#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 4.62 0.18 2.02 -1.09 -1.26 -4.45 121.20 121.23 2hg7 s ILE 2 Ca 0.00 0.57 -0.06 0.00 -2.23 0.00 0.00 60.65 58.93 2hg7 s ILE 2 Cb 0.00 -4.33 -0.01 0.00 -1.58 0.00 0.00 42.46 36.54 2hg7 s ILE 2 CO 0.00 -0.70 1.55 -0.07 -1.23 0.00 0.00 174.94 174.49 2hg7 h LEU 3 N 10.17 0.82 -0.36 2.97 -0.00 -1.59 -3.19 115.31 124.12 2hg7 h LEU 3 Ca -0.25 -0.36 0.06 0.00 -0.00 0.00 0.00 57.88 57.34 2hg7 h LEU 3 Cb 1.08 -0.23 -0.05 0.00 -0.00 0.00 0.00 40.66 41.46 2hg7 h LEU 3 CO 0.97 1.09 0.03 0.22 -0.00 0.00 0.00 178.44 180.75 2hg7 h TYR 4 N 0.65 0.03 -0.04 1.13 3.20 -1.92 0.16 116.97 120.18 2hg7 h TYR 4 Ca 0.06 0.02 0.01 0.00 3.14 0.00 0.00 58.73 61.96 2hg7 h TYR 4 Cb 0.90 0.04 -0.01 0.00 1.54 0.00 0.00 36.73 39.20 2hg7 h TYR 4 CO 0.05 -0.04 0.00 -0.44 -1.64 0.00 0.00 178.16 176.09 2hg7 h ASP 5 N 0.13 -0.01 -0.15 -2.11 5.19 -1.94 0.93 116.42 118.45 2hg7 h ASP 5 Ca 0.18 0.01 0.00 0.00 -0.62 0.00 0.00 57.03 56.60 2hg7 h ASP 5 Cb 0.23 0.02 -0.01 0.00 0.18 0.00 0.00 39.33 39.75 2hg7 h ASP 5 CO -0.27 0.00 0.10 0.00 -3.12 0.00 0.00 179.24 175.95 2hg7 h ALA 6 N 1.03 0.19 -0.47 3.45 0.00 -1.40 -1.33 119.26 120.73 2hg7 h ALA 6 Ca 0.02 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.88 2hg7 h ALA 6 Cb 0.02 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 2hg7 h ALA 6 CO -0.03 -0.33 0.12 0.82 0.00 0.00 0.00 179.25 179.83 2hg7 h ILE 7 N 0.20 1.23 0.00 0.00 2.04 -0.60 -2.61 117.51 117.77 2hg7 h ILE 7 Ca 0.06 -0.81 -0.02 0.00 1.00 0.00 0.00 64.86 65.09 2hg7 h ILE 7 Cb -0.02 0.87 -0.00 0.00 -0.74 0.00 0.00 36.82 36.93 2hg7 h ILE 7 CO -0.02 0.29 -0.11 -0.03 0.00 0.00 0.00 178.15 178.29 2hg7 h MET 8 N 0.63 0.00 0.01 2.37 4.05 -0.61 0.33 114.93 121.71 2hg7 h MET 8 Ca 0.15 0.00 -0.04 0.00 -0.28 0.00 0.00 59.70 59.53 2hg7 h MET 8 Cb 0.31 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.11 2hg7 h MET 8 CO 0.00 0.11 -0.16 -0.92 0.23 0.00 0.00 176.91 176.16 2hg7 h TYR 9 N 0.00 0.14 0.00 1.39 3.20 -0.88 -3.22 116.97 117.61 2hg7 h TYR 9 Ca -0.00 -0.09 -0.20 0.00 3.14 0.00 0.00 58.73 61.58 2hg7 h TYR 9 Cb 0.42 -0.01 -0.03 0.00 1.54 0.00 0.00 36.73 38.65 2hg7 h TYR 9 CO 0.00 0.94 -1.30 -0.22 -1.64 0.00 0.00 178.16 175.94 