#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2hf5 s GLU 47 N 0.00 4.64 0.00 0.00 2.02 -1.26 -4.93 118.70 119.17 2hf5 s GLU 47 Ca 0.00 1.33 0.09 0.00 0.02 0.00 0.00 54.97 56.41 2hf5 s GLU 47 Cb 0.00 -3.36 0.50 0.00 0.10 0.00 0.00 34.13 31.37 2hf5 s GLU 47 CO 0.00 0.26 1.11 1.28 0.02 0.00 0.00 175.26 177.93 2hf5 n LEU 48 N 2.69 0.00 0.01 1.80 7.99 -1.26 -2.79 117.00 125.44 2hf5 n LEU 48 Ca 0.00 0.17 -0.10 0.00 -0.01 0.00 0.00 56.01 56.07 2hf5 n LEU 48 Cb 0.49 -0.17 -0.05 0.00 -0.11 0.00 0.00 43.42 43.59 2hf5 n LEU 48 CO 0.50 -0.12 0.83 -0.61 -1.51 0.00 0.00 177.39 176.48 2hf5 h GLN 49 N 0.00 -0.05 -0.32 3.23 4.15 -1.96 0.20 115.11 120.35 2hf5 h GLN 49 Ca 0.00 0.00 -0.05 0.00 0.77 0.00 0.00 58.65 59.37 2hf5 h GLN 49 Cb 0.05 0.01 -0.02 0.00 0.21 0.00 0.00 27.48 27.74 2hf5 h GLN 49 CO 0.00 -0.03 -0.01 0.22 -1.93 0.00 0.00 178.83 177.08 2hf5 h ASP 50 N -0.05 0.47 0.24 -0.69 3.58 -1.94 -1.46 116.42 116.56 2hf5 h ASP 50 Ca 0.05 -0.09 -0.07 0.00 0.42 0.00 0.00 57.03 57.34 2hf5 h ASP 50 Cb 0.13 -0.12 -0.01 0.00 1.72 0.00 0.00 39.33 41.04 2hf5 h ASP 50 CO -0.12 0.54 -0.29 -0.03 -2.88 0.00 0.00 179.24 176.46 2hf5 h MET 51 N 0.48 0.10 -0.41 0.28 4.05 -1.51 -1.19 114.93 116.73 2hf5 h MET 51 Ca 0.10 -0.03 -0.02 0.00 -0.28 0.00 0.00 59.70 59.47 2hf5 h MET 51 Cb 0.33 -0.01 -0.02 0.00 -0.80 0.00 0.00 31.60 31.10 2hf5 h MET 51 CO 0.01 0.39 0.16 0.82 0.23 0.00 0.00 176.91 178.52 2hf5 h ILE 52 N 0.09 1.20 0.00 1.77 2.04 0.43 -0.07 117.51 122.97 2hf5 h ILE 52 Ca 0.01 -0.61 -0.04 0.00 1.00 0.00 0.00 64.86 65.22 2hf5 h ILE 52 Cb 0.57 0.84 -0.01 0.00 -0.74 0.00 0.00 36.82 37.49 2hf5 h ILE 52 CO 0.04 0.22 -0.18 0.78 0.00 0.00 0.00 178.15 179.02 2hf5 h ASN 53 N 0.51 0.00 0.14 1.72 -0.26 -0.87 0.15 115.58 116.98 2hf5 h ASN 53 Ca 0.13 0.00 -0.32 0.00 -0.56 0.00 0.00 56.30 55.55 2hf5 h ASN 53 Cb 0.19 0.00 -0.00 0.00 -1.06 0.00 0.00 38.32 37.45 2hf5 h ASN 53 CO -0.01 0.18 -1.64 -0.33 -1.06 0.00 0.00 177.43 174.56 2hf5 h GLU 54 N 0.00 0.30 0.03 0.81 4.39 -0.98 -3.40 114.58 115.74 2hf5 h GLU 54 Ca -0.00 -0.52 -0.30 0.00 0.34 0.00 0.00 59.36 58.88 2hf5 h GLU 54 Cb 0.48 0.19 -0.04 0.00 -0.10 0.00 0.00 28.75 29.28 2hf5 h GLU 54 CO 0.02 1.25 -1.67 0.28 -1.16 0.00 0.00 179.01 177.73 