.08 -1.26 -4.53 117.98 117.11 1brg s PHE 82 Ca 0.00 1.55 -0.13 0.00 0.12 0.00 0.00 56.93 58.47 1brg s PHE 82 Cb 0.00 -3.30 0.04 0.00 -0.57 0.00 0.00 43.02 39.20 1brg s PHE 82 CO 0.00 -1.90 1.14 1.03 -0.10 0.00 0.00 175.22 175.38 1brg s ARG 83 N -3.76 2.26 0.00 0.44 0.52 -1.26 -5.02 118.95 112.12 1brg s ARG 83 Ca 0.71 1.47 0.00 0.00 -0.52 0.00 0.00 55.73 57.39 1brg s ARG 83 Cb -0.24 -1.88 0.00 0.00 0.52 0.00 0.00 34.95 33.35 1brg s ARG 83 CO 0.38 -1.68 0.00 0.27 0.02 0.00 0.00 175.30 174.28 1brg n ASN 84 N -2.98 0.00 -0.95 0.23 0.23 -1.26 -5.06 115.26 105.47 1brg n ASN 84 Ca 0.11 -0.86 0.11 0.00 -0.53 0.00 0.00 54.58 53.40 1brg n ASN 84 Cb 0.52 0.00 0.14 0.00 -2.08 0.00 0.00 39.78 38.36 1brg n ASN 84 CO 0.00 0.00 0.00 -1.54 -0.93 0.00 0.00 177.26 174.79 1brg n SER 85 N -2.59 3.04 -4.69 0.53 3.41 -1.26 -4.96 113.62 107.09 1brg n SER 85 Ca 0.00 -1.92 -0.37 0.00 -0.26 0.00 0.00 58.87 56.32 1brg n SER 85 Cb 0.00 -0.12 -0.08 0.00 -0.26 0.00 0.00 64.21 63.76 1brg n SER 85 CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 1brg s ASP 86 N -1.58 6.35 0.08 4.04 1.01 -1.26 -2.15 116.67 123.16 1brg s ASP 86 Ca 0.30 0.41 -0.02 0.00 0.71 0.00 0.00 52.55 53.95 1brg s ASP 86 Cb 0.19 -2.18 -0.04 0.00 1.01 0.00 0.00 42.92 41.90 1brg s ASP 86 CO 0.28 0.03 0.02 -0.13 0.21 0.00 0.00 175.17 175.57 1brg s ARG 87 N 0.93 0.74 -0.13 8.23 1.81 -0.65 -1.27 118.95 128.61 1brg s ARG 87 Ca 0.15 -1.27 0.02 0.00 -1.72 0.00 0.00 55.73 52.90 1brg s ARG 87 Cb -0.14 0.23 -0.00 0.00 -0.45 0.00 0.00 34.95 34.59 1brg s ARG 87 CO 0.05 -0.17 -0.18 -1.50 -0.68 0.00 0.00 175.30 172.82 1brg s ILE 88 N -3.96 2.53 -0.16 1.52 2.07 -0.64 -2.24 121.20 120.32 1brg s ILE 88 Ca 0.13 -0.84 -0.00 0.00 -1.41 0.00 0.00 60.65 58.52 1brg s ILE 88 Cb 0.08 -2.03 -0.00 0.00 0.13 0.00 0.00 42.46 40.63 1brg s ILE 88 CO -0.06 0.54 -0.14 -0.76 -1.91 0.00 0.00 174.94 172.61 1brg s LEU 89 N 0.51 2.55 0.00 8.50 1.02 0.39 -2.13 118.68 129.52 1brg s LEU 89 Ca -0.12 -0.45 0.02 0.00 0.02 0.00 0.00 54.13 53.60 1brg s LEU 89 Cb -0.16 -1.59 -0.01 0.00 0.02 0.00 0.00 46.19 44.45 1brg s LEU 89 CO 0.05 0.08 -0.06 -0.72 0.02 0.00 0.00 176.35 175.71 1brg s TYR 90 N 0.87 0.53 0.26 0.29 1.13 0.12 -0.25 117.35 120.31 1brg s TYR 90 Ca -0.04 -0.15 0.03 0.00 -1.41 0.00 0.00 57.07 55.50 1brg s TYR 90 Cb -0.15 -0.34 -0.03 0.00 -1.10 0.00 0.00 41.96 40.34 1brg s TYR 90 CO -0.01 -0.02 0.41 -1.54 -2.51 0.00 0.00 175.55 171.88 1brg s SER 91 N -0.33 6.32 0.57 -0.18 1.04 -0.95 0.85 113.70 121.02 1brg s SER 91 Ca 0.01 0.20 0.27 0.00 0.48 0.00 0.00 55.95 56.91 1brg s SER 