#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 3.96 0.00 0.00 8.01 -1.26 -4.87 118.70 124.54 2hf5 s GLU 47 Ca 0.00 1.22 0.17 0.00 0.01 0.00 0.00 54.97 56.37 2hf5 s GLU 47 Cb 0.00 -3.84 1.02 0.00 -4.31 0.00 0.00 34.13 26.99 2hf5 s GLU 47 CO 0.00 -1.06 1.43 1.28 0.01 0.00 0.00 175.26 176.92 2hf5 n LEU 48 N 7.42 0.00 -0.05 1.80 4.77 -1.26 -3.47 117.00 126.20 2hf5 n LEU 48 Ca 0.14 0.00 0.03 0.00 -0.03 0.00 0.00 56.01 56.16 2hf5 n LEU 48 Cb 0.47 0.00 0.38 0.00 -2.33 0.00 0.00 43.42 41.94 2hf5 n LEU 48 CO 0.62 0.00 1.18 -0.61 -1.33 0.00 0.00 177.39 177.25 2hf5 h GLN 49 N 0.00 0.64 -0.22 3.23 4.15 -1.99 0.44 115.11 121.37 2hf5 h GLN 49 Ca 0.00 -0.04 -0.12 0.00 0.77 0.00 0.00 58.65 59.26 2hf5 h GLN 49 Cb 0.00 -0.14 -0.01 0.00 0.21 0.00 0.00 27.48 27.53 2hf5 h GLN 49 CO 0.00 0.42 -0.38 0.38 -1.93 0.00 0.00 178.83 177.32 2hf5 h ASP 50 N 0.66 0.51 -0.09 -0.69 2.03 -1.99 -0.37 116.42 116.49 2hf5 h ASP 50 Ca 0.19 -0.22 -0.12 0.00 -0.73 0.00 0.00 57.03 56.15 2hf5 h ASP 50 Cb -0.05 -0.14 -0.01 0.00 -0.83 0.00 0.00 39.33 38.29 2hf5 h ASP 50 CO -0.04 0.85 -0.32 -0.03 -1.03 0.00 0.00 179.24 178.67 2hf5 h MET 51 N 0.41 0.57 -0.76 4.15 4.05 -1.49 -1.43 114.93 120.43 2hf5 h MET 51 Ca 0.04 -0.25 -0.00 0.00 -0.28 0.00 0.00 59.70 59.21 2hf5 h MET 51 Cb 0.85 -0.01 -0.04 0.00 -0.80 0.00 0.00 31.60 31.60 2hf5 h MET 51 CO 0.07 0.82 0.47 0.82 0.23 0.00 0.00 176.91 179.33 2hf5 h ILE 52 N 0.49 1.21 0.00 1.77 2.04 -0.31 0.08 117.51 122.79 2hf5 h ILE 52 Ca 0.06 -0.43 -0.10 0.00 1.00 0.00 0.00 64.86 65.39 2hf5 h ILE 52 Cb 0.80 0.12 -0.01 0.00 -0.74 0.00 0.00 36.82 36.98 2hf5 h ILE 52 CO 0.07 0.21 -0.46 0.78 0.00 0.00 0.00 178.15 178.75 2hf5 h ASN 53 N 1.04 0.00 0.96 1.72 2.35 -0.53 0.83 115.58 121.95 2hf5 h ASN 53 Ca 0.28 0.00 -0.15 0.00 -0.55 0.00 0.00 56.30 55.88 2hf5 h ASN 53 Cb -0.07 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.28 2hf5 h ASN 53 CO -0.05 0.46 -1.11 -0.08 -1.65 0.00 0.00 177.43 174.99 2hf5 h GLU 54 N 0.00 0.00 0.03 0.81 4.81 -0.64 -3.33 114.58 116.27 2hf5 h GLU 54 Ca -0.00 0.00 -0.28 0.00 -0.13 0.00 0.00 59.36 58.95 2hf5 h GLU 54 Cb 1.10 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 30.45 2hf5 h GLU 54 CO 0.06 0.38 -1.51 0.28 -0.73 0.00 0.00 179.01 177.49 2hf5 h VAL 55 N 0.00 1.11 -1.78 0.32 2.07 -0.87 -3.45 116.25 113.66 2hf5 h VAL 55 Ca -0.11 -2.88 -0.62 0.00 0.82 0.00 0.00 66.70 63.92 2hf5 h VAL 55 Cb 1.53 2.61 0.00 0.00 -1.52 0.00 0.00 31.29 33.90 2hf5 h VAL 55 CO 0.06 0.71 1.31 -0.67 0.02 0.00 0.00 177.57 178.99 2hf5 n ASP 56 N -3.24 3.09 -0.09 0.57 2.03 0.27 -4.85 116.55 114.33 2hf5 n ASP 56 Ca -0.14 0.60 -0.17 0.00 0.52 0.00 0.00 54.79 55.60 2hf5 n ASP 56 Cb 1.02 -1.40 -0.13 0.00 -0.72 0.00 0.00 41.12 39.89 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 8.99 1.33 0.17 -1.67 0.00 -1.26 -4.65 120.51 123.42 2hf5 n ALA 57 Ca 0.30 -1.01 0.02 0.00 0.00 0.00 0.00 53.44 52.74 2hf5 n ALA 57 Cb 0.33 -0.27 -0.03 0.00 0.00 0.00 0.00 19.45 19.48 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 -3.23 0.73 0.00 0.00 5.68 -1.26 -5.02 116.55 113.45 2hf5 n ASP 58 Ca -0.40 -0.52 0.00 0.00 -0.50 0.00 0.00 54.79 53.37 2hf5 n ASP 58 Cb 1.03 1.03 0.00 0.00 -1.14 0.00 0.00 41.12 42.03 2hf5 n ASP 58 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2hf5 n GLY 59 N 1.26 1.00 0.00 6.12 0.00 -1.26 -4.95 105.19 107.36 2hf5 n GLY 59 Ca 0.01 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.17 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 0.00 0.01 0.00 1.61 6.94 -1.26 -4.90 115.26 117.66 2hf5 n ASN 60 Ca 0.00 -0.14 0.00 0.00 -0.02 0.00 0.00 54.58 54.42 2hf5 n ASN 60 Cb 0.00 -0.28 0.00 0.00 -2.36 0.00 0.00 39.78 37.14 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 1.29 1.08 3.11 4.83 0.00 -1.26 -4.96 105.19 109.29 2hf5 n GLY 61 Ca 0.14 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.07 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 -3.94 0.14 0.27 2.61 -1.32 -1.26 -4.84 115.64 107.30 2hf5 s THR 62 Ca 0.00 -1.13 -0.29 0.00 -1.21 0.00 0.00 61.69 59.06 2hf5 s THR 62 Cb 0.00 -0.92 -0.09 0.00 -1.51 0.00 0.00 72.50 69.97 2hf5 s THR 62 CO 0.00 -0.62 1.01 -0.63 -2.21 0.00 0.00 174.62 172.17 2hf5 s ILE 63 N -2.69 3.83 0.49 5.08 1.01 -0.63 -4.83 121.20 123.46 2hf5 s ILE 63 Ca -0.04 1.80 0.06 0.00 0.00 0.00 0.00 60.65 62.46 2hf5 s ILE 63 Cb -0.01 -4.12 0.01 0.00 0.01 0.00 0.00 42.46 38.34 2hf5 s ILE 63 CO -0.05 0.39 0.32 -0.62 