#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 3.88 0.00 0.00 1.03 -1.26 -4.98 118.70 117.38 2hf5 s GLU 47 Ca 0.00 0.35 0.12 0.00 0.03 0.00 0.00 54.97 55.47 2hf5 s GLU 47 Cb 0.00 -2.96 0.72 0.00 -0.80 0.00 0.00 34.13 31.09 2hf5 s GLU 47 CO 0.00 0.51 1.38 1.28 -1.33 0.00 0.00 175.26 177.10 2hf5 n LEU 48 N 0.84 0.00 -0.34 1.83 7.99 -1.26 -4.10 117.00 121.96 2hf5 n LEU 48 Ca -0.06 0.00 0.13 0.00 -0.01 0.00 0.00 56.01 56.06 2hf5 n LEU 48 Cb 0.52 0.00 0.32 0.00 -0.11 0.00 0.00 43.42 44.15 2hf5 n LEU 48 CO 0.42 0.00 1.17 -0.61 -1.51 0.00 0.00 177.39 176.86 2hf5 h GLN 49 N 0.00 0.69 -0.31 3.23 4.15 -1.98 0.89 115.11 121.78 2hf5 h GLN 49 Ca 0.00 -0.04 0.02 0.00 0.77 0.00 0.00 58.65 59.40 2hf5 h GLN 49 Cb 0.00 -0.16 -0.02 0.00 0.21 0.00 0.00 27.48 27.51 2hf5 h GLN 49 CO 0.00 0.46 0.16 0.22 -1.93 0.00 0.00 178.83 177.74 2hf5 h ASP 50 N 0.71 0.25 0.04 -0.69 3.58 -1.99 0.41 116.42 118.73 2hf5 h ASP 50 Ca 0.57 0.01 -0.05 0.00 0.42 0.00 0.00 57.03 57.98 2hf5 h ASP 50 Cb 0.92 -0.04 -0.01 0.00 1.72 0.00 0.00 39.33 41.91 2hf5 h ASP 50 CO -0.40 0.19 -0.13 -0.03 -2.88 0.00 0.00 179.24 175.98 2hf5 h MET 51 N 0.34 0.21 -0.07 0.28 4.05 -1.28 -0.40 114.93 118.06 2hf5 h MET 51 Ca 0.13 -0.05 -0.00 0.00 -0.28 0.00 0.00 59.70 59.50 2hf5 h MET 51 Cb 0.03 -0.03 -0.00 0.00 -0.80 0.00 0.00 31.60 30.80 2hf5 h MET 51 CO -0.08 0.35 0.03 0.82 0.23 0.00 0.00 176.91 178.27 2hf5 h ILE 52 N 0.20 1.12 0.00 1.77 2.04 -0.02 -0.64 117.51 121.99 2hf5 h ILE 52 Ca 0.04 -0.36 0.00 0.00 1.00 0.00 0.00 64.86 65.55 2hf5 h ILE 52 Cb 0.37 1.23 0.00 0.00 -0.74 0.00 0.00 36.82 37.68 2hf5 h ILE 52 CO 0.02 0.10 0.00 0.78 0.00 0.00 0.00 178.15 179.05 2hf5 h ASN 53 N -0.02 0.00 0.15 1.72 -0.26 -0.23 0.17 115.58 117.10 2hf5 h ASN 53 Ca 0.02 0.00 -0.25 0.00 -0.56 0.00 0.00 56.30 55.51 2hf5 h ASN 53 Cb 0.14 0.00 0.02 0.00 -1.06 0.00 0.00 38.32 37.41 2hf5 h ASN 53 CO -0.00 0.00 -1.19 -0.08 -1.06 0.00 0.00 177.43 175.10 2hf5 h GLU 54 N 0.00 0.33 0.05 0.81 4.22 -0.79 -3.38 114.58 115.81 2hf5 h GLU 54 Ca 0.00 -0.56 -0.26 0.00 0.08 0.00 0.00 59.36 58.62 2hf5 h GLU 54 Cb 0.41 0.21 -0.02 0.00 0.50 0.00 0.00 28.75 29.84 2hf5 h GLU 54 CO 0.00 1.27 -1.33 -0.24 -2.18 