91 Cb -0.03 -1.92 1.55 0.00 0.10 0.00 0.00 66.02 65.72 1brg s SER 91 CO -0.00 -0.12 2.07 0.77 0.98 0.00 0.00 173.24 176.94 1brg h SER 92 N 1.20 0.00 -0.44 7.02 4.64 -1.24 0.61 113.55 125.35 1brg h SER 92 Ca -0.51 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.81 1brg h SER 92 Cb 1.22 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.31 1brg h SER 92 CO 0.62 0.00 0.00 -0.90 -0.87 0.00 0.00 176.83 175.68 1brg n ASP 93 N -4.00 4.64 -3.22 4.97 5.75 -1.26 -4.96 116.55 118.47 1brg n ASP 93 Ca 0.03 -2.84 -0.20 0.00 -0.01 0.00 0.00 54.79 51.76 1brg n ASP 93 Cb 0.38 -0.58 0.07 0.00 -1.03 0.00 0.00 41.12 39.96 1brg n ASP 93 CO 0.00 0.00 0.00 0.79 -0.11 0.00 0.00 177.20 177.88 1brg n TRP 94 N 0.20 -2.48 -3.43 2.11 7.02 0.21 -5.01 117.44 116.06 1brg n TRP 94 Ca 0.24 0.89 -0.37 0.00 -1.02 0.00 0.00 57.50 57.23 1brg n TRP 94 Cb 0.98 -4.58 -0.06 0.00 -2.42 0.00 0.00 31.31 25.22 1brg n TRP 94 CO 0.00 0.00 0.00 -0.51 -2.02 0.00 0.00 177.69 175.16 1brg s LEU 95 N -6.48 4.31 -0.17 -0.99 1.43 -1.26 -4.90 118.68 110.62 1brg s LEU 95 Ca 0.46 0.75 -0.02 0.00 -1.03 0.00 0.00 54.13 54.29 1brg s LEU 95 Cb -0.20 -2.57 -0.01 0.00 0.03 0.00 0.00 46.19 43.44 1brg s LEU 95 CO 0.64 0.10 -0.09 -0.63 0.23 0.00 0.00 176.35 176.60 1brg s ILE 96 N 0.21 3.19 0.24 -0.59 -1.09 -0.84 -2.23 121.20 120.09 1brg s ILE 96 Ca 0.22 -0.58 0.07 0.00 -2.23 0.00 0.00 60.65 58.13 1brg s ILE 96 Cb -0.15 -2.39 -0.05 0.00 -1.58 0.00 0.00 42.46 38.29 1brg s ILE 96 CO 0.09 0.48 -0.09 -0.31 -1.23 0.00 0.00 174.94 173.88 1brg s TYR 97 N 0.88 1.82 0.08 3.97 1.51 0.66 -0.94 117.35 125.33 1brg s TYR 97 Ca -0.02 -0.66 0.06 0.00 -1.01 0.00 0.00 57.07 55.43 1brg s TYR 97 Cb -0.15 -0.96 -0.03 0.00 -0.11 0.00 0.00 41.96 40.71 1brg s TYR 97 CO 0.00 0.29 -0.16 -1.59 -1.11 0.00 0.00 175.55 172.99 1brg s LYS 98 N -3.70 0.89 0.00 -0.62 -2.85 0.16 -0.46 119.74 113.16 1brg s LYS 98 Ca 0.26 -1.01 0.05 0.00 -1.00 0.00 0.00 55.97 54.27 1brg s LYS 98 Cb 0.02 -0.95 -0.01 0.00 -2.06 0.00 0.00 37.83 34.82 1brg s LYS 98 CO 0.10 0.21 -0.15 -0.08 0.10 0.00 0.00 175.35 175.53 1brg s THR 99 N -1.27 1.16 0.00 3.79 -1.32 -0.95 -1.81 115.64 115.23 1brg s THR 99 Ca 0.00 -0.74 0.00 0.00 -1.21 0.00 0.00 61.69 59.74 1brg s THR 99 Cb -0.10 -0.99 0.00 0.00 -1.51 0.00 0.00 72.50 69.90 1brg s THR 99 CO 0.03 0.23 0.51 0.35 -2.21 0.00 0.00 174.62 173.53 1brg n THR 100 N 2.47 0.25 -2.31 5.08 -2.24 -1.26 -1.64 114.28 114.63 1brg n THR 100 Ca -0.15 -0.42 -0.03 0.00 -2.27 0.00 0.00 64.05 61.18 1brg n THR 100 Cb 0.55 1.11 0.07 0.00 -2.10 0.00 0.00 70.33 69.95 1brg n THR 