0.00 0.00 0.00 174.94 174.98 2hf5 s ASP 64 N -1.11 4.61 0.13 3.58 -1.08 -1.26 -3.01 116.67 118.51 2hf5 s ASP 64 Ca 0.44 -1.17 -0.22 0.00 -0.52 0.00 0.00 52.55 51.08 2hf5 s ASP 64 Cb -0.28 0.08 -0.03 0.00 -1.46 0.00 0.00 42.92 41.23 2hf5 s ASP 64 CO 0.35 -0.89 1.68 -0.26 0.52 0.00 0.00 175.17 176.56 2hf5 h PHE 65 N 0.99 -0.30 -0.65 -5.34 -1.00 -1.97 0.28 116.94 108.95 2hf5 h PHE 65 Ca -0.39 0.02 0.04 0.00 2.81 0.00 0.00 57.97 60.45 2hf5 h PHE 65 Cb 1.29 0.15 -0.05 0.00 3.61 0.00 0.00 35.95 40.95 2hf5 h PHE 65 CO 0.88 -0.18 0.38 -1.35 -1.61 0.00 0.00 178.31 176.42 2hf5 h PRO 66 N -0.14 0.70 -0.10 1.51 0.11 -1.99 -2.04 132.00 130.06 2hf5 h PRO 66 Ca 0.09 -0.04 -0.02 0.00 0.11 0.00 0.00 66.00 66.14 2hf5 h PRO 66 Cb 0.27 -0.16 -0.00 0.00 0.11 0.00 0.00 31.00 31.22 2hf5 h PRO 66 CO -0.22 0.47 -0.00 0.93 -0.21 0.00 0.00 178.00 178.97 2hf5 h GLU 67 N 0.73 0.18 -0.51 1.05 5.08 -1.80 0.45 114.58 119.75 2hf5 h GLU 67 Ca 0.27 -0.06 0.05 0.00 -1.00 0.00 0.00 59.36 58.63 2hf5 h GLU 67 Cb 0.10 -0.02 -0.05 0.00 0.50 0.00 0.00 28.75 29.28 2hf5 h GLU 67 CO -0.14 0.44 0.24 0.35 -1.00 0.00 0.00 179.01 178.90 2hf5 h PHE 68 N -0.10 0.43 -0.53 4.33 3.57 -0.39 0.29 116.94 124.53 2hf5 h PHE 68 Ca 0.03 0.02 -0.10 0.00 3.53 0.00 0.00 57.97 61.45 2hf5 h PHE 68 Cb 0.36 -0.12 -0.02 0.00 2.79 0.00 0.00 35.95 38.97 2hf5 h PHE 68 CO 0.04 0.19 -0.06 -0.07 -2.23 0.00 0.00 178.31 176.18 2hf5 h LEU 69 N 0.46 0.93 -0.03 0.59 3.38 -1.25 -0.71 115.31 118.67 2hf5 h LEU 69 Ca 0.23 -0.28 -0.10 0.00 0.09 0.00 0.00 57.88 57.82 2hf5 h LEU 69 Cb 0.18 -0.25 0.01 0.00 0.09 0.00 0.00 40.66 40.68 2hf5 h LEU 69 CO -0.18 1.02 -0.37 0.74 0.09 0.00 0.00 178.44 179.74 2hf5 h THR 70 N 0.86 1.46 -0.13 0.22 2.02 -0.23 0.15 112.91 117.26 2hf5 h THR 70 Ca 0.15 -1.88 -0.02 0.00 0.77 0.00 0.00 66.41 65.42 2hf5 h THR 70 Cb 0.59 2.53 -0.01 0.00 -1.74 0.00 0.00 68.15 69.52 2hf5 h THR 70 CO 0.04 0.53 -0.00 0.24 0.37 0.00 0.00 175.52 176.70 2hf5 h MET 71 N -0.25 0.19 0.04 6.66 2.86 -0.47 0.43 114.93 124.40 2hf5 h MET 71 Ca -0.04 -0.02 -0.00 0.00 -2.06 0.00 0.00 59.70 57.58 2hf5 h MET 71 Cb 1.07 -0.04 0.00 0.00 0.06 0.00 0.00 31.60 32.69 2hf5 h MET 71 CO 0.07 0.21 -0.02 1.98 1.06 0.00 0.00 176.91 