2hf5 h VAL 55 N -0.10 0.92 -2.49 3.13 2.07 -0.83 -3.45 116.25 115.51 2hf5 h VAL 55 Ca -0.34 -2.72 -0.53 0.00 0.82 0.00 0.00 66.70 63.93 2hf5 h VAL 55 Cb 1.93 2.51 0.04 0.00 -1.52 0.00 0.00 31.29 34.25 2hf5 h VAL 55 CO 0.10 0.63 1.14 -0.67 0.02 0.00 0.00 177.57 178.79 2hf5 n ASP 56 N -3.19 4.10 -0.07 0.57 2.03 0.51 -4.87 116.55 115.64 2hf5 n ASP 56 Ca -0.18 0.97 -0.09 0.00 0.52 0.00 0.00 54.79 56.02 2hf5 n ASP 56 Cb 1.04 -1.55 -0.15 0.00 -0.72 0.00 0.00 41.12 39.74 2hf5 n ASP 56 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2hf5 n ALA 57 N 5.92 1.51 0.23 -1.67 0.00 -1.26 -4.41 120.51 120.83 2hf5 n ALA 57 Ca 0.18 -1.12 0.03 0.00 0.00 0.00 0.00 53.44 52.53 2hf5 n ALA 57 Cb 0.38 -0.43 -0.05 0.00 0.00 0.00 0.00 19.45 19.36 2hf5 n ALA 57 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 2hf5 n ASP 58 N -2.85 1.27 0.00 0.00 5.75 -1.26 -5.01 116.55 114.45 2hf5 n ASP 58 Ca -0.27 -0.46 0.00 0.00 -0.01 0.00 0.00 54.79 54.05 2hf5 n ASP 58 Cb 1.11 1.10 0.00 0.00 -1.03 0.00 0.00 41.12 42.31 2hf5 n ASP 58 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2hf5 n GLY 59 N 1.45 0.44 0.00 6.12 0.00 -1.26 -4.92 105.19 107.02 2hf5 n GLY 59 Ca 0.00 -0.99 0.15 0.00 0.00 0.00 0.00 46.02 45.18 2hf5 n GLY 59 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2hf5 n ASN 60 N 1.81 0.00 0.00 1.61 6.94 -1.26 -4.87 115.26 119.49 2hf5 n ASN 60 Ca 0.00 -0.64 0.00 0.00 -0.02 0.00 0.00 54.58 53.92 2hf5 n ASN 60 Cb 0.00 -0.11 0.00 0.00 -2.36 0.00 0.00 39.78 37.32 2hf5 n ASN 60 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 2hf5 n GLY 61 N 1.01 0.68 3.79 4.83 0.00 -1.26 -5.01 105.19 109.22 2hf5 n GLY 61 Ca 0.19 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.12 2hf5 n GLY 61 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2hf5 s THR 62 N -2.34 0.00 -0.00 2.61 -1.32 -1.26 -4.83 115.64 108.49 2hf5 s THR 62 Ca 0.00 -1.04 -0.14 0.00 -1.21 0.00 0.00 61.69 59.30 2hf5 s THR 62 Cb 0.00 -2.80 -0.06 0.00 -1.51 0.00 0.00 72.50 68.13 2hf5 s THR 62 CO 0.00 0.00 0.39 -0.63 -2.21 0.00 0.00 174.62 172.17 2hf5 s ILE 63 N -2.47 5.06 0.45 5.08 1.01 0.12 -4.61 121.20 125.84 2hf5 s ILE 63 Ca 0.16 0.78 0.07 0.00 0.00 0.00 0.00 60.65 61.66 2hf5 s ILE 63 Cb -0.05 -3.69 -0.02 0.00 