#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 3.98 0.34 1.12 1.09 -1.26 -2.60 121.20 123.88 2hg7 s ILE 2 Ca 0.00 -0.32 0.08 0.00 -1.10 0.00 0.00 60.65 59.31 2hg7 s ILE 2 Cb 0.00 -2.76 0.11 0.00 -1.06 0.00 0.00 42.46 38.75 2hg7 s ILE 2 CO 0.00 0.48 1.82 -0.07 -0.10 0.00 0.00 174.94 177.07 2hg7 h LEU 3 N 6.86 0.27 -0.66 2.97 -0.00 -1.63 -3.11 115.31 120.01 2hg7 h LEU 3 Ca -0.33 -0.08 0.12 0.00 -0.00 0.00 0.00 57.88 57.59 2hg7 h LEU 3 Cb 1.19 -0.07 -0.08 0.00 -0.00 0.00 0.00 40.66 41.69 2hg7 h LEU 3 CO 0.63 0.51 0.22 0.22 -0.00 0.00 0.00 178.44 180.02 2hg7 h TYR 4 N 0.25 0.38 -0.01 1.13 3.20 -1.94 0.21 116.97 120.19 2hg7 h TYR 4 Ca 0.04 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.95 2hg7 h TYR 4 Cb 0.54 -0.07 -0.00 0.00 1.54 0.00 0.00 36.73 38.75 2hg7 h TYR 4 CO 0.01 0.05 0.00 -0.44 -1.64 0.00 0.00 178.16 176.14 2hg7 h ASP 5 N 0.38 0.01 -0.46 -2.11 5.19 -1.96 0.28 116.42 117.75 2hg7 h ASP 5 Ca 0.35 -0.02 -0.01 0.00 -0.62 0.00 0.00 57.03 56.73 2hg7 h ASP 5 Cb 0.49 -0.00 -0.02 0.00 0.18 0.00 0.00 39.33 39.98 2hg7 h ASP 5 CO -0.37 0.02 0.26 0.00 -3.12 0.00 0.00 179.24 176.03 2hg7 h ALA 6 N 0.98 0.58 -0.22 3.45 0.00 -1.53 -0.77 119.26 121.76 2hg7 h ALA 6 Ca 0.00 -0.08 -0.02 0.00 0.00 0.00 0.00 54.91 54.82 2hg7 h ALA 6 Cb 0.02 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 2hg7 h ALA 6 CO -0.00 0.09 0.06 0.82 0.00 0.00 0.00 179.25 180.22 2hg7 h ILE 7 N 0.60 1.20 0.00 0.00 2.04 -0.73 -2.59 117.51 118.03 2hg7 h ILE 7 Ca 0.16 -0.63 -0.05 0.00 1.00 0.00 0.00 64.86 65.33 2hg7 h ILE 7 Cb 0.03 1.21 -0.01 0.00 -0.74 0.00 0.00 36.82 37.31 2hg7 h ILE 7 CO -0.03 0.20 -0.25 -0.03 0.00 0.00 0.00 178.15 178.04 2hg7 h MET 8 N 0.17 0.00 -0.23 2.37 4.05 -0.31 0.30 114.93 121.29 2hg7 h MET 8 Ca 0.07 0.00 -0.06 0.00 -0.28 0.00 0.00 59.70 59.43 2hg7 h MET 8 Cb 0.25 0.00 -0.01 0.00 -0.80 0.00 0.00 31.60 31.05 2hg7 h MET 8 CO -0.00 0.25 -0.10 -0.92 0.23 0.00 0.00 176.91 176.37 2hg7 h TYR 9 N 0.00 0.54 0.14 1.39 3.20 -0.92 -3.08 116.97 118.24 2hg7 h TYR 9 Ca -0.00 -0.13 -0.29 0.00 3.14 0.00 0.00 58.73 61.44 2hg7 h TYR 9 Cb 0.46 -0.13 0.01 0.00 1.54 0.00 0.00 36.73 38.61 2hg7 h TYR 9 CO 0.00 0.74 -1.35 -0.22 -1.64 