#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2hg7 s ILE 2 N 0.00 4.28 0.26 1.12 1.09 -1.26 -1.22 121.20 125.47 2hg7 s ILE 2 Ca 0.00 -1.26 0.05 0.00 -1.10 0.00 0.00 60.65 58.34 2hg7 s ILE 2 Cb 0.00 -3.55 -0.01 0.00 -1.06 0.00 0.00 42.46 37.83 2hg7 s ILE 2 CO 0.00 -0.42 1.61 -0.07 -0.10 0.00 0.00 174.94 175.96 2hg7 h LEU 3 N 8.40 0.27 -0.19 2.97 -0.00 -1.60 -3.28 115.31 121.88 2hg7 h LEU 3 Ca -0.23 -0.14 0.05 0.00 -0.00 0.00 0.00 57.88 57.56 2hg7 h LEU 3 Cb 1.09 -0.08 -0.07 0.00 -0.00 0.00 0.00 40.66 41.60 2hg7 h LEU 3 CO 0.73 0.75 -0.29 0.22 -0.00 0.00 0.00 178.44 179.85 2hg7 h TYR 4 N 0.19 -0.78 -0.16 1.13 5.03 -1.92 0.84 116.97 121.29 2hg7 h TYR 4 Ca 0.00 0.04 -0.01 0.00 2.58 0.00 0.00 58.73 61.34 2hg7 h TYR 4 Cb 0.99 0.37 -0.01 0.00 1.55 0.00 0.00 36.73 39.64 2hg7 h TYR 4 CO 0.02 -0.36 0.05 -0.44 -1.32 0.00 0.00 178.16 176.11 2hg7 h ASP 5 N -0.33 0.24 -0.21 -2.11 3.32 -1.98 -1.53 116.42 113.82 2hg7 h ASP 5 Ca 0.12 -0.20 0.04 0.00 0.02 0.00 0.00 57.03 57.01 2hg7 h ASP 5 Cb 0.51 -0.06 -0.03 0.00 0.22 0.00 0.00 39.33 39.96 2hg7 h ASP 5 CO -0.37 0.37 -0.01 0.00 -1.72 0.00 0.00 179.24 177.51 2hg7 h ALA 6 N 0.88 0.18 -0.34 3.45 0.00 -1.50 -0.67 119.26 121.25 2hg7 h ALA 6 Ca 0.05 0.06 -0.12 0.00 0.00 0.00 0.00 54.91 54.91 2hg7 h ALA 6 Cb 0.22 0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 2hg7 h ALA 6 CO -0.00 -0.44 -0.25 0.82 0.00 0.00 0.00 179.25 179.38 2hg7 h ILE 7 N 0.05 1.29 -0.41 0.00 2.04 -0.85 -2.22 117.51 117.41 2hg7 h ILE 7 Ca 0.10 -1.40 -0.05 0.00 1.00 0.00 0.00 64.86 64.51 2hg7 h ILE 7 Cb 0.13 1.43 -0.02 0.00 -0.74 0.00 0.00 36.82 37.63 2hg7 h ILE 7 CO -0.18 0.46 0.06 -0.03 0.00 0.00 0.00 178.15 178.45 2hg7 h MET 8 N 0.55 0.64 -0.20 2.37 4.05 -1.05 0.81 114.93 122.10 2hg7 h MET 8 Ca 0.07 -0.13 -0.11 0.00 -0.28 0.00 0.00 59.70 59.24 2hg7 h MET 8 Cb 0.81 -0.10 -0.00 0.00 -0.80 0.00 0.00 31.60 31.52 2hg7 h MET 8 CO 0.07 0.62 -0.32 -0.92 0.23 0.00 0.00 176.91 176.59 2hg7 h TYR 9 N 0.61 0.71 -0.09 1.39 3.20 -1.05 -3.15 116.97 118.59 2hg7 h TYR 9 Ca 0.13 -0.24 -0.05 0.00 3.14 0.00 0.00 58.73 61.71 2hg7 h TYR 9 Cb 0.30 -0.14 -0.00 0.00 1.54 0.00 0.00 36.73 38.43 2hg7 h TYR 9 CO 0.01 0.97 -0.14 -0.22 -1.64 0.00 0.00 178.16 177.15 2hg7 h LYS 10 N 0.25 0.25 -3.66 1.82 3.11 -0.97 -3.38 116.57 113.99 2hg7 h LYS 10 Ca 0.02 -0.15 -0.64 0.00 -2.81 0.00 0.00 60.65 57.07 2hg7 h LYS 10 Cb 0.90 0.01 -0.41 0.00 -1.00 0.00 0.00 32.23 31.74 2hg7 h LYS 10 CO 0.07 0.72 -0.66 0.71 -2.81 0.00 0.00 179.45 177.48 2hg7 s TYR 11 N -4.11 3.23 0.45 1.91 2.02 0.24 -4.96 117.35 116.14 2hg7 s TYR 11 Ca -0.15 -3.08 0.21 0.00 -0.37 0.00 0.00 57.07 53.68 2hg7 s TYR 11 Cb 0.04 -2.78 1.24 0.00 -0.40 0.00 0.00 41.96 40.06 2hg7 s TYR 11 CO 0.74 -0.79 2.04 -1.35 -1.57 0.00 0.00 175.55 174.62 2hg7 h PRO 12 N 6.78 0.00 -0.58 -1.71 0.11 -1.74 -1.95 132.00 132.91 2hg7 h PRO 12 Ca -0.07 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.04 2hg7 h PRO 12 Cb 0.92 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.03 2hg7 h PRO 12 CO 0.64 0.15 0.00 0.09 -0.21 0.00 0.00 178.00 178.66 2hg7 n ASN 13 N -4.01 3.28 -4.65 -2.05 3.02 -1.26 -4.84 115.26 104.76 2hg7 n ASN 13 Ca -0.02 -2.18 -0.40 0.00 -0.03 0.00 0.00 54.58 51.95 2hg7 n ASN 13 Cb 0.23 -0.43 -0.07 0.00 -0.61 0.00 0.00 39.78 38.90 2hg7 n ASN 13 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2hg7 s ALA 14 N -1.56 3.57 -0.49 5.41 0.00 -0.73 -5.03 121.76 122.93 2hg7 s ALA 14 Ca 0.37 -0.42 -0.15 0.00 0.00 0.00 0.00 51.96 51.75 2hg7 s ALA 14 Cb 0.22 -2.91 0.09 0.00 0.00 0.00 0.00 23.12 20.52 2hg7 s ALA 14 CO 0.21 -0.60 0.42 0.08 0.00 0.00 0.00 175.76 175.86 2hg7 s VAL 15 N 2.00 5.19 -0.14 0.00 1.01 -1.26 -4.93 120.40 122.27 2hg7 s VAL 15 Ca 0.25 -1.18 -0.00 0.00 0.00 0.00 0.00 61.98 61.04 2hg7 s VAL 15 Cb -0.16 -4.16 0.09 0.00 0.00 0.00 0.00 36.38 32.16 2hg7 s VAL 15 CO 0.09 -0.64 2.00 -1.54 0.00 0.00 0.00 175.10 175.01 2hg7 n SER 16 N 5.20 5.82 0.00 3.32 3.41 -1.26 -3.66 113.62 126.45 2hg7 n SER 16 Ca -0.13 -2.69 0.00 0.00 -0.26 0.00 0.00 58.87 55.79 2hg7 n SER 16 Cb 0.43 -1.10 0.00 0.00 -0.26 0.00 0.00 64.21 63.28 2hg7 n SER 16 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 2hg7 n ARG 17 N 1.00 0.00 -0.03 4.33 1.74 -1.05 -4.35 116.66 118.31 2hg7 n ARG 17 Ca 0.13 0.08 -0.04 0.00 -0.77 0.00 0.00 57.85 57.25 2hg7 n ARG 17 Cb 0.53 -0.48 -0.04 0.00 -1.02 0.00 0.00 32.46 31.45 2hg7 n ARG 17 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 2hg7 n LYS 18 N -2.10 1.03 -0.22 5.56 4.01 -1.26 -4.48 118.16 120.70 2hg7 n LYS 18 Ca 0.00 