0.01 0.00 0.00 42.46 38.71 2hf5 s ILE 63 CO 0.12 0.57 0.26 -0.62 0.00 0.00 0.00 174.94 175.27 2hf5 s ASP 64 N -1.11 4.58 0.17 3.58 -1.08 -1.26 -2.81 116.67 118.74 2hf5 s ASP 64 Ca 0.24 -1.09 -0.15 0.00 -0.52 0.00 0.00 52.55 51.02 2hf5 s ASP 64 Cb -0.16 -0.23 0.12 0.00 -1.46 0.00 0.00 42.92 41.19 2hf5 s ASP 64 CO 0.13 -0.71 1.71 -0.26 0.52 0.00 0.00 175.17 176.55 2hf5 h PHE 65 N 1.19 0.05 -0.51 -5.34 -1.00 -1.99 0.17 116.94 109.51 2hf5 h PHE 65 Ca -0.41 0.03 0.06 0.00 2.81 0.00 0.00 57.97 60.46 2hf5 h PHE 65 Cb 1.27 0.04 -0.05 0.00 3.61 0.00 0.00 35.95 40.82 2hf5 h PHE 65 CO 0.74 -0.04 0.21 -1.00 -1.61 0.00 0.00 178.31 176.61 2hf5 h PRO 66 N 0.15 0.39 0.35 1.51 0.13 -1.99 -2.48 132.00 130.06 2hf5 h PRO 66 Ca 0.20 -0.02 -0.02 0.00 -0.87 0.00 0.00 66.00 65.29 2hf5 h PRO 66 Cb 0.27 -0.09 0.00 0.00 0.13 0.00 0.00 31.00 31.32 2hf5 h PRO 66 CO -0.30 0.26 -0.17 0.93 -0.23 0.00 0.00 178.00 178.48 2hf5 h GLU 67 N 0.40 -0.46 -0.29 0.86 5.08 -1.63 0.17 114.58 118.71 2hf5 h GLU 67 Ca 0.24 0.03 0.02 0.00 -1.00 0.00 0.00 59.36 58.65 2hf5 h GLU 67 Cb 0.23 0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.56 2hf5 h GLU 67 CO -0.22 -0.27 0.15 0.35 -1.00 0.00 0.00 179.01 178.02 2hf5 h PHE 68 N -0.53 0.28 -0.27 4.33 3.57 -1.01 0.27 116.94 123.58 2hf5 h PHE 68 Ca -0.05 0.01 -0.07 0.00 3.53 0.00 0.00 57.97 61.40 2hf5 h PHE 68 Cb 0.40 -0.09 -0.01 0.00 2.79 0.00 0.00 35.95 39.04 2hf5 h PHE 68 CO -0.04 0.16 -0.09 -0.07 -2.23 0.00 0.00 178.31 176.05 2hf5 h LEU 69 N 0.32 0.55 -0.09 0.59 3.38 -1.39 -0.23 115.31 118.44 2hf5 h LEU 69 Ca 0.12 -0.38 -0.15 0.00 0.09 0.00 0.00 57.88 57.55 2hf5 h LEU 69 Cb 0.02 -0.15 0.01 0.00 0.09 0.00 0.00 40.66 40.63 2hf5 h LEU 69 CO -0.07 0.80 -0.55 0.74 0.09 0.00 0.00 178.44 179.46 2hf5 h THR 70 N 0.29 1.37 -0.03 0.22 2.02 -0.81 -0.58 112.91 115.39 2hf5 h THR 70 Ca 0.07 -1.88 -0.00 0.00 0.77 0.00 0.00 66.41 65.36 2hf5 h THR 70 Cb 0.58 2.25 -0.00 0.00 -1.74 0.00 0.00 68.15 69.24 2hf5 h THR 70 CO 0.03 0.56 0.01 0.24 0.37 0.00 0.00 175.52 176.74 2hf5 h MET 71 N 0.11 0.04 0.09 6.66 2.86 -0.51 0.77 114.93 124.94 2hf5 h MET 71 Ca -0.04 -0.00 -0.00 0.00 -2.06 0.00 0.00 59.70 57.59 2hf5 h MET 71 Cb 1.20 -0.01 0.00 0.00 0.06 0.00 0.00 31.60 32.85 2hf5 h MET 