#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 1.13 0.00 0.00 -1.05 -1.26 -5.04 118.70 112.48 2hf5 s GLU 47 Ca 0.00 -1.08 0.21 0.00 -0.15 0.00 0.00 54.97 53.96 2hf5 s GLU 47 Cb 0.00 -1.32 1.19 0.00 -0.44 0.00 0.00 34.13 33.56 2hf5 s GLU 47 CO 0.00 0.31 1.78 1.28 0.95 0.00 0.00 175.26 179.58 2hf5 n LEU 48 N 1.29 0.25 0.06 1.83 7.99 -1.26 -4.07 117.00 123.09 2hf5 n LEU 48 Ca -0.19 -0.10 0.13 0.00 -0.01 0.00 0.00 56.01 55.83 2hf5 n LEU 48 Cb 0.54 -0.01 0.60 0.00 -0.11 0.00 0.00 43.42 44.44 2hf5 n LEU 48 CO 0.22 0.05 1.15 1.56 -1.51 0.00 0.00 177.39 178.86 2hf5 h GLN 49 N 0.35 0.15 0.60 3.23 4.20 -1.97 0.21 115.11 121.88 2hf5 h GLN 49 Ca 0.00 -0.01 -0.02 0.00 0.06 0.00 0.00 58.65 58.68 2hf5 h GLN 49 Cb 0.08 -0.03 -0.01 0.00 0.30 0.00 0.00 27.48 27.82 2hf5 h GLN 49 CO 0.00 0.10 -0.39 -0.44 -0.67 0.00 0.00 178.83 177.43 2hf5 h ASP 50 N 0.15 -0.98 -0.31 1.46 3.32 -2.00 0.12 116.42 118.19 2hf5 h ASP 50 Ca 0.17 0.06 0.01 0.00 0.02 0.00 0.00 57.03 57.29 2hf5 h ASP 50 Cb 0.47 0.29 -0.02 0.00 0.22 0.00 0.00 39.33 40.30 2hf5 h ASP 50 CO -0.02 -0.60 0.20 -0.03 -1.72 0.00 0.00 179.24 177.08 2hf5 h MET 51 N -0.94 0.36 -0.71 3.56 4.05 -1.60 -1.33 114.93 118.31 2hf5 h MET 51 Ca -0.07 -0.02 -0.07 0.00 -0.28 0.00 0.00 59.70 59.26 2hf5 h MET 51 Cb 0.77 -0.08 -0.03 0.00 -0.80 0.00 0.00 31.60 31.46 2hf5 h MET 51 CO 0.06 0.24 0.18 0.82 0.23 0.00 0.00 176.91 178.43 2hf5 h ILE 52 N 0.37 1.26 0.00 1.77 2.04 -0.05 -1.04 117.51 121.86 2hf5 h ILE 52 Ca 0.12 -0.97 0.00 0.00 1.00 0.00 0.00 64.86 65.01 2hf5 h ILE 52 Cb 0.03 0.53 0.00 0.00 -0.74 0.00 0.00 36.82 36.63 2hf5 h ILE 52 CO -0.03 0.37 0.00 0.78 0.00 0.00 0.00 178.15 179.28 2hf5 h ASN 53 N 1.07 0.00 0.74 1.72 -0.26 0.34 -2.13 115.58 117.06 2hf5 h ASN 53 Ca 0.22 0.00 -0.25 0.00 -0.56 0.00 0.00 56.30 55.71 2hf5 h ASN 53 Cb 0.37 0.00 -0.02 0.00 -1.06 0.00 0.00 38.32 37.60 2hf5 h ASN 53 CO 0.00 0.00 -1.27 -0.33 -1.06 0.00 0.00 177.43 174.77 2hf5 h GLU 54 N 0.00 0.10 0.06 0.81 5.08 -0.79 -3.38 114.58 116.46 2hf5 h GLU 54 Ca 0.00 -0.17 -0.28 0.00 -1.00 0.00 0.00 59.36 57.91 2hf5 h GLU 54 Cb 0.71 0.06 -0.02 0.00 0.50 0.00 0.00 28.75 30.00 2hf5 h GLU 54 CO 0.00 0.98 -1.46 0.28 -1.00 0.00 0.00 179.01 