0.03 -0.04 0.00 -0.51 0.00 0.00 58.31 57.79 2hg7 n LYS 18 Cb 0.00 -1.14 0.07 0.00 -0.51 0.00 0.00 35.03 33.45 2hg7 n LYS 18 CO 0.00 0.00 0.00 -0.44 -1.11 0.00 0.00 177.40 175.85 2hg7 h ASP 19 N 0.00 0.60 -4.88 4.39 3.32 -1.92 -3.43 116.42 114.50 2hg7 h ASP 19 Ca -0.15 0.01 -0.12 0.00 0.02 0.00 0.00 57.03 56.78 2hg7 h ASP 19 Cb 1.27 -0.12 -0.21 0.00 0.22 0.00 0.00 39.33 40.49 2hg7 h ASP 19 CO -0.01 0.42 -0.31 0.72 -1.72 0.00 0.00 179.24 178.34 2hg7 s PHE 20 N -6.12 -0.17 -0.02 4.55 -0.71 -1.24 -0.66 117.98 113.60 2hg7 s PHE 20 Ca -0.13 0.27 0.01 0.00 -1.04 0.00 0.00 56.93 56.04 2hg7 s PHE 20 Cb 0.15 0.08 0.02 0.00 -1.21 0.00 0.00 43.02 42.05 2hg7 s PHE 20 CO 0.76 -0.36 -0.02 -2.00 -1.34 0.00 0.00 175.22 172.26 2hg7 s GLU 21 N -1.19 0.43 0.23 1.99 2.12 -0.65 -2.51 118.70 119.11 2hg7 s GLU 21 Ca -0.12 -0.04 -0.03 0.00 0.36 0.00 0.00 54.97 55.14 2hg7 s GLU 21 Cb -0.05 -0.51 -0.05 0.00 0.26 0.00 0.00 34.13 33.78 2hg7 s GLU 21 CO 0.04 -0.05 0.45 -0.51 -0.54 0.00 0.00 175.26 174.65 2hg7 s LEU 22 N 0.64 4.17 0.07 2.70 1.43 -1.26 -1.33 118.68 125.10 2hg7 s LEU 22 Ca -0.07 0.55 0.02 0.00 -1.03 0.00 0.00 54.13 53.60 2hg7 s LEU 22 Cb -0.10 -3.33 -0.03 0.00 0.03 0.00 0.00 46.19 42.76 2hg7 s LEU 22 CO -0.01 -0.09 -0.08 -0.60 0.23 0.00 0.00 176.35 175.80 2hg7 s ARG 23 N -3.31 0.69 -0.09 1.70 6.06 0.10 -4.79 118.95 119.32 2hg7 s ARG 23 Ca 0.41 -1.02 -0.30 0.00 -2.50 0.00 0.00 55.73 52.32 2hg7 s ARG 23 Cb -0.11 -0.33 -0.03 0.00 0.06 0.00 0.00 34.95 34.55 2hg7 s ARG 23 CO 0.29 0.04 1.22 1.21 -2.50 0.00 0.00 175.30 175.56 2hg7 s ASN 24 N -2.22 7.01 0.05 -2.12 2.47 -1.26 -1.34 114.94 117.53 2hg7 s ASN 24 Ca 0.00 1.79 0.13 0.00 0.42 0.00 0.00 52.86 55.20 2hg7 s ASN 24 Cb -0.04 -2.55 -0.17 0.00 -1.45 0.00 0.00 41.25 37.04 2hg7 s ASN 24 CO -0.01 -0.64 0.89 -0.78 -3.72 0.00 0.00 177.10 172.84 2hg7 h ASP 25 N 7.68 0.00 0.00 -4.21 3.58 -0.57 -3.48 116.42 119.43 2hg7 h ASP 25 Ca -0.32 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.13 2hg7 h ASP 25 Cb 1.14 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.19 2hg7 h ASP 25 CO 0.91 0.84 0.00 0.61 -2.88 0.00 0.00 179.24 178.71 2hg7 n GLY 26 N 1.44 3.13 1.39 -0.78 0.00 -1.26 -4.76 105.19 104.36 2hg7 n GLY 26 Ca -0.10 -0.98 0.11 0.00 0.00 0.00 0.00 46.02 