2hg7 h LYS 10 N -0.69 0.00 -3.28 1.82 3.11 -1.36 -3.39 116.57 112.79 2hg7 h LYS 10 Ca -0.02 0.00 -0.66 0.00 -2.81 0.00 0.00 60.65 57.16 2hg7 h LYS 10 Cb 0.99 0.00 -0.39 0.00 -1.00 0.00 0.00 32.23 31.83 2hg7 h LYS 10 CO 0.03 0.50 -0.41 0.71 -2.81 0.00 0.00 179.45 177.47 2hg7 s TYR 11 N -2.79 3.57 0.36 1.91 2.02 0.12 -4.95 117.35 117.59 2hg7 s TYR 11 Ca -0.02 -3.13 0.17 0.00 -0.37 0.00 0.00 57.07 53.72 2hg7 s TYR 11 Cb 0.09 -2.96 0.89 0.00 -0.40 0.00 0.00 41.96 39.58 2hg7 s TYR 11 CO 0.81 -0.68 1.88 -1.35 -1.57 0.00 0.00 175.55 174.64 2hg7 h PRO 12 N 6.02 0.00 -0.38 -1.71 0.11 -1.75 -3.05 132.00 131.24 2hg7 h PRO 12 Ca 0.08 0.00 -0.16 0.00 0.11 0.00 0.00 66.00 66.03 2hg7 h PRO 12 Cb 0.83 0.00 -0.10 0.00 0.11 0.00 0.00 31.00 31.84 2hg7 h PRO 12 CO 0.75 0.30 0.00 0.09 -0.21 0.00 0.00 178.00 178.94 2hg7 n ASN 13 N -3.96 2.96 -4.77 -2.05 3.02 -1.26 -5.00 115.26 104.20 2hg7 n ASN 13 Ca -0.02 -3.56 -0.39 0.00 -0.03 0.00 0.00 54.58 50.58 2hg7 n ASN 13 Cb 0.37 -0.63 -0.06 0.00 -0.61 0.00 0.00 39.78 38.85 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 -3.14 3.30 -0.64 5.41 0.00 -1.15 -4.99 121.76 120.55 2hg7 s ALA 14 Ca 0.45 0.54 -0.27 0.00 0.00 0.00 0.00 51.96 52.68 2hg7 s ALA 14 Cb 0.40 -3.16 0.03 0.00 0.00 0.00 0.00 23.12 20.39 2hg7 s ALA 14 CO 0.03 0.21 1.19 0.08 0.00 0.00 0.00 175.76 177.27 2hg7 s VAL 15 N -1.36 3.97 0.32 0.00 1.01 -1.26 -5.00 120.40 118.07 2hg7 s VAL 15 Ca 0.44 0.61 -0.29 0.00 0.00 0.00 0.00 61.98 62.75 2hg7 s VAL 15 Cb -0.22 -4.77 -0.10 0.00 0.00 0.00 0.00 36.38 31.28 2hg7 s VAL 15 CO 0.28 -1.50 1.22 -0.44 0.00 0.00 0.00 175.10 174.66 2hg7 s SER 16 N 3.25 6.93 -0.19 3.32 0.01 -1.26 -1.36 113.70 124.39 2hg7 s SER 16 Ca 0.38 2.51 0.00 0.00 1.31 0.00 0.00 55.95 60.15 2hg7 s SER 16 Cb -0.09 -2.64 0.00 0.00 0.21 0.00 0.00 66.02 63.51 2hg7 s SER 16 CO 0.21 -0.40 0.00 0.54 0.41 0.00 0.00 173.24 173.99 2hg7 n ARG 17 N 0.89 -0.84 0.15 12.44 1.74 0.32 -4.65 116.66 126.70 2hg7 n ARG 17 Ca -0.00 0.34 0.00 0.00 -0.77 0.00 0.00 57.85 57.42 2hg7 n ARG 17 Cb 0.43 -4.05 0.00 0.00 -1.02 0.00 0.00 32.46 27.82 2hg7 n ARG 17 CO 0.00 0.00 0.00 1.17 -1.52 0.00 0.00 177.63 177.28 2hg7 n LYS 18 N -1.52 0.00 0.15 5.56 4.81 -1.20 -4.73 118.16 121.23 2hg7 n