71 CO 0.11 0.03 -0.04 1.98 1.06 0.00 0.00 176.91 180.05 2hf5 h MET 72 N 0.04 -0.12 0.00 1.72 -1.53 -0.76 -3.20 114.93 111.08 2hf5 h MET 72 Ca 0.01 0.01 0.00 0.00 -3.44 0.00 0.00 59.70 56.28 2hf5 h MET 72 Cb 0.01 0.03 0.00 0.00 -0.55 0.00 0.00 31.60 31.08 2hf5 h MET 72 CO -0.00 -0.08 0.16 0.00 0.14 0.00 0.00 176.91 177.13 2hf5 h ALA 73 N -1.92 1.13 -0.77 0.39 0.00 -0.86 -1.79 119.26 115.44 2hf5 h ALA 73 Ca -0.01 0.00 0.15 0.00 0.00 0.00 0.00 54.91 55.05 2hf5 h ALA 73 Cb 0.09 0.00 -0.14 0.00 0.00 0.00 0.00 17.79 17.74 2hf5 h ALA 73 CO 0.02 -0.13 -0.24 -0.09 0.00 0.00 0.00 179.25 178.81 2hf5 h ARG 74 N 0.00 -0.03 0.00 0.00 9.65 0.56 -3.40 114.38 121.16 2hf5 h ARG 74 Ca 0.00 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.88 2hf5 h ARG 74 Cb 0.32 0.01 0.00 0.00 -1.39 0.00 0.00 29.97 28.91 2hf5 h ARG 74 CO 0.00 -0.02 -0.46 1.63 2.80 0.00 0.00 179.97 183.92 2hf5 n LYS 75 N -5.50 0.00 -3.74 0.20 5.02 -1.03 -5.05 118.16 108.06 2hf5 n LYS 75 Ca 0.10 0.00 -0.38 0.00 -2.02 0.00 0.00 58.31 56.01 2hf5 n LYS 75 Cb 0.39 -0.25 -0.12 0.00 -0.02 0.00 0.00 35.03 35.03 2hf5 n LYS 75 CO 0.00 0.00 0.00 1.41 -0.52 0.00 0.00 177.40 178.29 2hf5 s MET 76 N -2.00 2.63 -0.29 1.97 0.00 -0.70 -5.06 119.30 115.86 2hf5 s MET 76 Ca 0.00 -1.17 -0.07 0.00 0.00 0.00 0.00 55.69 54.45 2hf5 s MET 76 Cb 0.00 -3.48 0.01 0.00 0.00 0.00 0.00 34.83 31.36 2hf5 s MET 76 CO 0.00 -0.67 0.07 0.21 0.00 0.00 0.00 175.02 174.63 2hf5 s LYS 77 N 1.41 3.15 0.12 4.11 2.47 -1.25 -3.72 119.74 126.03 2hf5 s LYS 77 Ca -0.01 -0.82 0.00 0.00 -1.56 0.00 0.00 55.97 53.58 2hf5 s LYS 77 Cb -0.19 -3.34 0.00 0.00 -1.46 0.00 0.00 37.83 32.83 2hf5 s LYS 77 CO 0.03 -0.41 0.00 -3.47 0.16 0.00 0.00 175.35 171.66 2hf5 n ASP 78 N 4.86 0.72 -4.37 1.43 2.03 -1.26 -5.00 116.55 114.98 2hf5 n ASP 78 Ca -0.15 0.18 -0.45 0.00 0.52 0.00 0.00 54.79 54.89 2hf5 n ASP 78 Cb 0.48 -0.16 -0.04 0.00 -0.72 0.00 0.00 41.12 40.68 2hf5 n ASP 78 CO 0.00 0.00 0.00 -0.89 -1.92 0.00 0.00 177.20 174.39 2hf5 s THR 79 N -1.84 4.97 -0.55 5.18 2.01 -1.26 -4.97 115.64 119.17 2hf5 s THR 79 Ca 0.00 -1.30 -0.18 0.00 0.31 0.00 0.00 61.69 60.52 2hf5 s THR 79 Cb 0.00 -4.49 0.10 0.00 0.01 0.00 0.00 72.50 68.12 2hf5 s THR 79 CO 0.00 -1.11 0.61 1.51 -0.69 0.00 