0.00 0.00 178.16 175.69 2hg7 h LYS 10 N 0.18 0.30 -3.28 1.82 1.63 -1.08 -3.40 116.57 112.74 2hg7 h LYS 10 Ca 0.05 -0.51 -0.63 0.00 -0.85 0.00 0.00 60.65 58.71 2hg7 h LYS 10 Cb 0.59 0.19 -0.41 0.00 -0.60 0.00 0.00 32.23 32.01 2hg7 h LYS 10 CO 0.03 1.22 -0.64 0.71 -3.45 0.00 0.00 179.45 177.32 2hg7 s TYR 11 N -2.64 3.01 0.33 1.91 2.02 0.10 -4.94 117.35 117.15 2hg7 s TYR 11 Ca -0.06 -3.07 0.33 0.00 -0.37 0.00 0.00 57.07 53.90 2hg7 s TYR 11 Cb 0.07 -2.65 1.58 0.00 -0.40 0.00 0.00 41.96 40.56 2hg7 s TYR 11 CO 0.88 -0.73 2.08 -1.35 -1.57 0.00 0.00 175.55 174.87 2hg7 h PRO 12 N 6.42 0.00 -0.64 -1.71 0.11 -1.77 -2.42 132.00 131.99 2hg7 h PRO 12 Ca -0.05 0.00 -0.18 0.00 0.11 0.00 0.00 66.00 65.89 2hg7 h PRO 12 Cb 0.88 0.00 -0.11 0.00 0.11 0.00 0.00 31.00 31.89 2hg7 h PRO 12 CO 0.66 0.06 0.20 0.09 -0.21 0.00 0.00 178.00 178.80 2hg7 n ASN 13 N -3.30 4.57 -4.48 -2.05 3.02 -1.26 -4.86 115.26 106.90 2hg7 n ASN 13 Ca -0.01 -3.24 -0.43 0.00 -0.03 0.00 0.00 54.58 50.87 2hg7 n ASN 13 Cb 0.25 -0.71 -0.06 0.00 -0.61 0.00 0.00 39.78 38.65 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 -2.99 3.31 -0.34 5.41 0.00 -0.91 -5.02 121.76 121.22 2hg7 s ALA 14 Ca 0.53 -1.51 -0.29 0.00 0.00 0.00 0.00 51.96 50.69 2hg7 s ALA 14 Cb 0.43 -3.46 0.01 0.00 0.00 0.00 0.00 23.12 20.10 2hg7 s ALA 14 CO 0.12 -2.08 1.29 0.08 0.00 0.00 0.00 175.76 175.16 2hg7 s VAL 15 N 3.05 4.13 0.31 0.00 1.01 -1.26 -4.97 120.40 122.67 2hg7 s VAL 15 Ca 0.21 1.24 -0.29 0.00 0.00 0.00 0.00 61.98 63.14 2hg7 s VAL 15 Cb -0.16 -4.24 -0.10 0.00 0.00 0.00 0.00 36.38 31.88 2hg7 s VAL 15 CO 0.15 -0.59 1.33 -0.94 0.00 0.00 0.00 175.10 175.05 2hg7 s SER 16 N 2.89 6.76 0.00 3.32 1.04 -1.26 -1.36 113.70 125.09 2hg7 s SER 16 Ca 0.55 2.67 0.00 0.00 0.48 0.00 0.00 55.95 59.66 2hg7 s SER 16 Cb -0.15 -2.64 0.00 0.00 0.10 0.00 0.00 66.02 63.33 2hg7 s SER 16 CO 0.25 -0.56 0.00 0.54 0.98 0.00 0.00 173.24 174.45 2hg7 n ARG 17 N 1.10 -0.78 0.02 4.02 1.74 0.14 -4.69 116.66 118.21 2hg7 n ARG 17 Ca 0.01 0.19 -0.01 0.00 -0.77 0.00 0.00 57.85 57.28 2hg7 n ARG 17 Cb 0.42 -3.97 -0.00 0.00 -1.02 0.00 0.00 32.46 27.89 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 -1.14 0.02 -0.11 5.56 5.02 -1.10 -4.91 118.16 121.50 2hg7 n LYS 18 Ca 0.00 0.01 -0.23 0.00 -2.02 0.00 0.00 58.31 56.07 2hg7 n LYS 18 Cb 0.19 -0.54 -0.11 0.00 -0.02 0.00 0.00 35.03 34.56 2hg7 n LYS 18 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 2hg7 n ASP 19 N -3.32 1.88 -4.31 4.39 -0.08 -0.46 -4.93 116.55 109.71 2hg7 n ASP 19 Ca -0.01 0.41 -0.31 0.00 -1.51 0.00 0.00 54.79 53.37 2hg7 n ASP 19 Cb 0.24 -0.94 -0.16 0.00 2.34 0.00 0.00 41.12 42.61 2hg7 n ASP 19 CO 0.00 0.00 0.00 0.72 0.12 0.00 0.00 177.20 178.04 2hg7 s PHE 20 N -2.39 2.30 -0.06 -0.67 -0.71 -1.22 -1.74 117.98 113.49 2hg7 s PHE 20 Ca -0.30 -0.43 0.02 0.00 -1.04 0.00 0.00 56.93 55.18 2hg7 s PHE 20 Cb 0.07 -1.45 0.01 0.00 -1.21 0.00 0.00 43.02 40.44 2hg7 s PHE 20 CO 0.56 0.00 -0.11 -2.00 -1.34 0.00 0.00 175.22 172.33 2hg7 s GLU 21 N -0.76 1.53 0.16 1.99 2.12 -0.91 0.25 118.70 123.08 2hg7 s GLU 21 Ca 0.10 -0.38 0.08 0.00 0.36 0.00 0.00 54.97 55.13 2hg7 s GLU 21 Cb -0.10 -1.30 -0.04 0.00 0.26 0.00 0.00 34.13 32.95 2hg7 s GLU 21 CO -0.00 0.04 -0.06 -0.51 -0.54 0.00 0.00 175.26 174.20 2hg7 s LEU 22 N 0.58 3.14 0.20 2.70 1.43 -1.26 -1.67 118.68 123.80 2hg7 s LEU 22 Ca -0.12 -0.46 0.10 0.00 -1.03 0.00 0.00 54.13 52.62 2hg7 s LEU 22 Cb -0.14 -1.83 -0.04 0.00 0.03 0.00 0.00 46.19 44.20 2hg7 s LEU 22 CO 0.03 0.11 -0.19 -0.60 0.23 0.00 0.00 176.35 175.93 2hg7 s ARG 23 N -2.74 1.43 -0.17 1.70 6.06 -0.26 -4.94 118.95 120.02 2hg7 s ARG 23 Ca 0.25 -1.55 -0.10 0.00 -2.50 0.00 0.00 55.73 51.83 2hg7 s ARG 23 Cb -0.09 -1.50 -0.05 0.00 0.06 0.00 0.00 34.95 33.37 2hg7 s ARG 23 CO 0.16 0.29 0.18 1.21 -2.50 0.00 0.00 175.30 174.64 2hg7 s ASN 24 N -2.98 6.31 -0.20 -2.12 2.47 -1.26 -0.61 114.94 116.54 2hg7 s ASN 24 Ca 0.21 0.35 -0.18 0.00 0.42 0.00 0.00 52.86 53.66 2hg7 s ASN 24 Cb -0.05 -2.11 -0.20 0.00 -1.45 0.00 0.00 41.25 37.44 2hg7 s ASN 24 CO 0.09 0.21 0.18 -0.67 -3.72 0.00 0.00 177.10 173.19 2hg7 n ASP 25 N 3.21 1.91 0.00 -4.21 2.03 0.14 -4.96 116.55 114.68 2hg7 n ASP 25 Ca -0.16 0.37 0.00 0.00 0.52 0.00 0.00 54.79 55.53 2hg7 n ASP 25 Cb 0.52 -0.93 0.00 0.00 -0.72 0.00 0.00 41.12 39.99 2hg7 n ASP 25 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2hg7 n GLY 26 N 1.51 4.10 0.76 0.27 