LYS 18 Ca -0.02 0.00 0.02 0.00 -0.87 0.00 0.00 58.31 57.45 2hg7 n LYS 18 Cb 0.24 0.00 0.14 0.00 0.02 0.00 0.00 35.03 35.43 2hg7 n LYS 18 CO 0.00 0.00 0.00 -0.44 1.17 0.00 0.00 177.40 178.13 2hg7 h ASP 19 N 0.00 0.00 -2.97 3.14 5.19 -1.48 -3.41 116.42 116.89 2hg7 h ASP 19 Ca 0.00 0.00 -0.36 0.00 -0.62 0.00 0.00 57.03 56.05 2hg7 h ASP 19 Cb 0.00 0.00 -0.38 0.00 0.18 0.00 0.00 39.33 39.13 2hg7 h ASP 19 CO 0.00 0.52 -0.69 0.72 -3.12 0.00 0.00 179.24 176.67 2hg7 s PHE 20 N -3.23 -0.05 -0.06 4.55 -0.71 -1.09 0.32 117.98 117.71 2hg7 s PHE 20 Ca 0.02 0.17 -0.15 0.00 -1.04 0.00 0.00 56.93 55.93 2hg7 s PHE 20 Cb 0.09 -0.45 -0.05 0.00 -1.21 0.00 0.00 43.02 41.40 2hg7 s PHE 20 CO 0.73 -0.42 0.38 -2.00 -1.34 0.00 0.00 175.22 172.57 2hg7 s GLU 21 N 2.23 4.03 0.13 1.99 2.12 0.40 -0.52 118.70 129.08 2hg7 s GLU 21 Ca 0.04 0.31 0.04 0.00 0.36 0.00 0.00 54.97 55.73 2hg7 s GLU 21 Cb -0.14 -3.30 -0.04 0.00 0.26 0.00 0.00 34.13 30.91 2hg7 s GLU 21 CO -0.08 0.51 0.10 -0.51 -0.54 0.00 0.00 175.26 174.74 2hg7 s LEU 22 N -0.44 3.78 0.04 2.70 1.43 -1.26 0.01 118.68 124.93 2hg7 s LEU 22 Ca 0.22 -0.09 -0.00 0.00 -1.03 0.00 0.00 54.13 53.22 2hg7 s LEU 22 Cb -0.15 -2.42 -0.03 0.00 0.03 0.00 0.00 46.19 43.62 2hg7 s LEU 22 CO 0.10 0.11 -0.03 -0.60 0.23 0.00 0.00 176.35 176.16 2hg7 s ARG 23 N -2.79 0.49 -0.46 1.70 6.06 -0.55 -4.78 118.95 118.62 2hg7 s ARG 23 Ca 0.30 -0.95 -0.23 0.00 -2.50 0.00 0.00 55.73 52.34 2hg7 s ARG 23 Cb -0.11 0.14 0.03 0.00 0.06 0.00 0.00 34.95 35.07 2hg7 s ARG 23 CO 0.22 -0.08 0.80 1.21 -2.50 0.00 0.00 175.30 174.95 2hg7 s ASN 24 N -2.27 6.40 -0.08 -2.12 3.84 -1.26 -1.07 114.94 118.38 2hg7 s ASN 24 Ca -0.03 -0.14 -0.16 0.00 0.21 0.00 0.00 52.86 52.74 2hg7 s ASN 24 Cb -0.00 -2.39 -0.29 0.00 -0.55 0.00 0.00 41.25 38.02 2hg7 s ASN 24 CO -0.06 -0.94 0.65 -0.78 -2.79 0.00 0.00 177.10 173.18 2hg7 h ASP 25 N 9.01 0.47 0.00 -4.21 3.58 -1.69 -3.49 116.42 120.08 2hg7 h ASP 25 Ca -0.25 -0.89 0.00 0.00 0.42 0.00 0.00 57.03 56.31 2hg7 h ASP 25 Cb 1.08 -0.15 0.00 0.00 1.72 0.00 0.00 39.33 41.98 2hg7 h ASP 25 CO 0.97 1.63 0.00 0.61 -2.88 0.00 0.00 179.24 179.57 2hg7 n GLY 26 N 1.76 3.31 1.56 -0.78 0.00 -1.26 -4.92 105.19 104.86 2hg7 n GLY 26 Ca -0.23 -0.45 -0.09 0.00 0.00 