0.00 0.00 179.01 176.53 2hf5 h VAL 55 N -0.24 1.35 -2.67 0.32 3.04 -0.67 -3.45 116.25 113.93 2hf5 h VAL 55 Ca -0.23 -3.06 -0.54 0.00 -1.01 0.00 0.00 66.70 61.87 2hf5 h VAL 55 Cb 1.80 2.74 0.01 0.00 -2.01 0.00 0.00 31.29 33.83 2hf5 h VAL 55 CO 0.14 0.82 1.01 -0.62 -1.01 0.00 0.00 177.57 177.91 2hf5 s ASP 56 N -6.69 6.62 -0.18 3.17 -1.08 0.54 -4.89 116.67 114.16 2hf5 s ASP 56 Ca -0.04 2.43 0.11 0.00 -0.52 0.00 0.00 52.55 54.53 2hf5 s ASP 56 Cb 0.08 -2.56 -0.23 0.00 -1.46 0.00 0.00 42.92 38.76 2hf5 s ASP 56 CO 0.84 -0.89 0.13 0.00 0.52 0.00 0.00 175.17 175.77 2hf5 n ALA 57 N 5.93 1.42 0.01 3.66 0.00 -1.26 -4.49 120.51 125.79 2hf5 n ALA 57 Ca 0.16 -1.11 0.00 0.00 0.00 0.00 0.00 53.44 52.50 2hf5 n ALA 57 Cb 0.41 -0.33 0.01 0.00 0.00 0.00 0.00 19.45 19.54 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 -3.00 1.63 -0.80 0.00 5.75 -1.26 -5.00 116.55 113.86 2hf5 n ASP 58 Ca -0.33 -1.57 -0.07 0.00 -0.01 0.00 0.00 54.79 52.80 2hf5 n ASP 58 Cb 1.09 -0.01 -0.01 0.00 -1.03 0.00 0.00 41.12 41.16 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 -0.21 0.19 0.38 6.12 0.00 -1.26 -4.91 105.19 105.51 2hf5 n GLY 59 Ca 0.01 -0.60 0.13 0.00 0.00 0.00 0.00 46.02 45.56 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 0.62 1.18 0.00 1.61 2.04 -1.26 -4.92 115.26 114.53 2hf5 n ASN 60 Ca -0.09 -1.48 0.00 0.00 -0.44 0.00 0.00 54.58 52.58 2hf5 n ASN 60 Cb 0.52 -0.03 0.00 0.00 -2.53 0.00 0.00 39.78 37.74 2hf5 n ASN 60 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 2hf5 n GLY 61 N 1.10 0.75 3.82 4.83 0.00 -1.26 -5.00 105.19 109.43 2hf5 n GLY 61 Ca 0.18 0.00 -0.08 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 -2.45 0.00 0.03 2.61 -1.32 -1.26 -4.88 115.64 108.36 2hf5 s THR 62 Ca 0.00 -0.97 -0.14 0.00 -1.21 0.00 0.00 61.69 59.37 2hf5 s THR 62 Cb 0.00 -2.70 -0.06 0.00 -1.51 0.00 0.00 72.50 68.23 2hf5 s THR 62 CO 0.00 0.00 0.42 -0.51 -2.21 0.00 0.00 174.62 172.32 2hf5 s ILE 63 N -2.62 5.03 0.53 5.08 2.07 -0.72 -4.64 121.20 125.92 2hf5 s ILE 63 Ca 0.15 0.77 0.04 0.00 -1.41 0.00 0.00 60.65 60.20 2hf5 s ILE 63 Cb -0.05 -3.70 0.02 0.00 0.13 0.00 0.00 42.46 38.86 2hf5 s ILE 63 CO 0.10 0.50 0.28 -0.62 -1.91 0.00 0.00 174.94 