45.06 2hg7 n GLY 26 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2hg7 n ASN 27 N 0.60 4.09 0.00 1.61 5.15 -1.26 -5.02 115.26 120.43 2hg7 n ASN 27 Ca 0.00 -2.06 0.00 0.00 -0.60 0.00 0.00 54.58 51.92 2hg7 n ASN 27 Cb 0.00 -0.51 0.00 0.00 -0.53 0.00 0.00 39.78 38.74 2hg7 n ASN 27 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2hg7 n GLY 28 N 1.59 -0.32 2.89 8.20 0.00 -1.26 -2.53 105.19 113.75 2hg7 n GLY 28 Ca 0.25 -1.23 -0.25 0.00 0.00 0.00 0.00 46.02 44.78 2hg7 n GLY 28 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2hg7 s SER 29 N -4.00 1.95 0.44 1.61 0.01 -0.36 0.24 113.70 113.59 2hg7 s SER 29 Ca 0.00 -0.25 0.02 0.00 1.31 0.00 0.00 55.95 57.03 2hg7 s SER 29 Cb 0.00 -0.74 -0.01 0.00 0.21 0.00 0.00 66.02 65.48 2hg7 s SER 29 CO 0.00 -0.12 0.08 0.00 0.41 0.00 0.00 173.24 173.61 2hg7 n TYR 30 N 4.82 0.59 -2.84 2.43 4.11 -0.45 -1.36 117.16 124.47 2hg7 n TYR 30 Ca -0.13 -2.46 -0.42 0.00 -0.00 0.00 0.00 57.90 54.88 2hg7 n TYR 30 Cb 0.50 -0.15 -0.04 0.00 -0.00 0.00 0.00 39.34 39.65 2hg7 n TYR 30 CO 0.00 0.00 0.00 0.42 -0.00 0.00 0.00 176.86 177.28 2hg7 s ILE 31 N -2.90 4.77 -0.17 -3.48 1.01 -1.26 -0.72 121.20 118.45 2hg7 s ILE 31 Ca 0.11 1.57 -0.14 0.00 0.00 0.00 0.00 60.65 62.19 2hg7 s ILE 31 Cb 0.01 -4.18 -0.09 0.00 0.01 0.00 0.00 42.46 38.20 2hg7 s ILE 31 CO 0.08 -0.17 -0.04 1.21 0.00 0.00 0.00 174.94 176.02 2hg7 n GLU 32 N 6.19 0.49 -4.41 2.79 2.13 -0.60 -4.88 120.64 122.35 2hg7 n GLU 32 Ca 0.07 0.55 -0.30 0.00 0.66 0.00 0.00 57.16 58.14 2hg7 n GLU 32 Cb 0.47 -1.71 -0.12 0.00 0.27 0.00 0.00 31.44 30.35 2hg7 n GLU 32 CO 0.00 0.00 0.00 0.15 -0.41 0.00 0.00 177.13 176.87 2hg7 s LYS 33 N -2.29 1.91 -0.23 5.31 1.02 -0.44 -4.98 119.74 120.05 2hg7 s LYS 33 Ca -0.20 -1.10 -0.03 0.00 0.02 0.00 0.00 55.97 54.66 2hg7 s LYS 33 Cb 0.04 -2.16 0.12 0.00 -0.52 0.00 0.00 37.83 35.31 2hg7 s LYS 33 CO 0.36 0.50 0.36 -0.46 -0.92 0.00 0.00 175.35 175.19 2hg7 s TRP 34 N -1.08 -0.74 0.00 3.18 -0.11 -1.26 -1.63 118.94 117.29 2hg7 s TRP 34 Ca 0.17 0.83 0.00 0.00 1.22 0.00 0.00 56.10 58.32 2hg7 s TRP 34 Cb -0.11 -0.00 0.00 0.00 -1.50 0.00 0.00 33.47 31.86 2hg7 s TRP 34 CO 0.09 -0.67 0.87 0.09 -4.62 0.00 0.00 176.95 172.71 2hg7 n ASN 35 N 5.36 1.73 -4.77 5.86 3.02 0.16 -5.00 115.26 121.63 2hg7 n ASN 