177.81 2hf5 h VAL 55 N 0.03 1.19 -2.95 3.13 2.07 -0.87 -3.45 116.25 115.40 2hf5 h VAL 55 Ca -0.13 -2.91 -0.52 0.00 0.82 0.00 0.00 66.70 63.96 2hf5 h VAL 55 Cb 1.90 2.69 0.06 0.00 -1.52 0.00 0.00 31.29 34.42 2hf5 h VAL 55 CO 0.14 0.78 0.93 1.51 0.02 0.00 0.00 177.57 180.94 2hf5 s ASP 56 N -6.70 6.45 -0.12 0.57 1.47 -0.83 -4.83 116.67 112.68 2hf5 s ASP 56 Ca -0.06 2.82 0.16 0.00 1.18 0.00 0.00 52.55 56.65 2hf5 s ASP 56 Cb 0.08 -2.61 -0.24 0.00 -0.34 0.00 0.00 42.92 39.81 2hf5 s ASP 56 CO 0.84 -0.90 0.34 0.00 0.68 0.00 0.00 175.17 176.13 2hf5 n ALA 57 N 3.33 1.61 -0.09 2.11 0.00 -1.26 -4.41 120.51 121.79 2hf5 n ALA 57 Ca 0.12 -1.05 0.00 0.00 0.00 0.00 0.00 53.44 52.52 2hf5 n ALA 57 Cb 0.37 -0.49 0.00 0.00 0.00 0.00 0.00 19.45 19.33 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 -2.83 0.83 0.00 0.00 5.75 -1.26 -5.00 116.55 114.04 2hf5 n ASP 58 Ca -0.24 -0.96 0.00 0.00 -0.01 0.00 0.00 54.79 53.58 2hf5 n ASP 58 Cb 1.07 0.07 0.00 0.00 -1.03 0.00 0.00 41.12 41.22 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 0.07 0.54 0.00 6.12 0.00 -1.26 -4.94 105.19 105.71 2hf5 n GLY 59 Ca 0.00 -0.85 0.12 0.00 0.00 0.00 0.00 46.02 45.30 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 1.73 0.00 0.00 1.61 6.94 -1.26 -4.89 115.26 119.38 2hf5 n ASN 60 Ca 0.00 0.06 0.00 0.00 -0.02 0.00 0.00 54.58 54.62 2hf5 n ASN 60 Cb 0.25 -0.34 0.00 0.00 -2.36 0.00 0.00 39.78 37.33 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 0.93 1.19 3.16 4.83 0.00 -1.26 -4.96 105.19 109.08 2hf5 n GLY 61 Ca 0.11 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.04 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 -3.76 0.17 0.15 2.61 -1.32 -1.26 -4.69 115.64 107.54 2hf5 s THR 62 Ca 0.00 -1.37 -0.18 0.00 -1.21 0.00 0.00 61.69 58.93 2hf5 s THR 62 Cb 0.00 -1.36 -0.07 0.00 -1.51 0.00 0.00 72.50 69.56 2hf5 s THR 62 CO 0.00 -0.76 0.63 -0.63 -2.21 0.00 0.00 174.62 171.65 2hf5 s ILE 63 N -3.77 4.69 0.46 5.08 1.01 -0.51 -4.73 121.20 123.43 2hf5 s ILE 63 Ca 0.05 1.16 0.07 0.00 0.00 0.00 0.00 60.65 61.92 2hf5 s ILE 63 Cb 0.05 -3.85 -0.01 0.00 0.01 0.00 0.00 42.46 38.66 2hf5 s ILE 63 CO -0.10 0.35 0.33 -0.62 0.00 0.00 0.00 174.94 174.89 2hf5 s ASP 64 N -1.47 4.71 