173.30 2hf5 s ASP 64 N -1.25 4.48 0.11 4.50 -1.08 -1.26 -3.42 116.67 118.75 2hf5 s ASP 64 Ca 0.26 -1.37 -0.22 0.00 -0.52 0.00 0.00 52.55 50.70 2hf5 s ASP 64 Cb -0.16 0.45 -0.08 0.00 -1.46 0.00 0.00 42.92 41.67 2hf5 s ASP 64 CO 0.15 -1.03 1.71 -0.26 0.52 0.00 0.00 175.17 176.26 2hf5 h PHE 65 N 0.93 -0.15 -0.27 -5.34 -1.00 -1.99 0.14 116.94 109.26 2hf5 h PHE 65 Ca -0.39 0.01 0.06 0.00 2.81 0.00 0.00 57.97 60.46 2hf5 h PHE 65 Cb 1.31 0.08 -0.06 0.00 3.61 0.00 0.00 35.95 40.89 2hf5 h PHE 65 CO 1.14 -0.10 -0.09 -1.35 -1.61 0.00 0.00 178.31 176.31 2hf5 h PRO 66 N -0.07 -0.03 0.10 1.51 0.11 -1.99 -1.85 132.00 129.77 2hf5 h PRO 66 Ca 0.05 0.00 0.01 0.00 0.11 0.00 0.00 66.00 66.17 2hf5 h PRO 66 Cb 0.15 0.01 -0.01 0.00 0.11 0.00 0.00 31.00 31.25 2hf5 h PRO 66 CO -0.12 -0.02 -0.12 0.93 -0.21 0.00 0.00 178.00 178.47 2hf5 h GLU 67 N -0.03 -0.24 0.05 1.05 3.07 -1.88 -0.76 114.58 115.84 2hf5 h GLU 67 Ca 0.14 0.02 0.01 0.00 -0.50 0.00 0.00 59.36 59.02 2hf5 h GLU 67 Cb 0.24 0.06 -0.02 0.00 -0.84 0.00 0.00 28.75 28.18 2hf5 h GLU 67 CO -0.30 -0.16 -0.11 0.35 -1.40 0.00 0.00 179.01 177.39 2hf5 h PHE 68 N -0.25 -0.27 0.23 4.33 3.57 -0.54 -0.44 116.94 123.56 2hf5 h PHE 68 Ca 0.01 0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.51 2hf5 h PHE 68 Cb 0.25 0.11 0.00 0.00 2.79 0.00 0.00 35.95 39.11 2hf5 h PHE 68 CO -0.13 -0.16 -0.11 -0.07 -2.23 0.00 0.00 178.31 175.60 2hf5 h LEU 69 N -0.21 -0.26 -0.16 0.59 -0.00 -1.33 -1.87 115.31 112.08 2hf5 h LEU 69 Ca 0.02 -0.25 -0.05 0.00 -0.00 0.00 0.00 57.88 57.60 2hf5 h LEU 69 Cb 0.23 0.07 -0.00 0.00 -0.00 0.00 0.00 40.66 40.95 2hf5 h LEU 69 CO -0.07 0.16 -0.11 0.74 -0.00 0.00 0.00 178.44 179.16 2hf5 h THR 70 N -0.74 1.33 -0.51 0.22 2.02 -1.13 0.97 112.91 115.07 2hf5 h THR 70 Ca -0.03 -1.21 -0.02 0.00 0.77 0.00 0.00 66.41 65.91 2hf5 h THR 70 Cb 0.50 1.78 -0.02 0.00 -1.74 0.00 0.00 68.15 68.66 2hf5 h THR 70 CO 0.05 0.36 0.23 -0.03 0.37 0.00 0.00 175.52 176.50 2hf5 h MET 71 N 0.02 0.71 0.28 6.66 1.85 -1.21 0.82 114.93 124.06 2hf5 h MET 71 Ca 0.03 -0.09 -0.01 0.00 -0.61 0.00 0.00 59.70 59.02 2hf5 h MET 71 Cb 0.62 -0.14 0.00 0.00 0.43 0.00 0.00 31.60 32.51 2hf5 h MET 71 CO 0.03 0.57 -0.13 