0.00 -1.26 -4.86 105.19 105.71 2hg7 n GLY 26 Ca -0.34 -0.70 0.10 0.00 0.00 0.00 0.00 46.02 45.08 2hg7 n GLY 26 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2hg7 n ASN 27 N 0.00 2.24 0.00 1.61 4.13 -1.26 -5.00 115.26 116.99 2hg7 n ASN 27 Ca 0.00 -1.86 0.00 0.00 1.68 0.00 0.00 54.58 54.40 2hg7 n ASN 27 Cb 0.00 -0.19 0.00 0.00 -1.54 0.00 0.00 39.78 38.05 2hg7 n ASN 27 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2hg7 n GLY 28 N 1.23 -0.93 3.05 7.41 0.00 -1.26 -1.33 105.19 113.37 2hg7 n GLY 28 Ca 0.16 -1.13 -0.22 0.00 0.00 0.00 0.00 46.02 44.84 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 1.52 0.44 1.61 0.01 -1.07 -0.68 113.70 111.53 2hg7 s SER 29 Ca 0.00 -0.24 0.05 0.00 1.31 0.00 0.00 55.95 57.07 2hg7 s SER 29 Cb 0.00 -0.37 -0.05 0.00 0.21 0.00 0.00 66.02 65.80 2hg7 s SER 29 CO 0.00 0.10 0.01 -0.72 0.41 0.00 0.00 173.24 173.05 2hg7 s TYR 30 N 0.07 2.25 -0.08 2.43 1.13 0.21 -1.44 117.35 121.93 2hg7 s TYR 30 Ca -0.02 -0.80 -0.13 0.00 -1.41 0.00 0.00 57.07 54.72 2hg7 s TYR 30 Cb -0.09 -1.68 -0.05 0.00 -1.10 0.00 0.00 41.96 39.04 2hg7 s TYR 30 CO 0.01 0.34 0.31 0.42 -2.51 0.00 0.00 175.55 174.11 2hg7 s ILE 31 N -2.81 5.23 0.00 -3.49 1.01 -1.26 -1.11 121.20 118.78 2hg7 s ILE 31 Ca 0.25 0.60 0.00 0.00 0.00 0.00 0.00 60.65 61.50 2hg7 s ILE 31 Cb 0.07 -3.61 0.00 0.00 0.01 0.00 0.00 42.46 38.93 2hg7 s ILE 31 CO 0.13 0.54 0.00 -1.84 0.00 0.00 0.00 174.94 173.76 2hg7 n GLU 32 N 2.35 2.62 -5.06 2.79 0.28 -1.06 -4.90 120.64 117.65 2hg7 n GLU 32 Ca -0.15 0.00 -0.32 0.00 -0.16 0.00 0.00 57.16 56.53 2hg7 n GLU 32 Cb 0.53 -0.76 -0.15 0.00 1.43 0.00 0.00 31.44 32.48 2hg7 n GLU 32 CO 0.00 0.00 0.00 0.15 -0.16 0.00 0.00 177.13 177.12 2hg7 s LYS 33 N -1.19 2.69 -0.26 3.44 -0.14 -0.67 -4.97 119.74 118.64 2hg7 s LYS 33 Ca 0.00 -0.80 -0.03 0.00 -1.36 0.00 0.00 55.97 53.78 2hg7 s LYS 33 Cb 0.00 -2.31 0.15 0.00 -1.68 0.00 0.00 37.83 33.98 2hg7 s LYS 33 CO 0.00 0.42 0.46 -0.46 -0.76 0.00 0.00 175.35 175.01 2hg7 s TRP 34 N -0.23 -1.08 -0.48 3.18 -0.11 -1.26 -2.15 118.94 116.81 2hg7 s TRP 34 Ca -0.00 1.26 0.10 0.00 1.22 0.00 0.00 56.10 58.67 2hg7 s TRP 34 Cb -0.13 0.26 -0.11 0.00 -1.50 0.00 0.00 33.47 31.99 2hg7 s TRP 