35 Ca -0.04 -1.74 -0.37 0.00 -0.03 0.00 0.00 54.58 52.40 2hg7 n ASN 35 Cb 0.50 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.67 2hg7 n ASN 35 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 2hg7 s LEU 36 N -0.74 3.90 -0.42 3.41 1.43 -1.24 -4.90 118.68 120.12 2hg7 s LEU 36 Ca 0.00 2.33 -0.05 0.00 -1.03 0.00 0.00 54.13 55.38 2hg7 s LEU 36 Cb 0.00 -4.36 -0.04 0.00 0.03 0.00 0.00 46.19 41.82 2hg7 s LEU 36 CO 0.00 -1.13 3.02 0.54 0.23 0.00 0.00 176.35 179.02 2hg7 n ARG 37 N -0.85 2.49 -4.12 1.70 1.74 -1.26 -4.83 116.66 111.54 2hg7 n ARG 37 Ca 0.09 -2.00 -0.15 0.00 -0.77 0.00 0.00 57.85 55.02 2hg7 n ARG 37 Cb 0.49 -2.16 -0.13 0.00 -1.02 0.00 0.00 32.46 29.64 2hg7 n ARG 37 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2hg7 s ALA 38 N -0.67 0.60 0.30 7.54 0.00 -1.26 -5.13 121.76 123.13 2hg7 s ALA 38 Ca 0.62 -0.60 -0.30 0.00 0.00 0.00 0.00 51.96 51.68 2hg7 s ALA 38 Cb 0.34 -0.03 -0.12 0.00 0.00 0.00 0.00 23.12 23.31 2hg7 s ALA 38 CO -0.14 0.05 1.47 -0.35 0.00 0.00 0.00 175.76 176.79 2hg7 n PRO 39 N 1.99 2.39 -1.73 0.00 -0.04 -1.26 -4.89 135.00 131.45 2hg7 n PRO 39 Ca -0.19 0.85 -0.42 0.00 -0.04 0.00 0.00 63.50 63.69 2hg7 n PRO 39 Cb 0.56 -2.55 -0.03 0.00 -0.04 0.00 0.00 33.50 31.44 2hg7 n PRO 39 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2hg7 s LEU 40 N -0.62 4.11 0.67 1.53 2.01 -1.26 -4.93 118.68 120.19 2hg7 s LEU 40 Ca 0.62 2.32 -0.17 0.00 0.01 0.00 0.00 54.13 56.91 2hg7 s LEU 40 Cb -0.55 -3.53 0.00 0.00 0.01 0.00 0.00 46.19 42.13 2hg7 s LEU 40 CO 0.54 -1.30 1.28 -2.84 1.01 0.00 0.00 176.35 175.04 2hg7 s PRO 41 N 4.93 2.41 0.53 1.29 0.02 -1.26 -5.03 135.00 137.89 2hg7 s PRO 41 Ca 0.88 2.01 0.08 0.00 0.02 0.00 0.00 61.00 63.99 2hg7 s PRO 41 Cb -0.37 -1.84 0.06 0.00 0.02 0.00 0.00 34.50 32.37 2hg7 s PRO 41 CO 0.37 -1.69 0.73 0.95 -0.33 0.00 0.00 177.00 177.04 2hg7 s THR 42 N -1.52 2.44 0.14 0.99 -4.23 -1.26 -4.86 115.64 107.33 2hg7 s THR 42 Ca 0.81 -0.97 -0.22 0.00 -1.18 0.00 0.00 61.69 60.13 2hg7 s THR 42 Cb -0.36 -2.47 -0.01 0.00 1.34 0.00 0.00 72.50 71.00 2hg7 s THR 42 CO 0.41 0.00 1.66 -0.61 -0.54 0.00 0.00 174.62 175.54 2hg7 h GLN 43 N 0.29 -0.21 -0.33 3.99 5.75 -1.99 0.21 115.11 122.82 2hg7 h GLN 43 Ca -0.34 0.01 0.04 0.00 -0.15 0.00 0.00 58.65 58.22 2hg7 h