1.98 -0.40 0.00 0.00 176.91 178.96 2hf5 h MET 72 N 0.71 -0.36 0.00 0.39 -1.53 -1.03 -3.08 114.93 110.04 2hf5 h MET 72 Ca 0.18 0.02 0.00 0.00 -3.44 0.00 0.00 59.70 56.46 2hf5 h MET 72 Cb 0.10 0.08 0.00 0.00 -0.55 0.00 0.00 31.60 31.23 2hf5 h MET 72 CO -0.02 -0.24 0.19 0.00 0.14 0.00 0.00 176.91 176.98 2hf5 h ALA 73 N -1.77 1.18 -0.89 0.39 0.00 -0.70 0.61 119.26 118.08 2hf5 h ALA 73 Ca -0.04 0.00 0.24 0.00 0.00 0.00 0.00 54.91 55.11 2hf5 h ALA 73 Cb 0.28 0.00 -0.14 0.00 0.00 0.00 0.00 17.79 17.94 2hf5 h ALA 73 CO 0.06 -0.18 0.28 -0.09 0.00 0.00 0.00 179.25 179.32 2hf5 h ARG 74 N 0.00 0.23 0.00 0.00 9.65 0.77 -3.34 114.38 121.70 2hf5 h ARG 74 Ca 0.00 -0.01 0.00 0.00 -1.10 0.00 0.00 59.98 58.87 2hf5 h ARG 74 Cb 0.39 -0.05 0.00 0.00 -1.39 0.00 0.00 29.97 28.91 2hf5 h ARG 74 CO 0.00 0.15 -0.50 1.63 2.80 0.00 0.00 179.97 184.05 2hf5 n LYS 75 N -5.19 0.98 -1.39 0.20 5.02 -0.89 -5.08 118.16 111.80 2hf5 n LYS 75 Ca 0.22 0.00 -0.10 0.00 -2.02 0.00 0.00 58.31 56.42 2hf5 n LYS 75 Cb 0.70 -0.75 0.05 0.00 -0.02 0.00 0.00 35.03 35.01 2hf5 n LYS 75 CO 0.00 0.00 0.00 -1.33 -0.52 0.00 0.00 177.40 175.55 2hf5 n MET 76 N -1.64 0.28 -1.70 1.97 2.81 0.21 -5.04 117.12 114.02 2hf5 n MET 76 Ca 0.00 -1.10 -0.39 0.00 -1.81 0.00 0.00 57.70 54.40 2hf5 n MET 76 Cb 0.25 -0.28 0.04 0.00 -0.71 0.00 0.00 33.22 32.52 2hf5 n MET 76 CO 0.00 0.00 0.00 0.36 1.51 0.00 0.00 175.97 177.84 2hf5 n LYS 77 N -1.77 1.45 -3.55 0.03 2.85 -1.26 -3.59 118.16 112.31 2hf5 n LYS 77 Ca 0.07 0.54 -0.37 0.00 -1.05 0.00 0.00 58.31 57.50 2hf5 n LYS 77 Cb 0.24 -2.41 -0.07 0.00 -0.65 0.00 0.00 35.03 32.15 2hf5 n LYS 77 CO 0.00 0.00 0.00 0.16 -0.05 0.00 0.00 177.40 177.51 2hf5 s ASP 78 N -0.97 6.54 -0.27 -5.58 -4.77 -1.26 -2.96 116.67 107.39 2hf5 s ASP 78 Ca 0.72 0.64 0.03 0.00 -3.30 0.00 0.00 52.55 50.64 2hf5 s ASP 78 Cb -0.44 -2.19 0.07 0.00 -1.09 0.00 0.00 42.92 39.27 2hf5 s ASP 78 CO 0.49 0.18 -0.07 -0.89 0.70 0.00 0.00 175.17 175.58 2hf5 s THR 79 N -0.08 2.15 -0.72 2.11 2.01 -1.26 -5.04 115.64 114.81 2hf5 s THR 79 Ca 0.19 -1.76 -0.22 0.00 0.31 0.00 0.00 61.69 60.21 2hf5 s THR 79 Cb -0.14 -2.33 0.08 0.00 0.01 0.00 0.00 72.50 70.11 2hf5 s THR 79 CO 0.07 -0.15 1.03 