100 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 1brg n ASP 101 N -0.13 2.16 -3.20 3.42 5.75 -1.20 -4.46 116.55 118.89 1brg n ASP 101 Ca 0.00 -2.77 -0.14 0.00 -0.01 0.00 0.00 54.79 51.87 1brg n ASP 101 Cb 0.22 -0.41 0.06 0.00 -1.03 0.00 0.00 41.12 39.96 1brg n ASP 101 CO 0.00 0.00 0.00 1.41 -0.11 0.00 0.00 177.20 178.50 1brg n HIS 102 N -0.42 -2.46 -1.39 2.11 8.25 -0.92 -3.30 115.22 117.11 1brg n HIS 102 Ca 0.17 0.86 -0.14 0.00 -0.26 0.00 0.00 57.72 58.35 1brg n HIS 102 Cb 0.91 -4.10 -0.06 0.00 1.12 0.00 0.00 29.99 27.86 1brg n HIS 102 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 1brg n TYR 103 N -3.11 -0.16 0.09 4.41 4.02 -1.26 -4.89 117.16 116.27 1brg n TYR 103 Ca -0.06 0.00 -0.08 0.00 -0.01 0.00 0.00 57.90 57.75 1brg n TYR 103 Cb 0.61 -2.83 -0.05 0.00 -0.02 0.00 0.00 39.34 37.06 1brg n TYR 103 CO 0.00 0.00 0.00 1.96 -1.01 0.00 0.00 176.86 177.81 1brg h GLN 104 N 0.00 -0.31 -6.80 -0.72 4.20 -1.96 -3.46 115.11 106.06 1brg h GLN 104 Ca -0.29 0.02 -0.69 0.00 0.06 0.00 0.00 58.65 57.75 1brg h GLN 104 Cb 1.07 0.07 -0.23 0.00 0.30 0.00 0.00 27.48 28.69 1brg h GLN 104 CO 0.43 -0.07 -0.86 0.99 -0.67 0.00 0.00 178.83 178.66 1brg s THR 105 N -2.97 2.33 -0.01 -0.54 2.01 -1.26 -5.11 115.64 110.10 1brg s THR 105 Ca -0.08 -1.55 0.03 0.00 0.31 0.00 0.00 61.69 60.40 1brg s THR 105 Cb 0.00 -1.99 -0.01 0.00 0.01 0.00 0.00 72.50 70.52 1brg s THR 105 CO 0.28 0.21 -0.09 -0.36 -0.69 0.00 0.00 174.62 173.97 1brg s PHE 106 N -0.97 0.83 -0.04 4.92 0.40 -1.26 -4.40 117.98 117.47 1brg s PHE 106 Ca 0.14 -0.16 -0.02 0.00 -0.60 0.00 0.00 56.93 56.28 1brg s PHE 106 Cb -0.10 -0.54 0.02 0.00 0.51 0.00 0.00 43.02 42.91 1brg s PHE 106 CO 0.05 -0.01 0.08 0.95 0.70 0.00 0.00 175.22 176.99 1brg s THR 107 N -0.23 -0.02 0.28 0.64 -4.23 -0.75 -4.96 115.64 106.37 1brg s THR 107 Ca 0.03 0.09 -0.29 0.00 -1.18 0.00 0.00 61.69 60.34 1brg s THR 107 Cb -0.04 -0.14 -0.10 0.00 1.34 0.00 0.00 72.50 73.57 1brg s THR 107 CO -0.00 0.04 1.35 -0.75 -0.54 0.00 0.00 174.62 174.71 1brg s LYS 108 N 0.52 4.34 0.00 3.99 2.20 -1.26 0.35 119.74 129.87 1brg s LYS 108 Ca -0.04 2.21 0.00 0.00 -0.36 0.00 0.00 55.97 57.78 1brg s LYS 108 Cb -0.06 -3.11 0.00 0.00 -1.51 0.00 0.00 37.83 33.16 1brg s LYS 108 CO -0.02 -0.27 0.00 0.44 -0.36 0.00 0.00 175.35 175.14 1brg n ILE 109 N 1.66 0.00 -1.94 5.43 -5.35 -0.12 -4.87 119.36 114.17 1brg n ILE 109 Ca 0.03 -0.22 0.00 0.00 -0.27 0.00 0.00 62.75 62.29 1brg n ILE 109 Cb 0.41 0.78 0.00 0.00 -1.74 0.00 0.00 39.64 39.09 1brg n ILE 109 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33