0.00 174.62 174.93 2hf5 s ASP 80 N 3.45 6.19 -0.46 3.53 -4.77 -1.26 -4.91 116.67 118.44 2hf5 s ASP 80 Ca 0.13 -1.42 0.04 0.00 -3.30 0.00 0.00 52.55 48.00 2hf5 s ASP 80 Cb -0.22 -2.26 0.23 0.00 -1.09 0.00 0.00 42.92 39.58 2hf5 s ASP 80 CO 0.03 -0.96 0.92 -1.20 0.70 0.00 0.00 175.17 174.65 2hf5 n SER 81 N 5.92 -2.71 -0.11 2.11 7.64 -1.26 -5.05 113.62 120.15 2hf5 n SER 81 Ca -0.10 -2.82 -0.06 0.00 1.01 0.00 0.00 58.87 56.89 2hf5 n SER 81 Cb 0.42 1.58 -0.00 0.00 -1.01 0.00 0.00 64.21 65.20 2hf5 n SER 81 CO 0.00 0.00 0.00 -0.08 -3.01 0.00 0.00 175.04 171.95 2hf5 h GLU 82 N 4.14 -0.18 -0.74 1.43 4.22 -1.99 0.40 114.58 121.86 2hf5 h GLU 82 Ca -0.10 0.01 0.06 0.00 0.08 0.00 0.00 59.36 59.41 2hf5 h GLU 82 Cb 1.09 0.04 -0.06 0.00 0.50 0.00 0.00 28.75 30.32 2hf5 h GLU 82 CO 0.14 -0.12 0.44 1.05 -2.18 0.00 0.00 179.01 178.34 2hf5 h GLU 83 N -0.19 0.78 -0.64 1.92 4.11 -2.00 -1.82 114.58 116.74 2hf5 h GLU 83 Ca 0.19 -0.05 -0.06 0.00 0.07 0.00 0.00 59.36 59.51 2hf5 h GLU 83 Cb 0.48 -0.18 -0.03 0.00 0.50 0.00 0.00 28.75 29.53 2hf5 h GLU 83 CO -0.50 0.52 0.15 0.93 0.07 0.00 0.00 179.01 180.18 2hf5 h GLU 84 N 0.80 1.01 -0.88 1.06 5.08 -1.28 -1.67 114.58 118.70 2hf5 h GLU 84 Ca 0.33 -0.23 -0.03 0.00 -1.00 0.00 0.00 59.36 58.43 2hf5 h GLU 84 Cb 0.17 -0.14 -0.04 0.00 0.50 0.00 0.00 28.75 29.24 2hf5 h GLU 84 CO -0.17 0.90 0.44 0.82 -1.00 0.00 0.00 179.01 180.00 2hf5 h ILE 85 N 0.96 1.26 -0.24 3.13 1.08 0.28 0.43 117.51 124.41 2hf5 h ILE 85 Ca 0.20 -0.70 -0.01 0.00 -0.39 0.00 0.00 64.86 63.97 2hf5 h ILE 85 Cb 0.34 0.11 -0.01 0.00 -3.07 0.00 0.00 36.82 34.20 2hf5 h ILE 85 CO 0.00 0.31 0.13 0.03 -0.69 0.00 0.00 178.15 177.93 2hf5 h ARG 86 N 1.24 0.34 -0.68 2.37 3.08 -1.04 -1.56 114.38 118.12 2hf5 h ARG 86 Ca 0.30 -0.04 -0.01 0.00 0.07 0.00 0.00 59.98 60.30 2hf5 h ARG 86 Cb 0.08 -0.06 -0.03 0.00 0.08 0.00 0.00 29.97 30.03 2hf5 h ARG 86 CO -0.04 0.31 0.37 1.49 -1.07 0.00 0.00 179.97 181.02 2hf5 h GLU 87 N 0.27 0.95 -0.26 0.04 4.81 -0.75 -2.42 114.58 117.22 2hf5 h GLU 87 Ca 0.08 -0.10 -0.01 0.00 -0.13 0.00 0.00 59.36 59.20 2hf5 h GLU 87 Cb 0.08 -0.19 -0.01 0.00 0.63 0.00 0.00 28.75 29.25 2hf5 h GLU 87 CO -0.01 0.70 0.13 0.00 -0.73 0.00 0.00 179.01 179.10 2hf5 h ALA 88 N 1.45 0.34 -0.82 2.92 0.00 0.31 0.31 119.26 123.77 2hf5 h ALA 88 Ca 0.24 -0.09 0.10 0.00 0.00 0.00 0.00 54.91 55.16 2hf5 h ALA 88 Cb 0.04 -0.10 -0.07 0.00 0.00 0.00 0.00 17.79 17.65 2hf5 h ALA 88 CO -0.04 -0.10 0.46 0.74 0.00 0.00 0.00 179.25 180.31 2hf5 h PHE 89 N 0.29 0.84 0.05 0.00 -1.00 -0.83 0.65 116.94 116.95 2hf5 h PHE 89 Ca 0.09 0.03 -0.23 0.00 2.81 0.00 0.00 57.97 60.67 2hf5 h PHE 89 Cb 0.12 -0.26 -0.01 0.00 3.61 0.00 0.00 35.95 39.41 2hf5 h PHE 89 CO -0.02 0.34 -1.03 0.00 -1.61 0.00 0.00 178.31 175.99 2hf5 h ARG 90 N 0.78 0.21 0.02 1.51 3.08 -1.08 -3.08 114.38 115.82 2hf5 h ARG 90 Ca 0.40 -0.29 -0.04 0.00 0.07 0.00 0.00 59.98 60.11 2hf5 h ARG 90 Cb 0.37 0.10 0.00 0.00 0.08 0.00 0.00 29.97 30.52 2hf5 h ARG 90 CO -0.25 1.07 -0.17 0.28 -1.07 0.00 0.00 179.97 179.82 2hf5 h VAL 91 N 0.09 1.69 -0.84 2.04 2.07 0.19 -3.34 116.25 118.16 2hf5 h VAL 91 Ca -0.07 -2.26 -0.00 0.00 0.82 0.00 0.00 66.70 65.18 2hf5 h VAL 91 Cb 1.72 3.21 -0.04 0.00 -1.52 0.00 0.00 31.29 34.66 2hf5 h VAL 91 CO 0.16 0.60 0.51 -0.26 0.02 0.00 0.00 177.57 178.60 2hf5 h PHE 92 N -0.79 1.10 -4.00 1.57 -1.00 0.14 -3.43 116.94 110.54 2hf5 h PHE 92 Ca -0.03 0.00 -0.54 0.00 2.81 0.00 0.00 57.97 60.21 2hf5 h PHE 92 Cb 1.08 -0.36 0.11 0.00 3.61 0.00 0.00 35.95 40.40 2hf5 h PHE 92 CO 0.24 0.73 0.66 0.34 -1.61 0.00 0.00 178.31 178.67 2hf5 s ASP 93 N -6.29 5.82 0.02 2.17 -1.08 -1.16 -4.16 116.67 111.99 2hf5 s ASP 93 Ca -0.12 2.82 -0.19 0.00 -0.52 0.00 0.00 52.55 54.54 2hf5 s ASP 93 Cb 0.17 -2.65 -0.21 0.00 -1.46 0.00 0.00 42.92 38.78 2hf5 s ASP 93 CO 0.81 -1.20 1.17 0.11 0.52 0.00 0.00 175.17 176.57 2hf5 h LYS 94 N 2.18 0.45 -0.02 4.34 1.57 -1.82 -3.33 116.57 119.95 2hf5 h LYS 94 Ca -0.51 -0.42 0.00 0.00 -1.87 0.00 0.00 60.65 57.86 2hf5 h LYS 94 Cb 1.27 0.10 0.00 0.00 0.08 0.00 0.00 32.23 33.68 2hf5 h LYS 94 CO 0.60 1.06 -0.46 -0.40 -0.57 0.00 0.00 179.45 179.69 2hf5 n ASP 95 N -4.24 2.03 -2.96 0.86 5.68 -1.26 -4.98 116.55 111.68 2hf5 n ASP 95 Ca -0.09 -1.52 -0.22 0.00 -0.50 0.00 0.00 54.79 52.46 2hf5 n ASP 95 Cb 0.62 0.47 0.03 0.00 -1.14 0.00 0.00 41.12 41.10 2hf5 n ASP 95 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2hf5 n GLY 96 N 1.40 -0.52 0.00 6.12 0.00 -1.25 -4.87 105.19 106.07 2hf5 n GLY 96 