1.51 -0.69 0.00 0.00 174.62 176.38 2hf5 s ASP 80 N 1.08 6.26 -0.46 3.53 -4.77 -1.26 -4.76 116.67 116.29 2hf5 s ASP 80 Ca -0.05 -1.15 0.06 0.00 -3.30 0.00 0.00 52.55 48.11 2hf5 s ASP 80 Cb -0.20 -2.43 0.30 0.00 -1.09 0.00 0.00 42.92 39.51 2hf5 s ASP 80 CO -0.06 -1.41 1.08 -1.20 0.70 0.00 0.00 175.17 174.29 2hf5 n SER 81 N 7.67 -2.42 -0.18 2.11 7.64 -1.26 -5.04 113.62 122.14 2hf5 n SER 81 Ca 0.02 -3.55 -0.01 0.00 1.01 0.00 0.00 58.87 56.34 2hf5 n SER 81 Cb 0.46 1.88 0.09 0.00 -1.01 0.00 0.00 64.21 65.64 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 3.17 0.22 -0.47 1.43 4.81 -1.99 0.54 114.58 122.30 2hf5 h GLU 82 Ca -0.12 -0.01 0.05 0.00 -0.13 0.00 0.00 59.36 59.14 2hf5 h GLU 82 Cb 1.09 -0.05 -0.04 0.00 0.63 0.00 0.00 28.75 30.38 2hf5 h GLU 82 CO 0.16 0.15 0.22 0.93 -0.73 0.00 0.00 179.01 179.74 2hf5 h GLU 83 N 0.23 0.42 -0.34 1.92 5.08 -1.99 -1.82 114.58 118.08 2hf5 h GLU 83 Ca 0.29 -0.03 -0.15 0.00 -1.00 0.00 0.00 59.36 58.47 2hf5 h GLU 83 Cb 0.42 -0.10 -0.00 0.00 0.50 0.00 0.00 28.75 29.57 2hf5 h GLU 83 CO -0.39 0.28 -0.39 0.93 -1.00 0.00 0.00 179.01 178.45 2hf5 h GLU 84 N 0.44 0.87 -0.27 2.33 5.08 -1.03 -0.40 114.58 121.58 2hf5 h GLU 84 Ca 0.21 -0.47 -0.15 0.00 -1.00 0.00 0.00 59.36 57.94 2hf5 h GLU 84 Cb 0.14 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.41 2hf5 h GLU 84 CO -0.17 1.12 -0.45 0.82 -1.00 0.00 0.00 179.01 179.33 2hf5 h ILE 85 N 0.66 1.29 -0.69 3.13 1.08 -0.03 0.44 117.51 123.40 2hf5 h ILE 85 Ca 0.05 -1.64 -0.05 0.00 -0.39 0.00 0.00 64.86 62.82 2hf5 h ILE 85 Cb 0.98 1.57 -0.03 0.00 -3.07 0.00 0.00 36.82 36.27 2hf5 h ILE 85 CO 0.09 0.53 0.23 0.03 -0.69 0.00 0.00 178.15 178.34 2hf5 h ARG 86 N 0.56 1.07 -0.15 2.37 3.08 -1.25 0.04 114.38 120.10 2hf5 h ARG 86 Ca 0.04 -0.22 -0.06 0.00 0.07 0.00 0.00 59.98 59.80 2hf5 h ARG 86 Cb 1.00 -0.16 -0.01 0.00 0.08 0.00 0.00 29.97 30.88 2hf5 h ARG 86 CO 0.09 0.91 -0.17 1.49 -1.07 0.00 0.00 179.97 181.23 2hf5 h GLU 87 N 1.01 0.25 -0.45 0.04 4.81 -0.67 -2.19 114.58 117.39 2hf5 h GLU 87 Ca 0.23 -0.07 -0.10 0.00 -0.13 0.00 0.00 59.36 59.29 2hf5 h GLU 87 Cb 0.28 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.62 2hf5 h GLU 87 CO -0.01 0.43 -0.11 