0.14 3.58 -1.08 -1.26 -3.43 116.67 117.85 2hf5 s ASP 64 Ca 0.37 -1.03 -0.26 0.00 -0.52 0.00 0.00 52.55 51.11 2hf5 s ASP 64 Cb -0.17 -0.18 -0.02 0.00 -1.46 0.00 0.00 42.92 41.09 2hf5 s ASP 64 CO 0.20 -0.79 1.60 -0.26 0.52 0.00 0.00 175.17 176.45 2hf5 h PHE 65 N 1.05 -0.97 -0.87 -5.34 0.04 -1.98 0.15 116.94 109.01 2hf5 h PHE 65 Ca -0.40 0.04 0.01 0.00 2.80 0.00 0.00 57.97 60.42 2hf5 h PHE 65 Cb 1.28 0.45 -0.04 0.00 2.20 0.00 0.00 35.95 39.83 2hf5 h PHE 65 CO 0.72 -0.41 0.57 -1.35 -0.60 0.00 0.00 178.31 177.24 2hf5 h PRO 66 N -0.40 1.15 -0.34 1.51 0.11 -2.00 -2.75 132.00 129.28 2hf5 h PRO 66 Ca 0.10 -0.07 -0.10 0.00 0.11 0.00 0.00 66.00 66.04 2hf5 h PRO 66 Cb 0.56 -0.26 -0.01 0.00 0.11 0.00 0.00 31.00 31.41 2hf5 h PRO 66 CO -0.39 0.76 -0.16 0.93 -0.21 0.00 0.00 178.00 178.92 2hf5 h GLU 67 N 1.18 0.72 -0.26 1.05 5.08 -1.65 -1.77 114.58 118.92 2hf5 h GLU 67 Ca 0.32 -0.31 0.04 0.00 -1.00 0.00 0.00 59.36 58.41 2hf5 h GLU 67 Cb -0.13 -0.02 -0.04 0.00 0.50 0.00 0.00 28.75 29.06 2hf5 h GLU 67 CO -0.07 0.92 0.02 0.35 -1.00 0.00 0.00 179.01 179.23 2hf5 h PHE 68 N 0.49 0.03 -0.35 4.33 3.57 -0.65 0.09 116.94 124.45 2hf5 h PHE 68 Ca 0.08 0.02 -0.05 0.00 3.53 0.00 0.00 57.97 61.54 2hf5 h PHE 68 Cb 0.70 0.03 -0.02 0.00 2.79 0.00 0.00 35.95 39.45 2hf5 h PHE 68 CO 0.06 -0.01 -0.00 -0.07 -2.23 0.00 0.00 178.31 176.05 2hf5 h LEU 69 N 0.11 0.51 0.03 0.59 -0.00 -1.32 0.10 115.31 115.34 2hf5 h LEU 69 Ca 0.12 -0.10 -0.14 0.00 -0.00 0.00 0.00 57.88 57.76 2hf5 h LEU 69 Cb 0.15 -0.13 0.01 0.00 -0.00 0.00 0.00 40.66 40.69 2hf5 h LEU 69 CO -0.19 0.58 -0.57 0.74 -0.00 0.00 0.00 178.44 179.00 2hf5 h THR 70 N 0.52 1.48 -0.61 0.22 2.02 -0.95 -1.11 112.91 114.49 2hf5 h THR 70 Ca 0.11 -2.18 -0.04 0.00 0.77 0.00 0.00 66.41 65.07 2hf5 h THR 70 Cb 0.34 2.80 -0.03 0.00 -1.74 0.00 0.00 68.15 69.52 2hf5 h THR 70 CO 0.01 0.62 0.21 0.24 0.37 0.00 0.00 175.52 176.97 2hf5 h MET 71 N -0.27 0.90 0.44 6.66 2.86 -0.82 0.33 114.93 125.04 2hf5 h MET 71 Ca -0.08 -0.16 -0.02 0.00 -2.06 0.00 0.00 59.70 57.38 2hf5 h MET 71 Cb 1.33 -0.15 0.00 0.00 0.06 0.00 0.00 31.60 32.85 2hf5 h MET 71 CO 0.11 0.77 -0.21 1.98 1.06 0.00 0.00 176.91 180.61 2hf5 h MET 72 N 0.88 -0.57 0.00 1.72 -1.53 -0.84 -2.99 114.93 111.60 2hf5 h MET 72 Ca 0.20 0.04 0.00 0.00 -3.44 0.00 0.00 59.70 56.50 2hf5 h MET 72 Cb 0.23 0.13 0.00 0.00 -0.55 0.00 0.00 31.60 31.41 2hf5 h MET 72 CO -0.01 -0.38 0.32 0.00 0.14 0.00 0.00 176.91 176.98 2hf5 n ALA 73 N -2.40 0.58 -0.30 0.39 0.00 -0.42 -2.16 120.51 116.21 2hf5 n ALA 73 Ca -0.07 0.11 0.13 0.00 0.00 0.00 0.00 53.44 53.60 2hf5 n ALA 73 Cb 0.23 -0.73 0.29 0.00 0.00 0.00 0.00 19.45 19.25 2hf5 n ALA 73 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2hf5 h ARG 74 N 0.00 0.30 0.00 0.00 2.47 -0.18 -3.35 114.38 113.62 2hf5 h ARG 74 Ca 0.00 -0.02 -0.02 0.00 -1.26 0.00 0.00 59.98 58.68 2hf5 h ARG 74 Cb 0.64 -0.07 -0.00 0.00 -1.65 0.00 0.00 29.97 28.89 2hf5 h ARG 74 CO 0.00 0.20 -0.69 1.63 0.56 0.00 0.00 179.97 181.66 2hf5 n LYS 75 N -5.13 0.05 -4.59 0.04 5.02 -0.96 -5.05 118.16 107.54 2hf5 n LYS 75 Ca 0.21 0.02 -0.33 0.00 -2.02 0.00 0.00 58.31 56.19 2hf5 n LYS 75 Cb 0.66 -0.59 -0.15 0.00 -0.02 0.00 0.00 35.03 34.93 2hf5 n LYS 75 CO 0.00 0.00 0.00 -1.64 -0.52 0.00 0.00 177.40 175.24 2hf5 s MET 76 N -2.06 3.26 -0.24 1.97 -1.94 -0.92 -5.09 119.30 114.27 2hf5 s MET 76 Ca -0.03 -0.73 -0.15 0.00 -1.71 0.00 0.00 55.69 53.07 2hf5 s MET 76 Cb 0.01 -2.63 -0.04 0.00 2.01 0.00 0.00 34.83 34.18 2hf5 s MET 76 CO 0.04 0.06 0.36 0.21 -0.01 0.00 0.00 175.02 175.69 2hf5 s LYS 77 N 0.71 4.07 0.00 2.03 2.47 -1.26 -2.52 119.74 125.24 2hf5 s LYS 77 Ca -0.07 0.06 0.00 0.00 -1.56 0.00 0.00 55.97 54.40 2hf5 s LYS 77 Cb -0.16 -3.61 0.00 0.00 -1.46 0.00 0.00 37.83 32.61 2hf5 s LYS 77 CO 0.02 -0.17 0.00 -0.40 0.16 0.00 0.00 175.35 174.96 2hf5 n ASP 78 N 4.95 0.00 -4.74 1.43 5.75 -1.26 -5.02 116.55 117.67 2hf5 n ASP 78 Ca -0.09 0.00 -0.42 0.00 -0.01 0.00 0.00 54.79 54.27 2hf5 n ASP 78 Cb 0.51 0.00 -0.03 0.00 -1.03 0.00 0.00 41.12 40.57 2hf5 n ASP 78 CO 0.00 0.00 0.00 -0.89 -0.11 0.00 0.00 177.20 176.20 2hf5 s THR 79 N 2.12 2.66 -0.56 2.12 2.01 -1.26 -4.99 115.64 117.74 2hf5 s THR 79 Ca 0.00 0.53 0.05 0.00 0.31 0.00 0.00 61.69 62.57 2hf5 s THR 79 Cb 0.00 -3.34 0.18 0.00 0.01 0.00 0.00 72.50 69.35 2hf5 s THR 79 CO 0.00 0.07 0.44 -0.90 -0.69 0.00 0.00 174.62 173.54 2hf5 n ASP 80 N 2.89 1.32 -4.23 3.53 5.75 -1.26 -4.93 116.55 119.62 