0.00 0.00 46.02 45.25 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 0.00 3.35 0.00 1.61 2.85 -1.26 -5.04 115.26 116.77 2hg7 n ASN 27 Ca 0.00 -3.56 0.00 0.00 -0.11 0.00 0.00 54.58 50.91 2hg7 n ASN 27 Cb 0.00 -0.70 0.00 0.00 1.24 0.00 0.00 39.78 40.32 2hg7 n ASN 27 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 2hg7 n GLY 28 N -0.92 1.02 3.73 8.20 0.00 -1.26 -2.86 105.19 113.10 2hg7 n GLY 28 Ca 0.41 -2.20 -0.38 0.00 0.00 0.00 0.00 46.02 43.85 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 0.00 6.76 0.38 1.61 0.01 -1.26 -1.65 113.70 119.54 2hg7 s SER 29 Ca 0.00 0.91 0.02 0.00 1.31 0.00 0.00 55.95 58.19 2hg7 s SER 29 Cb 0.00 -2.31 -0.01 0.00 0.21 0.00 0.00 66.02 63.92 2hg7 s SER 29 CO 0.00 0.02 0.07 0.00 0.41 0.00 0.00 173.24 173.74 2hg7 n TYR 30 N 3.44 0.49 -2.40 2.43 4.11 -0.23 -1.35 117.16 123.65 2hg7 n TYR 30 Ca -0.07 -2.14 -0.43 0.00 -0.00 0.00 0.00 57.90 55.27 2hg7 n TYR 30 Cb 0.52 -0.12 -0.02 0.00 -0.00 0.00 0.00 39.34 39.71 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 -2.69 4.21 -0.25 -3.48 1.01 -1.26 -1.48 121.20 117.25 2hg7 s ILE 31 Ca 0.10 1.49 -0.15 0.00 0.00 0.00 0.00 60.65 62.09 2hg7 s ILE 31 Cb 0.00 -3.96 -0.10 0.00 0.01 0.00 0.00 42.46 38.41 2hg7 s ILE 31 CO 0.07 -0.09 -0.35 1.21 0.00 0.00 0.00 174.94 175.77 2hg7 n GLU 32 N 6.23 0.57 -3.86 2.79 4.07 0.10 -4.86 120.64 125.68 2hg7 n GLU 32 Ca 0.13 0.24 -0.29 0.00 -0.06 0.00 0.00 57.16 57.19 2hg7 n GLU 32 Cb 0.45 -1.46 -0.16 0.00 -0.06 0.00 0.00 31.44 30.21 2hg7 n GLU 32 CO 0.00 0.00 0.00 0.21 -0.06 0.00 0.00 177.13 177.28 2hg7 s LYS 33 N -2.61 1.24 -0.37 5.31 2.36 -0.99 -4.96 119.74 119.72 2hg7 s LYS 33 Ca -0.36 -0.68 -0.13 0.00 -2.55 0.00 0.00 55.97 52.25 2hg7 s LYS 33 Cb 0.12 -2.27 0.01 0.00 -1.05 0.00 0.00 37.83 34.63 2hg7 s LYS 33 CO 0.47 -0.57 0.26 -0.46 1.55 0.00 0.00 175.35 176.59 2hg7 s TRP 34 N 1.61 3.23 -0.48 4.03 -0.11 -1.26 -0.45 118.94 125.51 2hg7 s TRP 34 Ca -0.03 -0.50 0.06 0.00 1.22 0.00 0.00 56.10 56.86 2hg7 s TRP 34 Cb -0.17 -2.51 -0.02 0.00 -1.50 0.00 0.00 33.47 29.27 2hg7 s TRP 34 CO -0.07 -0.50 0.42 0.09 -4.62 0.00 0.00 176.95 172.27 2hg7 n ASN 35 N 5.11 0.76 -4.76 5.86 3.02 0.15 -5.01 115.26 120.39 2hg7 n ASN 35 Ca -0.12 -0.88 -0.41 