GLN 43 Cb 1.28 0.05 -0.04 0.00 1.07 0.00 0.00 27.48 29.84 2hg7 h GLN 43 CO 0.42 -0.14 0.09 0.00 -2.65 0.00 0.00 178.83 176.55 2hg7 h ALA 44 N 0.83 0.36 -0.06 3.38 0.00 -1.99 -0.95 119.26 120.83 2hg7 h ALA 44 Ca 0.10 0.05 0.01 0.00 0.00 0.00 0.00 54.91 55.08 2hg7 h ALA 44 Cb 0.37 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.20 2hg7 h ALA 44 CO -0.28 -0.31 -0.01 0.93 0.00 0.00 0.00 179.25 179.58 2hg7 h GLU 45 N 0.22 0.01 -0.19 0.00 5.08 -1.78 0.78 114.58 118.70 2hg7 h GLU 45 Ca 0.15 -0.00 0.02 0.00 -1.00 0.00 0.00 59.36 58.53 2hg7 h GLU 45 Cb 0.15 -0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.37 2hg7 h GLU 45 CO -0.18 0.01 0.03 -0.07 -1.00 0.00 0.00 179.01 177.80 2hg7 h LEU 46 N 0.01 0.01 -0.85 1.33 3.38 -0.33 -2.13 115.31 116.72 2hg7 h LEU 46 Ca 0.03 0.03 -0.12 0.00 0.09 0.00 0.00 57.88 57.91 2hg7 h LEU 46 Cb 0.04 0.04 -0.01 0.00 0.09 0.00 0.00 40.66 40.82 2hg7 h LEU 46 CO -0.06 0.03 -0.41 -0.33 0.09 0.00 0.00 178.44 177.77 2hg7 h GLU 47 N 0.11 0.34 -0.69 1.13 5.08 -1.04 -2.64 114.58 116.88 2hg7 h GLU 47 Ca 0.08 -0.17 -0.03 0.00 -1.00 0.00 0.00 59.36 58.25 2hg7 h GLU 47 Cb 0.08 -0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.30 2hg7 h GLU 47 CO -0.11 0.70 0.33 1.15 -1.00 0.00 0.00 179.01 180.07 2hg7 h THR 48 N 0.29 1.23 -0.30 1.13 2.02 -0.44 0.30 112.91 117.13 2hg7 h THR 48 Ca 0.03 -0.66 -0.09 0.00 0.77 0.00 0.00 66.41 66.46 2hg7 h THR 48 Cb 0.85 0.39 -0.01 0.00 -1.74 0.00 0.00 68.15 67.63 2hg7 h THR 48 CO 0.07 0.27 -0.20 -0.50 0.37 0.00 0.00 175.52 175.53 2hg7 h TRP 49 N 0.96 0.61 -0.53 3.16 6.55 -1.25 0.31 115.95 125.76 2hg7 h TRP 49 Ca 0.24 -0.12 -0.10 0.00 0.95 0.00 0.00 58.89 59.86 2hg7 h TRP 49 Cb 0.13 -0.15 -0.02 0.00 -0.86 0.00 0.00 29.16 28.26 2hg7 h TRP 49 CO 0.01 0.72 -0.04 2.35 -1.05 0.00 0.00 178.44 180.42 2hg7 h TRP 50 N 0.50 1.08 -0.49 0.49 2.91 -1.06 -1.33 115.95 118.05 2hg7 h TRP 50 Ca 0.08 -0.20 -0.03 0.00 1.13 0.00 0.00 58.89 59.87 2hg7 h TRP 50 Cb 0.62 -0.27 -0.02 0.00 -0.51 0.00 0.00 29.16 28.98 2hg7 h TRP 50 CO 0.02 0.99 0.20 0.93 -1.03 0.00 0.00 178.44 179.55 2hg7 h GLU 51 N 0.85 0.73 -0.83 2.65 5.08 0.28 0.25 114.58 123.59 2hg7 h GLU 51 Ca 0.15 -0.13 -0.03 0.00 -1.00 0.00 0.00 59.36 58.34 2hg7 h GLU 51 Cb 0.59 -0.12 -0.04 0.00 0.50 0.00 