0.00 -0.73 0.00 0.00 179.01 178.59 2hf5 h ALA 88 N 1.59 0.62 -0.26 2.92 0.00 0.71 0.77 119.26 125.61 2hf5 h ALA 88 Ca 0.04 -0.33 0.05 0.00 0.00 0.00 0.00 54.91 54.67 2hf5 h ALA 88 Cb 0.45 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 2hf5 h ALA 88 CO 0.03 0.51 0.18 0.74 0.00 0.00 0.00 179.25 180.71 2hf5 h PHE 89 N 0.70 0.11 0.12 0.00 -1.00 -0.40 0.83 116.94 117.30 2hf5 h PHE 89 Ca 0.11 0.00 -0.29 0.00 2.81 0.00 0.00 57.97 60.61 2hf5 h PHE 89 Cb 0.65 -0.04 0.03 0.00 3.61 0.00 0.00 35.95 40.21 2hf5 h PHE 89 CO 0.05 0.06 -1.19 -0.09 -1.61 0.00 0.00 178.31 175.53 2hf5 h ARG 90 N 0.11 0.60 0.21 1.51 2.43 -1.02 -3.33 114.38 114.90 2hf5 h ARG 90 Ca 0.12 -0.80 -0.34 0.00 -0.81 0.00 0.00 59.98 58.15 2hf5 h ARG 90 Cb 0.33 0.27 0.02 0.00 -0.42 0.00 0.00 29.97 30.16 2hf5 h ARG 90 CO -0.01 1.36 -1.58 0.28 -1.51 0.00 0.00 179.97 178.51 2hf5 h VAL 91 N 0.21 1.15 0.00 0.20 2.07 0.10 -3.24 116.25 116.75 2hf5 h VAL 91 Ca -0.18 -2.66 0.00 0.00 0.82 0.00 0.00 66.70 64.68 2hf5 h VAL 91 Cb 1.88 2.91 0.00 0.00 -1.52 0.00 0.00 31.29 34.56 2hf5 h VAL 91 CO 0.23 0.83 0.00 0.49 0.02 0.00 0.00 177.57 179.14 2hf5 n PHE 92 N -3.64 0.00 -4.17 1.57 3.01 0.28 -4.71 117.46 109.79 2hf5 n PHE 92 Ca -0.19 0.00 -0.18 0.00 1.01 0.00 0.00 57.45 58.09 2hf5 n PHE 92 Cb 1.09 -0.05 -0.12 0.00 -0.01 0.00 0.00 39.48 40.39 2hf5 n PHE 92 CO 0.00 0.00 0.00 0.34 1.01 0.00 0.00 176.76 178.11 2hf5 s ASP 93 N -0.55 1.60 0.09 4.37 -1.08 -1.22 -3.32 116.67 116.55 2hf5 s ASP 93 Ca 0.00 -0.60 0.01 0.00 -0.52 0.00 0.00 52.55 51.44 2hf5 s ASP 93 Cb 0.00 -0.05 -0.25 0.00 -1.46 0.00 0.00 42.92 41.17 2hf5 s ASP 93 CO 0.00 -0.08 1.17 0.11 0.52 0.00 0.00 175.17 176.89 2hf5 h LYS 94 N 4.36 0.14 -0.01 4.34 1.57 -1.84 -3.33 116.57 121.79 2hf5 h LYS 94 Ca -0.40 -0.24 0.00 0.00 -1.87 0.00 0.00 60.65 58.14 2hf5 h LYS 94 Cb 1.19 0.09 0.00 0.00 0.08 0.00 0.00 32.23 33.59 2hf5 h LYS 94 CO 0.40 1.09 -0.05 -0.40 -0.57 0.00 0.00 179.45 179.93 2hf5 n ASP 95 N -3.43 1.61 -4.07 0.86 5.68 -1.26 -5.01 116.55 110.93 2hf5 n ASP 95 Ca -0.06 -1.31 -0.32 0.00 -0.50 0.00 0.00 54.79 52.61 2hf5 n ASP 95 Cb 0.99 0.12 -0.01 0.00 -1.14 0.00 0.00 41.12 41.08 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 