2hf5 n ASP 80 Ca 0.09 -2.81 -0.35 0.00 -0.01 0.00 0.00 54.79 51.71 2hf5 n ASP 80 Cb 0.40 -0.65 -0.14 0.00 -1.03 0.00 0.00 41.12 39.69 2hf5 n ASP 80 CO 0.00 0.00 0.00 -0.44 -0.11 0.00 0.00 177.20 176.65 2hf5 s SER 81 N -0.80 4.15 0.27 -1.12 0.01 -1.26 -5.03 113.70 109.92 2hf5 s SER 81 Ca 0.30 -0.65 -0.00 0.00 1.31 0.00 0.00 55.95 56.90 2hf5 s SER 81 Cb 0.01 -1.67 0.59 0.00 0.21 0.00 0.00 66.02 65.16 2hf5 s SER 81 CO -0.18 -0.07 1.72 -0.08 0.41 0.00 0.00 173.24 175.05 2hf5 h GLU 82 N 8.05 0.45 -0.53 12.44 4.81 -1.98 0.20 114.58 138.01 2hf5 h GLU 82 Ca -0.38 -0.03 -0.10 0.00 -0.13 0.00 0.00 59.36 58.72 2hf5 h GLU 82 Cb 1.13 -0.10 -0.02 0.00 0.63 0.00 0.00 28.75 30.39 2hf5 h GLU 82 CO 0.60 0.30 -0.06 1.05 -0.73 0.00 0.00 179.01 180.17 2hf5 h GLU 83 N 0.46 0.96 -0.63 1.92 4.11 -1.99 -0.59 114.58 118.82 2hf5 h GLU 83 Ca 0.49 -0.32 -0.07 0.00 0.07 0.00 0.00 59.36 59.53 2hf5 h GLU 83 Cb 0.81 -0.08 -0.03 0.00 0.50 0.00 0.00 28.75 29.96 2hf5 h GLU 83 CO -0.45 0.98 0.13 0.93 0.07 0.00 0.00 179.01 180.66 2hf5 h GLU 84 N 0.87 1.00 -0.94 1.06 5.08 -1.15 -2.22 114.58 118.29 2hf5 h GLU 84 Ca 0.15 -0.24 -0.00 0.00 -1.00 0.00 0.00 59.36 58.27 2hf5 h GLU 84 Cb 0.59 -0.13 -0.05 0.00 0.50 0.00 0.00 28.75 29.66 2hf5 h GLU 84 CO 0.04 0.91 0.58 0.82 -1.00 0.00 0.00 179.01 180.36 2hf5 h ILE 85 N 0.95 1.25 -0.66 3.13 1.08 -0.25 0.25 117.51 123.27 2hf5 h ILE 85 Ca 0.20 -0.52 -0.02 0.00 -0.39 0.00 0.00 64.86 64.13 2hf5 h ILE 85 Cb 0.38 -0.09 -0.03 0.00 -3.07 0.00 0.00 36.82 34.01 2hf5 h ILE 85 CO 0.01 0.26 0.35 0.03 -0.69 0.00 0.00 178.15 178.10 2hf5 h ARG 86 N 1.28 0.93 0.00 2.37 3.08 -0.67 0.15 114.38 121.52 2hf5 h ARG 86 Ca 0.34 -0.12 -0.11 0.00 0.07 0.00 0.00 59.98 60.16 2hf5 h ARG 86 Cb -0.08 -0.18 -0.02 0.00 0.08 0.00 0.00 29.97 29.77 2hf5 h ARG 86 CO -0.07 0.71 -0.52 1.49 -1.07 0.00 0.00 179.97 180.52 2hf5 h GLU 87 N 0.90 0.00 -0.47 0.04 4.81 -0.81 -2.17 114.58 116.89 2hf5 h GLU 87 Ca 0.23 0.00 -0.13 0.00 -0.13 0.00 0.00 59.36 59.33 2hf5 h GLU 87 Cb 0.07 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.43 2hf5 h GLU 87 CO -0.03 0.52 -0.20 0.00 -0.73 0.00 0.00 179.01 178.56 2hf5 h ALA 88 N 1.48 0.74 -0.02 2.92 0.00 0.16 -1.14 119.26 123.41 2hf5 