180.22 2hf5 h MET 72 N 0.19 -0.05 0.00 1.72 -1.53 -1.03 -3.26 114.93 110.97 2hf5 h MET 72 Ca 0.05 0.00 0.00 0.00 -3.44 0.00 0.00 59.70 56.31 2hf5 h MET 72 Cb 0.14 0.01 0.00 0.00 -0.55 0.00 0.00 31.60 31.20 2hf5 h MET 72 CO 0.00 -0.04 0.17 0.00 0.14 0.00 0.00 176.91 177.18 2hf5 n ALA 73 N -2.07 0.79 -0.35 0.39 0.00 0.03 -2.27 120.51 117.03 2hf5 n ALA 73 Ca -0.01 0.12 0.05 0.00 0.00 0.00 0.00 53.44 53.61 2hf5 n ALA 73 Cb 0.02 -0.95 0.13 0.00 0.00 0.00 0.00 19.45 18.65 2hf5 n ALA 73 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 2hf5 n ARG 74 N -1.97 -0.10 0.00 0.00 3.00 0.15 -3.96 116.66 113.78 2hf5 n ARG 74 Ca -0.01 1.50 0.00 0.00 -0.00 0.00 0.00 57.85 59.34 2hf5 n ARG 74 Cb 0.19 -2.24 0.00 0.00 0.00 0.00 0.00 32.46 30.40 2hf5 n ARG 74 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.63 177.99 2hf5 n LYS 75 N -5.56 0.89 -3.84 -0.14 2.85 -1.16 -5.04 118.16 106.16 2hf5 n LYS 75 Ca 0.15 0.00 -0.36 0.00 -1.05 0.00 0.00 58.31 57.05 2hf5 n LYS 75 Cb 0.47 -0.76 -0.13 0.00 -0.65 0.00 0.00 35.03 33.96 2hf5 n LYS 75 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 2hf5 s MET 76 N -1.52 3.00 -0.26 -1.58 0.23 -0.96 -5.08 119.30 113.13 2hf5 s MET 76 Ca 0.00 -0.90 -0.07 0.00 -1.03 0.00 0.00 55.69 53.70 2hf5 s MET 76 Cb 0.00 -3.21 -0.01 0.00 -1.53 0.00 0.00 34.83 30.08 2hf5 s MET 76 CO 0.00 -0.42 0.06 0.21 -2.03 0.00 0.00 175.02 172.84 2hf5 s LYS 77 N 1.43 3.40 0.00 3.16 2.47 -1.26 -2.68 119.74 126.25 2hf5 s LYS 77 Ca 0.02 -0.65 0.00 0.00 -1.56 0.00 0.00 55.97 53.78 2hf5 s LYS 77 Cb -0.17 -3.30 0.00 0.00 -1.46 0.00 0.00 37.83 32.90 2hf5 s LYS 77 CO -0.00 -0.29 0.00 -3.47 0.16 0.00 0.00 175.35 171.74 2hf5 n ASP 78 N 4.89 0.00 -4.73 1.43 2.03 -1.26 -5.04 116.55 113.86 2hf5 n ASP 78 Ca -0.16 0.00 -0.41 0.00 0.52 0.00 0.00 54.79 54.74 2hf5 n ASP 78 Cb 0.50 0.00 -0.05 0.00 -0.72 0.00 0.00 41.12 40.85 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 3.39 4.48 -0.57 5.18 2.01 -1.26 -5.01 115.64 123.87 2hf5 s THR 79 Ca 0.00 2.03 0.06 0.00 0.31 0.00 0.00 61.69 64.09 2hf5 s THR 79 Cb 0.00 -4.30 0.21 0.00 0.01 0.00 0.00 72.50 68.41 2hf5 s THR 79 CO 0.00 0.34 0.54 -0.90 -0.69 0.00 0.00 174.62 173.90 2hf5 n ASP 80 N 2.67 1.99 -4.11 