0.00 -0.03 0.00 0.00 54.58 53.14 2hg7 n ASN 35 Cb 0.48 0.61 -0.02 0.00 -0.61 0.00 0.00 39.78 40.24 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 -1.60 4.40 -0.10 3.41 1.43 -0.43 -4.87 118.68 120.93 2hg7 s LEU 36 Ca 0.04 2.72 0.00 0.00 -1.03 0.00 0.00 54.13 55.86 2hg7 s LEU 36 Cb 0.05 -3.64 0.09 0.00 0.03 0.00 0.00 46.19 42.72 2hg7 s LEU 36 CO 0.17 -0.65 1.68 0.54 0.23 0.00 0.00 176.35 178.33 2hg7 n ARG 37 N 1.46 1.25 -4.45 1.70 1.74 -1.26 -4.80 116.66 112.29 2hg7 n ARG 37 Ca 0.03 -0.52 -0.24 0.00 -0.77 0.00 0.00 57.85 56.35 2hg7 n ARG 37 Cb 0.41 -1.20 -0.13 0.00 -1.02 0.00 0.00 32.46 30.51 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 -0.59 1.76 0.49 7.54 0.00 -1.26 -5.12 121.76 124.57 2hg7 s ALA 38 Ca 0.10 -1.14 -0.23 0.00 0.00 0.00 0.00 51.96 50.69 2hg7 s ALA 38 Cb 0.08 -0.29 -0.07 0.00 0.00 0.00 0.00 23.12 22.84 2hg7 s ALA 38 CO 0.01 0.37 1.29 -2.30 0.00 0.00 0.00 175.76 175.13 2hg7 n PRO 39 N 1.47 1.79 -2.01 0.00 -0.02 -1.26 -4.94 135.00 130.02 2hg7 n PRO 39 Ca -0.18 0.65 -0.42 0.00 -2.02 0.00 0.00 63.50 61.52 2hg7 n PRO 39 Cb 0.53 -2.47 -0.03 0.00 -0.02 0.00 0.00 33.50 31.52 2hg7 n PRO 39 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 2hg7 s LEU 40 N -2.48 4.36 0.66 2.45 2.01 -1.26 -4.97 118.68 119.44 2hg7 s LEU 40 Ca 0.66 2.43 -0.17 0.00 0.01 0.00 0.00 54.13 57.06 2hg7 s LEU 40 Cb -0.46 -3.57 -0.01 0.00 0.01 0.00 0.00 46.19 42.16 2hg7 s LEU 40 CO 0.54 -0.81 1.12 -0.81 1.01 0.00 0.00 176.35 177.39 2hg7 n PRO 41 N 4.97 0.87 -3.34 1.29 -0.04 -1.26 -5.03 135.00 132.46 2hg7 n PRO 41 Ca 0.14 0.35 -0.19 0.00 -0.04 0.00 0.00 63.50 63.77 2hg7 n PRO 41 Cb 0.41 -2.35 -0.01 0.00 -0.04 0.00 0.00 33.50 31.51 2hg7 n PRO 41 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 2hg7 s THR 42 N -1.54 3.15 0.10 0.52 -4.23 -1.26 -4.93 115.64 107.44 2hg7 s THR 42 Ca 0.79 -1.14 -0.28 0.00 -1.18 0.00 0.00 61.69 59.88 2hg7 s THR 42 Cb -0.38 -3.09 -0.11 0.00 1.34 0.00 0.00 72.50 70.26 2hg7 s THR 42 CO 0.44 -0.05 1.64 -0.61 -0.54 0.00 0.00 174.62 175.51 2hg7 h GLN 43 N 0.87 -0.50 -0.57 3.99 5.75 -1.99 0.13 115.11 122.79 2hg7 h GLN 43 Ca -0.42 0.03 0.04 0.00 -0.15 0.00 0.00 58.65 58.16 2hg7 h GLN 43 Cb 1.27 0.11 -0.04 0.00 1.07 0.00 0.00 27.48 