Ca 0.09 0.11 0.03 0.00 0.00 0.00 0.00 46.02 46.25 2hf5 n GLY 96 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2hf5 n ASN 97 N -2.45 0.00 0.00 1.61 6.94 -1.26 -4.82 115.26 115.28 2hf5 n ASN 97 Ca -0.12 -1.26 0.00 0.00 -0.02 0.00 0.00 54.58 53.17 2hf5 n ASN 97 Cb 0.62 0.00 0.00 0.00 -2.36 0.00 0.00 39.78 38.04 2hf5 n ASN 97 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 2hf5 n GLY 98 N 0.28 0.70 3.27 4.83 0.00 -1.26 -5.05 105.19 107.96 2hf5 n GLY 98 Ca 0.05 -0.69 -0.13 0.00 0.00 0.00 0.00 46.02 45.24 2hf5 n GLY 98 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2hf5 s TYR 99 N -2.00 -0.22 -0.40 1.61 2.02 -1.25 -4.84 117.35 112.27 2hf5 s TYR 99 Ca 0.00 0.30 -0.05 0.00 -0.37 0.00 0.00 57.07 56.95 2hf5 s TYR 99 Cb 0.00 0.13 0.09 0.00 -0.40 0.00 0.00 41.96 41.79 2hf5 s TYR 99 CO 0.00 -0.43 0.20 0.42 -1.57 0.00 0.00 175.55 174.17 2hf5 s ILE 100 N -1.54 3.57 0.37 2.71 1.01 -1.12 -4.46 121.20 121.74 2hf5 s ILE 100 Ca -0.12 -1.77 0.06 0.00 0.00 0.00 0.00 60.65 58.81 2hf5 s ILE 100 Cb -0.04 -3.32 -0.00 0.00 0.01 0.00 0.00 42.46 39.11 2hf5 s ILE 100 CO 0.03 -0.57 0.53 -0.44 0.00 0.00 0.00 174.94 174.49 2hf5 s SER 101 N 1.91 5.88 0.14 3.58 0.01 -1.26 -0.70 113.70 123.26 2hf5 s SER 101 Ca 0.05 -0.14 -0.18 0.00 1.31 0.00 0.00 55.95 56.99 2hf5 s SER 101 Cb -0.23 -1.19 0.03 0.00 0.21 0.00 0.00 66.02 64.85 2hf5 s SER 101 CO -0.02 -0.55 1.72 0.00 0.41 0.00 0.00 173.24 174.81 2hf5 h ALA 102 N 0.75 0.28 -0.62 1.44 0.00 -1.88 0.29 119.26 119.52 2hf5 h ALA 102 Ca -0.45 0.07 0.12 0.00 0.00 0.00 0.00 54.91 54.65 2hf5 h ALA 102 Cb 1.26 0.11 -0.09 0.00 0.00 0.00 0.00 17.79 19.07 2hf5 h ALA 102 CO 0.52 -0.38 0.15 0.00 0.00 0.00 0.00 179.25 179.54 2hf5 h ALA 103 N 1.23 0.76 -0.80 0.00 0.00 -1.96 0.10 119.26 118.60 2hf5 h ALA 103 Ca 0.14 0.13 0.01 0.00 0.00 0.00 0.00 54.91 55.19 2hf5 h ALA 103 Cb 0.17 0.17 -0.04 0.00 0.00 0.00 0.00 17.79 18.09 2hf5 h ALA 103 CO -0.21 -0.30 0.53 0.93 0.00 0.00 0.00 179.25 180.21 2hf5 h GLU 104 N 0.28 1.06 -0.26 0.00 4.39 -1.56 -2.51 114.58 115.98 2hf5 h GLU 104 Ca 0.33 -0.07 0.01 0.00 0.34 0.00 0.00 59.36 59.98 2hf5 h GLU 104 Cb 0.50 -0.24 -0.02 0.00 -0.10 0.00 0.00 28.75 28.89 2hf5 h GLU 104 CO -0.41 0.71 0.14 -0.07 -1.16 0.00 0.00 