3.53 5.75 -1.26 -4.94 116.55 120.18 2hf5 n ASP 80 Ca 0.01 -3.01 -0.32 0.00 -0.01 0.00 0.00 54.79 51.47 2hf5 n ASP 80 Cb 0.49 -0.67 -0.16 0.00 -1.03 0.00 0.00 41.12 39.75 2hf5 n ASP 80 CO 0.00 0.00 0.00 -0.55 -0.11 0.00 0.00 177.20 176.54 2hf5 s SER 81 N -1.37 2.94 0.43 -1.12 0.15 -1.26 -5.02 113.70 108.44 2hf5 s SER 81 Ca 0.32 -0.57 0.10 0.00 0.70 0.00 0.00 55.95 56.50 2hf5 s SER 81 Cb 0.06 -1.35 0.94 0.00 -1.71 0.00 0.00 66.02 63.97 2hf5 s SER 81 CO -0.12 0.02 2.05 -0.08 1.20 0.00 0.00 173.24 176.31 2hf5 h GLU 82 N 7.64 0.45 0.13 5.44 4.81 -1.97 0.11 114.58 131.19 2hf5 h GLU 82 Ca -0.37 -0.03 0.02 0.00 -0.13 0.00 0.00 59.36 58.85 2hf5 h GLU 82 Cb 1.16 -0.10 -0.03 0.00 0.63 0.00 0.00 28.75 30.41 2hf5 h GLU 82 CO 0.56 0.30 -0.24 0.93 -0.73 0.00 0.00 179.01 179.83 2hf5 h GLU 83 N 0.46 -0.44 -0.59 1.92 5.08 -1.98 0.33 114.58 119.37 2hf5 h GLU 83 Ca 0.17 0.03 -0.08 0.00 -1.00 0.00 0.00 59.36 58.48 2hf5 h GLU 83 Cb 0.10 0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.43 2hf5 h GLU 83 CO -0.04 -0.29 0.06 0.93 -1.00 0.00 0.00 179.01 178.66 2hf5 h GLU 84 N -0.46 1.00 -0.64 2.33 4.39 -1.51 0.14 114.58 119.84 2hf5 h GLU 84 Ca 0.02 -0.29 -0.08 0.00 0.34 0.00 0.00 59.36 59.36 2hf5 h GLU 84 Cb 0.47 -0.11 -0.03 0.00 -0.10 0.00 0.00 28.75 28.99 2hf5 h GLU 84 CO -0.13 0.97 0.10 0.82 -1.16 0.00 0.00 179.01 179.61 2hf5 h ILE 85 N 0.90 1.26 -0.53 3.13 1.08 -0.76 -0.87 117.51 121.72 2hf5 h ILE 85 Ca 0.17 -1.01 -0.12 0.00 -0.39 0.00 0.00 64.86 63.52 2hf5 h ILE 85 Cb 0.48 0.65 -0.02 0.00 -3.07 0.00 0.00 36.82 34.86 2hf5 h ILE 85 CO 0.02 0.38 -0.12 -0.09 -0.69 0.00 0.00 178.15 177.65 2hf5 h ARG 86 N 0.98 1.01 -0.93 2.37 2.43 0.13 -1.66 114.38 118.72 2hf5 h ARG 86 Ca 0.20 -0.38 0.03 0.00 -0.81 0.00 0.00 59.98 59.02 2hf5 h ARG 86 Cb 0.42 -0.06 -0.05 0.00 -0.42 0.00 0.00 29.97 29.86 2hf5 h ARG 86 CO 0.01 1.06 0.61 0.93 -1.51 0.00 0.00 179.97 181.07 2hf5 h GLU 87 N 0.90 1.16 -0.64 0.20 4.39 -0.38 -1.83 114.58 118.39 2hf5 h GLU 87 Ca 0.14 -0.07 0.00 0.00 0.34 0.00 0.00 59.36 59.77 2hf5 h GLU 87 Cb 0.68 -0.26 -0.03 0.00 -0.10 0.00 0.00 28.75 29.04 2hf5 h GLU 87 CO 0.05 0.77 0.41 0.00 -1.16 0.00 0.00 179.01 179.07 2hf5 h ALA 88 N 1.37 0.81 -0.61 3.43 