0.00 28.75 29.69 2hg7 h GLU 51 CO 0.04 0.66 0.40 0.93 -1.00 0.00 0.00 179.01 180.04 2hg7 h GLU 52 N 0.65 1.20 -0.61 2.33 5.08 -0.31 0.15 114.58 123.07 2hg7 h GLU 52 Ca 0.16 -0.17 -0.09 0.00 -1.00 0.00 0.00 59.36 58.26 2hg7 h GLU 52 Cb 0.19 -0.22 -0.02 0.00 0.50 0.00 0.00 28.75 29.21 2hg7 h GLU 52 CO -0.01 0.92 0.03 1.25 -1.00 0.00 0.00 179.01 180.19 2hg7 h LEU 53 N 1.18 1.03 -1.24 1.33 5.85 -0.94 -0.83 115.31 121.69 2hg7 h LEU 53 Ca 0.29 -0.29 -0.07 0.00 0.84 0.00 0.00 57.88 58.64 2hg7 h LEU 53 Cb 0.11 -0.27 -0.01 0.00 0.37 0.00 0.00 40.66 40.86 2hg7 h LEU 53 CO -0.04 1.07 -0.23 -0.61 -0.34 0.00 0.00 178.44 178.29 2hg7 h GLN 54 N 0.95 0.23 -0.68 1.25 5.75 0.14 -2.28 115.11 120.47 2hg7 h GLN 54 Ca 0.18 -0.07 0.00 0.00 -0.15 0.00 0.00 58.65 58.60 2hg7 h GLN 54 Cb 0.53 -0.02 0.00 0.00 1.07 0.00 0.00 27.48 29.05 2hg7 h GLN 54 CO 0.03 0.46 0.00 1.17 -2.65 0.00 0.00 178.83 177.83 2hg7 n LYS 55 N -4.18 3.67 -3.70 1.69 4.81 0.45 -4.93 118.16 115.96 2hg7 n LYS 55 Ca -0.01 -2.89 -0.36 0.00 -0.87 0.00 0.00 58.31 54.18 2hg7 n LYS 55 Cb 0.34 -1.87 -0.09 0.00 0.02 0.00 0.00 35.03 33.43 2hg7 n LYS 55 CO 0.00 0.00 0.00 1.21 1.17 0.00 0.00 177.40 179.78 2hg7 s ASN 56 N -0.91 6.14 0.26 3.14 2.47 -0.34 -5.00 114.94 120.71 2hg7 s ASN 56 Ca 0.52 0.16 -0.30 0.00 0.42 0.00 0.00 52.86 53.66 2hg7 s ASN 56 Cb 0.33 -2.09 -0.10 0.00 -1.45 0.00 0.00 41.25 37.93 2hg7 s ASN 56 CO 0.26 0.12 1.48 -2.84 -3.72 0.00 0.00 177.10 172.40 2hg7 s PRO 57 N 0.72 4.23 0.52 0.43 0.02 -1.26 -4.95 135.00 134.71 2hg7 s PRO 57 Ca 0.08 2.37 -0.22 0.00 0.02 0.00 0.00 61.00 63.25 2hg7 s PRO 57 Cb -0.12 -3.08 -0.06 0.00 0.02 0.00 0.00 34.50 31.25 2hg7 s PRO 57 CO 0.01 -0.47 1.18 -2.30 -0.33 0.00 0.00 177.00 175.10 2hg7 n PRO 58 N 2.22 1.45 -2.67 5.54 -0.02 -1.26 -4.91 135.00 135.35 2hg7 n PRO 58 Ca 0.07 0.53 -0.43 0.00 -2.02 0.00 0.00 63.50 61.65 2hg7 n PRO 58 Cb 0.40 -2.35 -0.03 0.00 -0.02 0.00 0.00 33.50 31.50 2hg7 n PRO 58 CO 0.00 0.00 0.00 -0.47 1.98 0.00 0.00 175.50 177.01 2hg7 s TYR 59 N -1.34 2.82 -2.00 6.00 5.04 -1.26 -5.32 117.35 121.30 2hg7 s TYR 59 Ca 0.70 0.55 0.06 0.00 -2.44 0.00 0.00 57.07 55.94 2hg7 s TYR 59 Cb -0.45 -4.30 0.36 0.00 0.35 0.00 0.00 41.96 37.92 2hg7 s TYR 59 CO 0.51 -1.26 0.83 0.39 -1.34 0.00 0.00 175.55 174.67