h ALA 88 Ca -0.01 -0.38 0.01 0.00 0.00 0.00 0.00 54.91 54.53 2hf5 h ALA 88 Cb 1.06 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 18.68 2hf5 h ALA 88 CO 0.07 0.67 0.01 0.74 0.00 0.00 0.00 179.25 180.74 2hf5 h PHE 89 N 0.83 0.00 -0.01 0.00 -1.00 -0.20 0.55 116.94 117.10 2hf5 h PHE 89 Ca 0.11 0.00 -0.21 0.00 2.81 0.00 0.00 57.97 60.68 2hf5 h PHE 89 Cb 0.77 0.00 -0.00 0.00 3.61 0.00 0.00 35.95 40.32 2hf5 h PHE 89 CO 0.05 0.00 -0.88 -0.09 -1.61 0.00 0.00 178.31 175.78 2hf5 h ARG 90 N 0.00 0.32 0.21 1.51 2.43 -0.80 -3.30 114.38 114.75 2hf5 h ARG 90 Ca 0.01 -0.33 -0.32 0.00 -0.81 0.00 0.00 59.98 58.53 2hf5 h ARG 90 Cb 0.04 0.09 0.03 0.00 -0.42 0.00 0.00 29.97 29.70 2hf5 h ARG 90 CO -0.00 1.02 -1.48 0.28 -1.51 0.00 0.00 179.97 178.28 2hf5 h VAL 91 N 0.18 1.19 0.00 0.20 2.07 0.07 -3.28 116.25 116.67 2hf5 h VAL 91 Ca -0.06 -2.60 0.00 0.00 0.82 0.00 0.00 66.70 64.86 2hf5 h VAL 91 Cb 1.50 2.96 0.00 0.00 -1.52 0.00 0.00 31.29 34.23 2hf5 h VAL 91 CO 0.14 0.81 0.00 0.49 0.02 0.00 0.00 177.57 179.03 2hf5 n PHE 92 N -3.75 0.00 -4.42 1.57 3.72 0.18 -4.72 117.46 110.05 2hf5 n PHE 92 Ca -0.20 0.00 -0.20 0.00 -0.05 0.00 0.00 57.45 57.00 2hf5 n PHE 92 Cb 1.05 -0.06 -0.14 0.00 -0.94 0.00 0.00 39.48 39.39 2hf5 n PHE 92 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 176.76 177.05 2hf5 s ASP 93 N -0.40 1.64 0.27 4.37 -1.08 -1.24 -2.72 116.67 117.51 2hf5 s ASP 93 Ca 0.00 -0.40 0.14 0.00 -0.52 0.00 0.00 52.55 51.76 2hf5 s ASP 93 Cb 0.00 -0.12 0.17 0.00 -1.46 0.00 0.00 42.92 41.51 2hf5 s ASP 93 CO 0.00 0.07 1.49 0.07 0.52 0.00 0.00 175.17 177.31 2hf5 h LYS 94 N 5.15 0.00 -0.01 4.34 2.10 -1.85 -3.24 116.57 123.06 2hf5 h LYS 94 Ca -0.37 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.28 2hf5 h LYS 94 Cb 1.18 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.51 2hf5 h LYS 94 CO 0.45 0.59 0.00 -0.40 -2.00 0.00 0.00 179.45 178.09 2hf5 n ASP 95 N -3.36 1.45 -4.12 7.07 5.68 -1.26 -5.03 116.55 116.98 2hf5 n ASP 95 Ca 0.01 -1.25 -0.31 0.00 -0.50 0.00 0.00 54.79 52.74 2hf5 n ASP 95 Cb 0.72 -0.01 -0.03 0.00 -1.14 0.00 0.00 41.12 40.66 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 0.24 -0.30 0.33 6.12 0.00 -1.22 -4.84 105.19 105.51 2hf5 