29.89 2hg7 h GLN 43 CO 0.51 -0.33 0.31 0.00 -2.65 0.00 0.00 178.83 176.67 2hg7 h ALA 44 N 0.16 0.74 0.26 3.38 0.00 -1.99 -1.83 119.26 119.97 2hg7 h ALA 44 Ca 0.00 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.92 2hg7 h ALA 44 Cb 0.50 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.16 2hg7 h ALA 44 CO -0.08 -0.00 -0.24 0.93 0.00 0.00 0.00 179.25 179.86 2hg7 h GLU 45 N 0.60 -0.50 -0.45 0.00 5.08 -1.87 0.07 114.58 117.51 2hg7 h GLU 45 Ca 0.24 0.03 0.09 0.00 -1.00 0.00 0.00 59.36 58.73 2hg7 h GLU 45 Cb 0.11 0.11 -0.08 0.00 0.50 0.00 0.00 28.75 29.39 2hg7 h GLU 45 CO -0.14 -0.33 -0.06 -0.07 -1.00 0.00 0.00 179.01 177.40 2hg7 h LEU 46 N -0.52 -0.31 -0.77 1.33 3.38 -0.39 0.05 115.31 118.07 2hg7 h LEU 46 Ca -0.01 0.12 -0.13 0.00 0.09 0.00 0.00 57.88 57.95 2hg7 h LEU 46 Cb 0.47 0.24 -0.01 0.00 0.09 0.00 0.00 40.66 41.45 2hg7 h LEU 46 CO -0.04 -0.11 -0.56 -0.33 0.09 0.00 0.00 178.44 177.49 2hg7 h GLU 47 N 0.05 0.17 -0.31 1.13 5.08 -1.22 -1.74 114.58 117.73 2hg7 h GLU 47 Ca 0.22 -0.10 -0.07 0.00 -1.00 0.00 0.00 59.36 58.41 2hg7 h GLU 47 Cb 0.34 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.59 2hg7 h GLU 47 CO -0.42 0.68 -0.07 1.15 -1.00 0.00 0.00 179.01 179.34 2hg7 h THR 48 N 0.13 1.28 -0.71 1.13 2.02 0.13 0.23 112.91 117.12 2hg7 h THR 48 Ca -0.00 -1.11 -0.06 0.00 0.77 0.00 0.00 66.41 66.01 2hg7 h THR 48 Cb 1.02 1.37 -0.03 0.00 -1.74 0.00 0.00 68.15 68.77 2hg7 h THR 48 CO 0.08 0.36 0.20 -0.50 0.37 0.00 0.00 175.52 176.02 2hg7 h TRP 49 N 0.36 1.15 -0.09 3.16 6.55 -0.95 0.26 115.95 126.39 2hg7 h TRP 49 Ca 0.08 -0.12 0.00 0.00 0.95 0.00 0.00 58.89 59.80 2hg7 h TRP 49 Cb 0.56 -0.33 -0.00 0.00 -0.86 0.00 0.00 29.16 28.52 2hg7 h TRP 49 CO 0.05 0.92 0.05 2.35 -1.05 0.00 0.00 178.44 180.77 2hg7 h TRP 50 N 1.06 0.11 -0.53 0.49 2.91 -1.12 0.21 115.95 119.08 2hg7 h TRP 50 Ca 0.23 0.00 -0.02 0.00 1.13 0.00 0.00 58.89 60.23 2hg7 h TRP 50 Cb 0.33 -0.04 -0.02 0.00 -0.51 0.00 0.00 29.16 28.92 2hg7 h TRP 50 CO 0.03 0.08 0.25 0.93 -1.03 0.00 0.00 178.44 178.70 2hg7 h GLU 51 N 0.10 0.76 -0.54 2.65 5.08 -0.17 -0.02 114.58 122.44 2hg7 h GLU 51 Ca 0.03 -0.11 -0.04 0.00 -1.00 0.00 0.00 59.36 58.24 2hg7 h GLU 51 Cb 0.00 -0.14 -0.03 0.00 0.50 0.00 0.00 28.75 29.09 