0.00 -0.65 -1.54 119.26 122.07 2hf5 h ALA 88 Ca 0.36 -0.06 0.07 0.00 0.00 0.00 0.00 54.91 55.28 2hf5 h ALA 88 Cb -0.03 -0.26 -0.06 0.00 0.00 0.00 0.00 17.79 17.44 2hf5 h ALA 88 CO -0.11 0.26 0.30 0.74 0.00 0.00 0.00 179.25 180.44 2hf5 h PHE 89 N 0.86 0.54 0.00 0.00 -1.00 -0.48 0.68 116.94 117.54 2hf5 h PHE 89 Ca 0.23 0.03 -0.07 0.00 2.81 0.00 0.00 57.97 60.96 2hf5 h PHE 89 Cb -0.07 -0.15 -0.01 0.00 3.61 0.00 0.00 35.95 39.33 2hf5 h PHE 89 CO -0.02 0.23 -0.35 0.07 -1.61 0.00 0.00 178.31 176.63 2hf5 h ARG 90 N 0.55 0.00 0.00 1.51 0.11 -1.24 -2.60 114.38 112.71 2hf5 h ARG 90 Ca 0.29 0.00 -0.00 0.00 0.10 0.00 0.00 59.98 60.37 2hf5 h ARG 90 Cb 0.25 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.33 2hf5 h ARG 90 CO -0.22 0.35 -0.00 0.28 0.10 0.00 0.00 179.97 180.48 2hf5 h VAL 91 N 0.00 1.72 -0.11 0.08 2.07 -0.22 -3.38 116.25 116.41 2hf5 h VAL 91 Ca -0.00 -2.12 -0.01 0.00 0.82 0.00 0.00 66.70 65.39 2hf5 h VAL 91 Cb 1.08 3.16 -0.01 0.00 -1.52 0.00 0.00 31.29 34.00 2hf5 h VAL 91 CO 0.05 0.55 0.05 -0.26 0.02 0.00 0.00 177.57 177.98 2hf5 h PHE 92 N -0.90 0.17 -4.08 1.57 -1.00 0.26 -3.45 116.94 109.51 2hf5 h PHE 92 Ca -0.00 -0.01 -0.53 0.00 2.81 0.00 0.00 57.97 60.24 2hf5 h PHE 92 Cb 0.90 -0.05 0.12 0.00 3.61 0.00 0.00 35.95 40.53 2hf5 h PHE 92 CO 0.24 0.24 0.50 0.34 -1.61 0.00 0.00 178.31 178.02 2hf5 s ASP 93 N -5.47 5.20 0.12 2.17 -1.08 -0.98 -3.93 116.67 112.70 2hf5 s ASP 93 Ca -0.14 2.47 -0.12 0.00 -0.52 0.00 0.00 52.55 54.25 2hf5 s ASP 93 Cb 0.06 -2.61 -0.09 0.00 -1.46 0.00 0.00 42.92 38.82 2hf5 s ASP 93 CO 0.69 -1.59 1.40 0.11 0.52 0.00 0.00 175.17 176.30 2hf5 h LYS 94 N 1.02 0.88 -0.15 4.34 1.57 -1.86 -3.21 116.57 119.16 2hf5 h LYS 94 Ca -0.51 -0.56 0.00 0.00 -1.87 0.00 0.00 60.65 57.71 2hf5 h LYS 94 Cb 1.30 0.07 0.00 0.00 0.08 0.00 0.00 32.23 33.68 2hf5 h LYS 94 CO 0.56 1.20 0.00 -0.25 -0.57 0.00 0.00 179.45 180.38 2hf5 n ASP 95 N -4.01 3.16 -2.95 0.86 9.92 -1.26 -4.95 116.55 117.31 2hf5 n ASP 95 Ca -0.04 -1.99 -0.17 0.00 -0.53 0.00 0.00 54.79 52.05 2hf5 n ASP 95 Cb 0.63 -0.09 -0.01 0.00 -0.64 0.00 0.00 41.12 41.02 2hf5 n ASP 95 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2hf5 n GLY 96 N 1.40 -0.49 0.50 0.44 0.00 -1.21 -4.83 105.19 100.98 2hf5 n GLY 96 Ca 0.16 0.05 0.00 0.00 0.00 0.00 0.00 46.02 46.22 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 -2.03 0.85 -0.05 1.61 6.94 -1.26 -4.75 115.26 116.57 2hf5 n ASN 97 Ca -0.06 -1.71 -0.01 0.00 -0.02 0.00 0.00 54.58 52.79 2hf5 n ASN 97 Cb 0.56 -0.42 -0.00 0.00 -2.36 0.00 0.00 39.78 37.55 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 0.08 0.41 3.22 4.83 0.00 -1.26 -5.02 105.19 107.43 2hf5 n GLY 98 Ca 0.00 -1.01 -0.12 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 -2.03 -0.06 -0.30 1.61 2.02 -1.26 -4.86 117.35 112.47 2hf5 s TYR 99 Ca 0.00 -0.04 0.02 0.00 -0.37 0.00 0.00 57.07 56.67 2hf5 s TYR 99 Cb 0.00 0.05 0.07 0.00 -0.40 0.00 0.00 41.96 41.68 2hf5 s TYR 99 CO 0.00 -0.44 -0.03 0.42 -1.57 0.00 0.00 175.55 173.93 2hf5 s ILE 100 N -2.19 2.48 0.48 2.71 1.01 -1.17 -4.22 121.20 120.31 2hf5 s ILE 100 Ca -0.08 -1.75 0.08 0.00 0.00 0.00 0.00 60.65 58.90 2hf5 s ILE 100 Cb -0.02 -2.54 0.02 0.00 0.01 0.00 0.00 42.46 39.92 2hf5 s ILE 100 CO -0.01 -0.21 0.53 -0.55 0.00 0.00 0.00 174.94 174.69 2hf5 s SER 101 N 1.15 5.12 0.04 3.58 0.15 -1.26 -1.61 113.70 120.87 2hf5 s SER 101 Ca -0.03 -0.79 -0.26 0.00 0.70 0.00 0.00 55.95 55.57 2hf5 s SER 101 Cb -0.20 -0.19 -0.17 0.00 -1.71 0.00 0.00 66.02 63.75 2hf5 s SER 101 CO -0.05 -0.93 1.46 0.00 1.20 0.00 0.00 173.24 174.92 2hf5 h ALA 102 N 0.68 -0.37 -1.00 5.45 0.00 -1.89 0.22 119.26 122.34 2hf5 h ALA 102 Ca -0.37 -0.15 0.19 0.00 0.00 0.00 0.00 54.91 54.58 2hf5 h ALA 102 Cb 1.28 0.14 -0.10 0.00 0.00 0.00 0.00 17.79 19.11 2hf5 h ALA 102 CO 0.51 -0.61 0.61 0.00 0.00 0.00 0.00 179.25 179.76 2hf5 h ALA 103 N 0.10 1.70 -0.53 0.00 0.00 -1.97 -0.27 119.26 118.30 2hf5 h ALA 103 Ca -0.04 0.07 -0.11 0.00 0.00 0.00 0.00 54.91 54.84 2hf5 h ALA 103 Cb 0.41 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.10 2hf5 h ALA 103 CO 0.06 -0.06 -0.10 0.93 0.00 0.00 0.00 179.25 180.08 2hf5 h GLU 104 N 0.76 0.98 -0.70 0.00 4.39 -1.74 -2.34 114.58 115.93 2hf5 h GLU 104 Ca 0.57 -0.35 0.12 0.00 0.34 0.00 0.00 59.36 60.04 2hf5 h GLU 104 Cb 0.90 -0.07 -0.08 0.00 -0.10 0.00 0.00 28.75 29.40 2hf5 h GLU 104 CO -0.36 1.02 0.28 -0.07 -1.16 0.00 0.00 179.01 178.72 2hf5 h LEU 105 