n GLY 96 Ca 0.03 0.14 0.00 0.00 0.00 0.00 0.00 46.02 46.19 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 -2.83 0.56 -0.09 1.61 6.94 -1.26 -4.78 115.26 115.41 2hf5 n ASN 97 Ca -0.15 -1.70 -0.01 0.00 -0.02 0.00 0.00 54.58 52.70 2hf5 n ASN 97 Cb 0.60 -0.28 -0.00 0.00 -2.36 0.00 0.00 39.78 37.74 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 0.17 0.43 3.21 4.83 0.00 -1.26 -5.02 105.19 107.55 2hf5 n GLY 98 Ca 0.00 -1.00 -0.13 0.00 0.00 0.00 0.00 46.02 44.89 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 -2.04 -0.24 -0.43 1.61 2.02 -1.25 -4.90 117.35 112.11 2hf5 s TYR 99 Ca 0.00 0.51 -0.06 0.00 -0.37 0.00 0.00 57.07 57.15 2hf5 s TYR 99 Cb 0.00 0.09 0.11 0.00 -0.40 0.00 0.00 41.96 41.76 2hf5 s TYR 99 CO 0.00 -0.27 0.26 0.42 -1.57 0.00 0.00 175.55 174.39 2hf5 s ILE 100 N -0.60 3.73 0.31 2.71 1.01 -1.22 -4.65 121.20 122.49 2hf5 s ILE 100 Ca -0.07 -1.87 0.06 0.00 0.00 0.00 0.00 60.65 58.76 2hf5 s ILE 100 Cb -0.04 -3.48 -0.02 0.00 0.01 0.00 0.00 42.46 38.93 2hf5 s ILE 100 CO 0.02 -0.69 0.44 -0.55 0.00 0.00 0.00 174.94 174.16 2hf5 s SER 101 N 2.18 6.10 0.13 3.58 0.15 -1.26 -1.42 113.70 123.15 2hf5 s SER 101 Ca 0.06 -0.06 -0.25 0.00 0.70 0.00 0.00 55.95 56.41 2hf5 s SER 101 Cb -0.24 -1.49 -0.04 0.00 -1.71 0.00 0.00 66.02 62.54 2hf5 s SER 101 CO -0.02 -0.31 1.63 0.00 1.20 0.00 0.00 173.24 175.74 2hf5 h ALA 102 N 0.96 -0.31 -0.53 5.45 0.00 -1.86 0.50 119.26 123.47 2hf5 h ALA 102 Ca -0.48 0.01 0.11 0.00 0.00 0.00 0.00 54.91 54.55 2hf5 h ALA 102 Cb 1.25 0.46 -0.09 0.00 0.00 0.00 0.00 17.79 19.41 2hf5 h ALA 102 CO 0.56 -0.74 -0.06 0.00 0.00 0.00 0.00 179.25 179.01 2hf5 h ALA 103 N 0.49 0.44 -0.04 0.00 0.00 -1.93 0.14 119.26 118.36 2hf5 h ALA 103 Ca 0.07 0.18 0.01 0.00 0.00 0.00 0.00 54.91 55.18 2hf5 h ALA 103 Cb 0.48 0.33 -0.01 0.00 0.00 0.00 0.00 17.79 18.58 2hf5 h ALA 103 CO -0.25 -0.41 -0.03 0.93 0.00 0.00 0.00 179.25 179.48 2hf5 h GLU 104 N 0.06 -0.04 -0.25 0.00 4.39 -1.59 -1.16 114.58 115.99 2hf5 h GLU 104 Ca 0.26 0.00 0.02 0.00 0.34 0.00 0.00 59.36 59.99 2hf5 h GLU 104 Cb 0.41 0.01 -0.02 0.00 -0.10 0.00 0.00 28.75 29.05 2hf5 h GLU 104 CO -0.49 -0.03 0.11 1.25 -1.16 0.00 0.00 179.01 178.69 2hf5 h LEU 105 N -0.04 0.16 -0.58 1.33 6.46 0.82 -1.81 115.31 121.64 2hf5 h LEU 105 Ca 0.03 0.02 -0.15 0.00 -0.12 0.00 0.00 57.88 57.66 2hf5 h LEU 105 Cb 0.08 -0.01 -0.02 0.00 -0.73 0.00 0.00 40.66 39.98 2hf5 h LEU 105 CO -0.06 0.12 -0.70 0.03 -0.62 0.00 0.00 178.44 177.21 2hf5 h ARG 106 N 0.24 0.00 0.00 1.25 3.08 -0.65 0.65 114.38 118.96 2hf5 h ARG 106 Ca 0.10 0.00 -0.09 0.00 0.07 0.00 0.00 59.98 60.06 2hf5 h ARG 106 Cb 0.04 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.08 2hf5 h ARG 106 CO -0.08 0.70 -0.46 0.45 -1.07 0.00 0.00 179.97 179.50 2hf5 h HIS 107 N 0.00 0.00 0.00 3.04 3.86 -0.69 0.91 115.15 122.27 2hf5 h HIS 107 Ca -0.01 0.00 -0.15 0.00 -1.16 0.00 0.00 60.37 59.05 2hf5 h HIS 107 Cb 1.25 0.00 -0.03 0.00 1.06 0.00 0.00 27.41 29.69 2hf5 h HIS 107 CO 0.00 0.44 -1.22 -0.39 0.86 0.00 0.00 177.93 177.62 2hf5 h VAL 108 N 0.00 0.58 0.00 2.45 -1.51 -1.30 -2.61 116.25 113.86 2hf5 h VAL 108 Ca -0.01 -2.04 0.00 0.00 -1.23 0.00 0.00 66.70 63.43 2hf5 h VAL 108 Cb 1.34 2.11 0.00 0.00 -2.13 0.00 0.00 31.29 32.61 2hf5 h VAL 108 CO 0.06 0.33 0.00 0.80 -1.23 0.00 0.00 177.57 177.52 2hf5 n MET 109 N -2.96 0.00 0.00 5.19 0.00 0.22 -4.88 117.12 114.69 2hf5 n MET 109 Ca -0.07 0.33 0.00 0.00 0.00 0.00 0.00 57.70 57.96 2hf5 n MET 109 Cb 0.82 -0.91 0.00 0.00 0.00 0.00 0.00 33.22 33.13 2hf5 n MET 109 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 175.97 176.22 2hf5 n THR 110 N -1.50 0.00 -0.72 1.12 -2.24 0.38 -5.05 114.28 106.26 2hf5 n THR 110 Ca 0.00 0.00 -0.08 0.00 -2.27 0.00 0.00 64.05 61.70 2hf5 n THR 110 Cb 0.00 -0.25 0.06 0.00 -2.10 0.00 0.00 70.33 68.04 2hf5 n THR 110 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 2hf5 n ASN 111 N -1.09 -1.11 -4.66 3.42 4.13 0.29 -4.94 115.26 111.30 2hf5 n ASN 111 Ca 0.00 -0.73 -0.43 0.00 1.68 0.00 0.00 54.58 55.10 2hf5 n ASN 111 Cb 0.17 -0.26 -0.02 0.00 -1.54 0.00 0.00 39.78 38.13 2hf5 n ASN 111 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 2hf5 s LEU 112 N 0.00 4.19 0.00 3.41 1.02 -1.26 -4.58 118.68 121.46 2hf5 s LEU 112 Ca 0.18 1.68 0.00 0.00 0.02 0.00 0.00 54.13 56.01 2hf5 s LEU 112 Cb -0.02 -3.54 0.00 0.00 0.02 0.00 0.00 46.19 42.65 2hf5 s LEU 112 CO 0.14 -0.73 0.00 0.61 0.02 0.00 0.00 176.35 176.39