179.01 178.22 2hf5 h LEU 105 N 1.09 0.22 -0.28 1.33 3.38 0.98 -2.14 115.31 119.90 2hf5 h LEU 105 Ca 0.29 0.01 0.04 0.00 0.09 0.00 0.00 57.88 58.31 2hf5 h LEU 105 Cb -0.12 -0.04 -0.04 0.00 0.09 0.00 0.00 40.66 40.55 2hf5 h LEU 105 CO -0.06 0.17 0.03 0.08 0.09 0.00 0.00 178.44 178.74 2hf5 h ARG 106 N 0.29 0.12 -0.27 1.13 0.11 -0.44 0.87 114.38 116.19 2hf5 h ARG 106 Ca 0.10 -0.01 0.06 0.00 0.10 0.00 0.00 59.98 60.24 2hf5 h ARG 106 Cb 0.01 -0.03 -0.08 0.00 1.11 0.00 0.00 29.97 30.99 2hf5 h ARG 106 CO -0.06 0.08 -0.30 1.25 0.10 0.00 0.00 179.97 181.04 2hf5 h HIS 107 N 0.12 -0.81 0.07 4.08 2.76 -1.17 0.62 115.15 120.83 2hf5 h HIS 107 Ca 0.13 0.05 -0.28 0.00 -2.20 0.00 0.00 60.37 58.06 2hf5 h HIS 107 Cb 0.16 0.40 -0.02 0.00 1.55 0.00 0.00 27.41 29.49 2hf5 h HIS 107 CO -0.19 -0.37 -1.47 -0.24 -1.30 0.00 0.00 177.93 174.36 2hf5 h VAL 108 N -0.29 1.19 0.00 5.26 3.04 -0.76 -3.41 116.25 121.27 2hf5 h VAL 108 Ca 0.14 -2.89 0.00 0.00 -1.01 0.00 0.00 66.70 62.94 2hf5 h VAL 108 Cb 0.52 2.70 0.00 0.00 -2.01 0.00 0.00 31.29 32.49 2hf5 h VAL 108 CO -0.44 0.78 0.00 0.80 -1.01 0.00 0.00 177.57 177.71 2hf5 n MET 109 N -3.34 0.00 0.00 4.17 0.00 0.30 -4.92 117.12 113.32 2hf5 n MET 109 Ca -0.13 0.34 0.00 0.00 0.00 0.00 0.00 57.70 57.91 2hf5 n MET 109 Cb 1.02 -0.93 0.00 0.00 0.00 0.00 0.00 33.22 33.31 2hf5 n MET 109 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 175.97 173.60 2hf5 n THR 110 N -1.52 0.00 -2.69 1.12 5.66 -1.00 -5.06 114.28 110.79 2hf5 n THR 110 Ca 0.00 0.00 -0.09 0.00 -3.05 0.00 0.00 64.05 60.91 2hf5 n THR 110 Cb 0.00 -0.23 0.04 0.00 -1.55 0.00 0.00 70.33 68.58 2hf5 n THR 110 CO 0.00 0.00 0.00 0.59 -3.05 0.00 0.00 175.07 172.61 2hf5 n ASN 111 N -1.70 0.69 -4.77 1.09 4.13 0.21 -4.98 115.26 109.93 2hf5 n ASN 111 Ca 0.00 -1.53 -0.33 0.00 1.68 0.00 0.00 54.58 54.39 2hf5 n ASN 111 Cb 0.19 -0.22 0.04 0.00 -1.54 0.00 0.00 39.78 38.26 2hf5 n ASN 111 CO 0.00 0.00 0.00 -1.48 0.28 0.00 0.00 177.26 176.06 2hf5 s LEU 112 N 0.00 3.43 0.00 3.41 0.05 -1.26 -3.70 118.68 120.61 2hf5 s LEU 112 Ca 0.25 2.05 0.24 0.00 0.05 0.00 0.00 54.13 56.73 2hf5 s LEU 112 Cb -0.02 -4.56 1.46 0.00 -2.05 0.00 0.00 46.19 41.02 2hf5 s LEU 112 CO 0.17 -1.62 1.82 0.61 -0.55 0.00 0.00 176.35 176.77