0.61 -0.40 0.54 6.12 0.00 -1.25 -4.84 105.19 105.97 2hf5 n GLY 96 Ca 0.05 0.15 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 -2.79 0.93 -0.65 1.61 6.94 -1.26 -4.77 115.26 115.27 2hf5 n ASN 97 Ca -0.04 -1.58 -0.08 0.00 -0.02 0.00 0.00 54.58 52.87 2hf5 n ASN 97 Cb 0.55 -0.39 -0.03 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 0.15 0.80 3.19 4.83 0.00 -1.26 -5.00 105.19 107.90 2hf5 n GLY 98 Ca 0.00 -0.67 -0.13 0.00 0.00 0.00 0.00 46.02 45.22 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 -2.31 -0.30 -0.45 1.61 2.02 -1.25 -4.94 117.35 111.73 2hf5 s TYR 99 Ca 0.00 0.73 -0.11 0.00 -0.37 0.00 0.00 57.07 57.32 2hf5 s TYR 99 Cb 0.00 0.11 0.09 0.00 -0.40 0.00 0.00 41.96 41.76 2hf5 s TYR 99 CO 0.00 -0.18 0.33 0.42 -1.57 0.00 0.00 175.55 174.55 2hf5 s ILE 100 N -0.00 4.54 0.36 2.71 1.01 -1.22 -4.75 121.20 123.85 2hf5 s ILE 100 Ca -0.01 -1.41 0.07 0.00 0.00 0.00 0.00 60.65 59.30 2hf5 s ILE 100 Cb -0.02 -3.82 -0.00 0.00 0.01 0.00 0.00 42.46 38.62 2hf5 s ILE 100 CO 0.01 -0.61 0.49 -0.44 0.00 0.00 0.00 174.94 174.38 2hf5 s SER 101 N 2.48 5.80 0.11 3.58 0.01 -1.26 -1.76 113.70 122.66 2hf5 s SER 101 Ca 0.04 -0.30 -0.27 0.00 1.31 0.00 0.00 55.95 56.73 2hf5 s SER 101 Cb -0.25 -1.02 -0.09 0.00 0.21 0.00 0.00 66.02 64.88 2hf5 s SER 101 CO 0.03 -0.53 1.63 0.00 0.41 0.00 0.00 173.24 174.78 2hf5 h ALA 102 N 0.84 -0.48 -0.96 1.44 0.00 -1.88 0.22 119.26 118.45 2hf5 h ALA 102 Ca -0.44 -0.05 0.15 0.00 0.00 0.00 0.00 54.91 54.57 2hf5 h ALA 102 Cb 1.26 0.45 -0.09 0.00 0.00 0.00 0.00 17.79 19.41 2hf5 h ALA 102 CO 0.51 -0.82 0.57 0.00 0.00 0.00 0.00 179.25 179.51 2hf5 h ALA 103 N 0.21 1.49 -0.51 0.00 0.00 -1.96 -0.13 119.26 118.36 2hf5 h ALA 103 Ca 0.03 0.06 -0.03 0.00 0.00 0.00 0.00 54.91 54.97 2hf5 h ALA 103 Cb 0.52 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.17 2hf5 h ALA 103 CO -0.16 0.06 0.21 0.93 0.00 0.00 0.00 179.25 180.29 2hf5 h GLU 104 N 0.82 0.75 -0.99 0.00 4.39 -1.61 -2.56 114.58 115.38 2hf5 h GLU 104 Ca 0.51 -0.13 0.06 0.00 0.34 0.00 0.00 59.36 60.13 2hf5 h GLU 104 Cb 0.65 -0.13 -0.06 0.00 -0.10 0.00 0.00 28.75 29.11 2hf5 h GLU 104 CO -0.32 0.66 0.64 -0.07 -1.16 0.00 0.00 