2hg7 h GLU 51 CO -0.01 0.63 0.18 0.93 -1.00 0.00 0.00 179.01 179.74 2hg7 h GLU 52 N 0.70 0.79 -0.74 2.33 5.08 -0.34 -0.11 114.58 122.31 2hg7 h GLU 52 Ca 0.18 -0.14 -0.06 0.00 -1.00 0.00 0.00 59.36 58.34 2hg7 h GLU 52 Cb 0.12 -0.13 -0.03 0.00 0.50 0.00 0.00 28.75 29.20 2hg7 h GLU 52 CO -0.02 0.68 0.21 1.25 -1.00 0.00 0.00 179.01 180.13 2hg7 h LEU 53 N 0.78 1.09 -0.78 1.33 5.85 0.09 0.16 115.31 123.83 2hg7 h LEU 53 Ca 0.18 -0.21 -0.10 0.00 0.84 0.00 0.00 57.88 58.59 2hg7 h LEU 53 Cb 0.21 -0.29 -0.02 0.00 0.37 0.00 0.00 40.66 40.94 2hg7 h LEU 53 CO -0.01 1.02 -0.15 1.56 -0.34 0.00 0.00 178.44 180.52 2hg7 h GLN 54 N 1.11 0.76 -0.15 1.25 1.08 -0.48 -2.43 115.11 116.25 2hg7 h GLN 54 Ca 0.24 -0.27 0.00 0.00 -1.45 0.00 0.00 58.65 57.17 2hg7 h GLN 54 Cb 0.33 -0.05 0.00 0.00 -0.05 0.00 0.00 27.48 27.71 2hg7 h GLN 54 CO -0.00 0.87 0.00 1.17 -0.95 0.00 0.00 178.83 179.92 2hg7 n LYS 55 N -4.15 1.54 -3.86 1.46 4.81 -0.10 -4.88 118.16 112.99 2hg7 n LYS 55 Ca 0.01 -0.82 -0.37 0.00 -0.87 0.00 0.00 58.31 56.26 2hg7 n LYS 55 Cb 0.39 -1.33 -0.06 0.00 0.02 0.00 0.00 35.03 34.05 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 -1.44 6.37 0.25 3.14 2.47 0.51 -5.02 114.94 121.24 2hg7 s ASN 56 Ca 0.28 0.45 -0.31 0.00 0.42 0.00 0.00 52.86 53.70 2hg7 s ASN 56 Cb 0.14 -2.07 -0.11 0.00 -1.45 0.00 0.00 41.25 37.76 2hg7 s ASN 56 CO 0.22 0.38 1.60 -2.16 -3.72 0.00 0.00 177.10 173.42 2hg7 s PRO 57 N -0.87 4.15 0.35 0.43 0.04 -1.26 -4.93 135.00 132.91 2hg7 s PRO 57 Ca 0.14 2.52 -0.27 0.00 0.04 0.00 0.00 61.00 63.43 2hg7 s PRO 57 Cb -0.12 -3.06 -0.12 0.00 0.04 0.00 0.00 34.50 31.24 2hg7 s PRO 57 CO 0.03 -0.62 1.11 -0.35 0.04 0.00 0.00 177.00 177.21 2hg7 n PRO 58 N 2.80 1.64 -2.69 0.56 -0.04 -1.26 -4.93 135.00 131.08 2hg7 n PRO 58 Ca 0.10 0.58 -0.42 0.00 -0.04 0.00 0.00 63.50 63.72 2hg7 n PRO 58 Cb 0.37 -2.09 -0.03 0.00 -0.04 0.00 0.00 33.50 31.72 2hg7 n PRO 58 CO 0.00 0.00 0.00 -0.47 -0.04 0.00 0.00 175.50 174.99 2hg7 s TYR 59 N -1.14 3.49 -1.81 0.54 5.04 -1.26 -5.31 117.35 116.90 2hg7 s TYR 59 Ca 0.59 1.57 0.00 0.00 -2.44 0.00 0.00 57.07 56.79 2hg7 s TYR 59 Cb -0.61 -3.19 0.00 0.00 0.35 0.00 0.00 41.96 38.51 2hg7 s TYR 59 CO 0.60 -0.26 0.45 -1.91 -1.34 0.00 0.00 175.55 173.09