N 0.87 0.29 -0.49 1.33 3.38 0.12 -1.38 115.31 119.43 2hf5 h LEU 105 Ca 0.14 0.09 -0.16 0.00 0.09 0.00 0.00 57.88 58.04 2hf5 h LEU 105 Cb 0.65 0.06 -0.01 0.00 0.09 0.00 0.00 40.66 41.45 2hf5 h LEU 105 CO 0.05 0.14 -0.55 0.03 0.09 0.00 0.00 178.44 178.20 2hf5 h ARG 106 N 0.46 0.60 -0.40 1.13 3.08 -1.10 0.51 114.38 118.66 2hf5 h ARG 106 Ca 0.37 -0.38 0.08 0.00 0.07 0.00 0.00 59.98 60.12 2hf5 h ARG 106 Cb 0.49 0.04 -0.09 0.00 0.08 0.00 0.00 29.97 30.50 2hf5 h ARG 106 CO -0.35 0.99 -0.25 1.25 -1.07 0.00 0.00 179.97 180.54 2hf5 h HIS 107 N 0.46 -0.66 0.15 3.04 2.76 -0.75 0.47 115.15 120.62 2hf5 h HIS 107 Ca 0.01 0.05 -0.35 0.00 -2.20 0.00 0.00 60.37 57.88 2hf5 h HIS 107 Cb 1.10 0.35 -0.00 0.00 1.55 0.00 0.00 27.41 30.40 2hf5 h HIS 107 CO 0.05 -0.32 -1.79 -0.24 -1.30 0.00 0.00 177.93 174.33 2hf5 h VAL 108 N -0.18 0.88 0.00 5.26 3.04 -1.15 -3.35 116.25 120.74 2hf5 h VAL 108 Ca 0.19 -2.52 0.00 0.00 -1.01 0.00 0.00 66.70 63.36 2hf5 h VAL 108 Cb 0.48 2.67 0.00 0.00 -2.01 0.00 0.00 31.29 32.43 2hf5 h VAL 108 CO -0.51 0.85 0.00 0.80 -1.01 0.00 0.00 177.57 177.70 2hf5 n MET 109 N -3.51 0.00 0.00 4.17 0.00 0.18 -4.83 117.12 113.13 2hf5 n MET 109 Ca -0.25 0.42 0.00 0.00 0.00 0.00 0.00 57.70 57.87 2hf5 n MET 109 Cb 1.06 -1.13 0.00 0.00 0.00 0.00 0.00 33.22 33.15 2hf5 n MET 109 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 175.97 178.38 2hf5 n THR 110 N -1.75 0.00 -2.94 1.12 -1.04 -1.15 -5.06 114.28 103.47 2hf5 n THR 110 Ca 0.00 0.00 -0.10 0.00 -2.04 0.00 0.00 64.05 61.91 2hf5 n THR 110 Cb 0.00 -0.47 0.04 0.00 -1.82 0.00 0.00 70.33 68.07 2hf5 n THR 110 CO 0.00 0.00 0.00 -3.20 -0.64 0.00 0.00 175.07 171.23 2hf5 n ASN 111 N -1.68 0.99 -4.69 8.00 5.15 0.16 -5.02 115.26 118.17 2hf5 n ASN 111 Ca 0.00 -1.73 -0.35 0.00 -0.60 0.00 0.00 54.58 51.90 2hf5 n ASN 111 Cb 0.30 -0.22 -0.09 0.00 -0.53 0.00 0.00 39.78 39.24 2hf5 n ASN 111 CO 0.00 0.00 0.00 -0.22 1.40 0.00 0.00 177.26 178.44 2hf5 s LEU 112 N 0.00 4.07 0.00 1.20 2.96 -1.25 -4.09 118.68 121.56 2hf5 s LEU 112 Ca 0.30 0.16 0.01 0.00 -0.22 0.00 0.00 54.13 54.38 2hf5 s LEU 112 Cb -0.02 -2.05 0.00 0.00 0.50 0.00 0.00 46.19 44.62 2hf5 s LEU 112 CO 0.19 0.16 0.52 0.61 -1.32 0.00 0.00 176.35 176.51