179.01 178.76 2hf5 h LEU 105 N 0.68 1.05 -0.15 1.33 3.38 0.11 -2.12 115.31 119.58 2hf5 h LEU 105 Ca 0.17 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.12 2hf5 h LEU 105 Cb 0.18 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.70 2hf5 h LEU 105 CO -0.02 0.68 0.01 0.08 0.09 0.00 0.00 178.44 179.29 2hf5 h ARG 106 N 1.20 0.26 -0.83 1.13 0.11 -0.77 0.68 114.38 116.16 2hf5 h ARG 106 Ca 0.42 -0.08 0.10 0.00 0.10 0.00 0.00 59.98 60.52 2hf5 h ARG 106 Cb 0.11 -0.03 -0.08 0.00 1.11 0.00 0.00 29.97 31.09 2hf5 h ARG 106 CO -0.16 0.47 0.47 1.25 0.10 0.00 0.00 179.97 182.10 2hf5 h HIS 107 N 0.02 0.85 0.03 4.08 2.76 -1.08 0.44 115.15 122.25 2hf5 h HIS 107 Ca 0.04 0.03 -0.14 0.00 -2.20 0.00 0.00 60.37 58.10 2hf5 h HIS 107 Cb 0.35 -0.26 -0.01 0.00 1.55 0.00 0.00 27.41 29.04 2hf5 h HIS 107 CO 0.03 0.33 -0.75 -0.24 -1.30 0.00 0.00 177.93 175.99 2hf5 h VAL 108 N 0.77 1.33 0.00 5.26 3.04 -1.20 -3.17 116.25 122.28 2hf5 h VAL 108 Ca 0.41 -2.31 0.00 0.00 -1.01 0.00 0.00 66.70 63.78 2hf5 h VAL 108 Cb 0.41 2.85 0.00 0.00 -2.01 0.00 0.00 31.29 32.54 2hf5 h VAL 108 CO -0.26 0.53 0.00 0.80 -1.01 0.00 0.00 177.57 177.63 2hf5 n MET 109 N -4.39 0.00 0.00 4.17 0.00 0.23 -4.83 117.12 112.31 2hf5 n MET 109 Ca -0.21 0.39 0.00 0.00 0.00 0.00 0.00 57.70 57.88 2hf5 n MET 109 Cb 0.65 -1.02 0.00 0.00 0.00 0.00 0.00 33.22 32.85 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 -1.66 0.00 -1.58 1.12 -2.24 -1.12 -5.06 114.28 103.74 2hf5 n THR 110 Ca 0.00 0.00 -0.09 0.00 -2.27 0.00 0.00 64.05 61.69 2hf5 n THR 110 Cb 0.00 -0.62 0.06 0.00 -2.10 0.00 0.00 70.33 67.66 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 -2.19 0.14 -4.54 3.42 5.03 0.15 -4.90 115.26 112.37 2hf5 n ASN 111 Ca 0.00 -1.21 -0.54 0.00 0.87 0.00 0.00 54.58 53.70 2hf5 n ASN 111 Cb 0.45 -0.29 -0.07 0.00 -1.02 0.00 0.00 39.78 38.84 2hf5 n ASN 111 CO 0.00 0.00 0.00 -0.11 -1.83 0.00 0.00 177.26 175.32 2hf5 n LEU 112 N 0.00 2.17 -0.03 3.41 -0.00 -1.26 -4.45 117.00 116.84 2hf5 n LEU 112 Ca 0.05 0.73 0.00 0.00 -0.00 0.00 0.00 56.01 56.80 2hf5 n LEU 112 Cb 0.19 -1.18 0.00 0.00 -0.00 0.00 0.00 43.42 42.43 2hf5 n LEU 112 CO 0.13 -0.57 0.26 0.61 -0.00 0.00 0.00 177.39 177.82