34 CO 0.03 -0.74 0.43 0.09 -4.62 0.00 0.00 176.95 172.15 2hg7 n ASN 35 N 5.39 0.48 -4.69 5.86 3.02 -0.71 -4.99 115.26 119.62 2hg7 n ASN 35 Ca -0.04 -0.74 -0.44 0.00 -0.03 0.00 0.00 54.58 53.33 2hg7 n ASN 35 Cb 0.50 1.00 -0.03 0.00 -0.61 0.00 0.00 39.78 40.64 2hg7 n ASN 35 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 2hg7 n LEU 36 N -1.24 3.50 -2.22 3.41 4.77 -1.26 -4.83 117.00 119.13 2hg7 n LEU 36 Ca 0.02 1.12 -0.17 0.00 -0.03 0.00 0.00 56.01 56.95 2hg7 n LEU 36 Cb 0.16 -1.48 -0.14 0.00 -2.33 0.00 0.00 43.42 39.62 2hg7 n LEU 36 CO 0.21 -0.22 1.86 0.54 -1.33 0.00 0.00 177.39 178.45 2hg7 n ARG 37 N 2.58 2.28 -3.88 3.23 1.74 -1.26 -4.77 116.66 116.58 2hg7 n ARG 37 Ca 0.12 -1.28 -0.11 0.00 -0.77 0.00 0.00 57.85 55.82 2hg7 n ARG 37 Cb 0.32 -2.12 -0.12 0.00 -1.02 0.00 0.00 32.46 29.52 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 0.95 -0.15 0.57 7.54 0.00 -1.26 -5.15 121.76 124.27 2hg7 s ALA 38 Ca 0.67 -0.05 -0.20 0.00 0.00 0.00 0.00 51.96 52.38 2hg7 s ALA 38 Cb 0.30 -0.01 -0.04 0.00 0.00 0.00 0.00 23.12 23.37 2hg7 s ALA 38 CO -0.02 -0.10 1.29 -1.25 0.00 0.00 0.00 175.76 175.68 2hg7 s PRO 39 N -0.61 3.01 0.23 0.00 0.04 -1.26 -4.95 135.00 131.45 2hg7 s PRO 39 Ca -0.07 2.07 -0.30 0.00 0.04 0.00 0.00 61.00 62.74 2hg7 s PRO 39 Cb -0.04 -2.10 -0.10 0.00 0.04 0.00 0.00 34.50 32.30 2hg7 s PRO 39 CO 0.00 -1.24 1.46 -0.51 0.04 0.00 0.00 177.00 176.75 2hg7 s LEU 40 N -3.81 4.38 0.96 -3.56 2.01 -1.26 -5.01 118.68 112.39 2hg7 s LEU 40 Ca 0.75 2.64 -0.12 0.00 0.01 0.00 0.00 54.13 57.41 2hg7 s LEU 40 Cb -0.37 -3.62 0.17 0.00 0.01 0.00 0.00 46.19 42.38 2hg7 s LEU 40 CO 0.41 -0.73 1.11 -2.16 1.01 0.00 0.00 176.35 176.00 2hg7 s PRO 41 N 0.00 0.75 0.36 1.29 0.04 -1.26 -5.07 135.00 131.11 2hg7 s PRO 41 Ca 0.62 0.46 0.07 0.00 0.04 0.00 0.00 61.00 62.19 2hg7 s PRO 41 Cb -0.42 -1.78 -0.00 0.00 0.04 0.00 0.00 34.50 32.34 2hg7 s PRO 41 CO 0.40 -2.50 0.50 0.95 0.04 0.00 0.00 177.00 176.40 2hg7 s THR 42 N -3.07 3.72 0.24 1.26 -4.23 -1.26 -4.95 115.64 107.35 2hg7 s THR 42 Ca 0.65 -0.99 -0.05 0.00 -1.18 0.00 0.00 61.69 60.11 2hg7 s THR 42 Cb -0.17 -3.27 0.17 0.00 1.34 0.00 0.00 72.50 70.57 2hg7 s THR 42 CO 0.56 -0.11 1.82 -0.61 -0.54 0.00 0.00 174.62 175.74 2hg7 h GLN 43 N 0.80 1.10 -0.47 3.99 -0.00 -1.98 0.84 115.11 119.39 2hg7 h GLN 43 Ca -0.44 -0.18 0.01 0.00 -0.00 0.00 0.00 58.65 58.04 2hg7 h GLN 43 Cb 1.26 -0.19 -0.03 0.00 0.00 0.00 0.00 27.48 28.53 2hg7 h GLN 43 CO 0.50 0.88 0.29 0.00 0.00 0.00 0.00 178.83 180.51 2hg7 h ALA 44 N 1.26 0.60 -0.49 3.38 0.00 -1.99 0.95 119.26 122.97 2hg7 h ALA 44 Ca 0.25 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.13 2hg7 h ALA 44 Cb 0.19 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 2hg7 h ALA 44 CO -0.02 0.00 0.26 0.93 0.00 0.00 0.00 179.25 180.41 2hg7 h GLU 45 N 0.59 0.69 -0.59 0.00 5.08 -1.78 -1.02 114.58 117.55 2hg7 h GLU 45 Ca 0.18 -0.09 0.01 0.00 -1.00 0.00 0.00 59.36 58.46 2hg7 h GLU 45 Cb -0.02 -0.13 -0.03 0.00 0.50 0.00 0.00 28.75 29.07 2hg7 h GLU 45 CO -0.06 0.55 0.38 -0.07 -1.00 0.00 0.00 179.01 178.81 2hg7 h LEU 46 N 0.64 0.65 -0.93 1.33 3.38 -0.39 -1.04 115.31 118.96 2hg7 h LEU 46 Ca 0.17 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 58.12 2hg7 h LEU 46 Cb 0.08 -0.16 -0.04 0.00 0.09 0.00 0.00 40.66 40.62 2hg7 h LEU 46 CO -0.03 0.47 0.56 -0.33 0.09 0.00 0.00 178.44 179.20 2hg7 h GLU 47 N 0.78 1.27 -0.13 1.13 5.08 -0.54 -1.77 114.58 120.38 2hg7 h GLU 47 Ca 0.22 -0.12 -0.01 0.00 -1.00 0.00 0.00 59.36 58.45 2hg7 h GLU 47 Cb -0.07 -0.26 -0.01 0.00 0.50 0.00 0.00 28.75 28.91 2hg7 h GLU 47 CO -0.06 0.89 0.03 1.15 -1.00 0.00 0.00 179.01 180.02 2hg7 h THR 48 N 1.28 1.21 -0.42 1.13 2.02 -0.51 -1.61 112.91 116.01 2hg7 h THR 48 Ca 0.33 -0.65 -0.03 0.00 0.77 0.00 0.00 66.41 66.83 2hg7 h THR 48 Cb -0.05 1.39 -0.02 0.00 -1.74 0.00 0.00 68.15 67.73 2hg7 h THR 48 CO -0.06 0.19 0.11 -0.50 0.37 0.00 0.00 175.52 175.63 2hg7 h TRP 49 N 0.01 0.62 0.31 3.16 6.55 -1.07 0.20 115.95 125.73 2hg7 h TRP 49 Ca 0.04 -0.04 -0.02 0.00 0.95 0.00 0.00 58.89 59.83 2hg7 h TRP 49 Cb 0.27 -0.19 0.00 0.00 -0.86 0.00 0.00 29.16 28.39 2hg7 h TRP 49 CO 0.01 0.53 -0.15 2.35 -1.05 0.00 0.00 178.44 180.13 2hg7 h TRP 50 N 0.60 -0.38 -0.67 0.49 2.91 -1.08 0.28 115.95 118.09 2hg7 h TRP 50 Ca 0.14 -0.01 0.03 0.00 1.13 0.00 0.00 58.89 60.18 2hg7 h TRP 50 Cb 0.21 0.13 -0.04 0.00 -0.51 0.00 0.00 29.16 28.94 2hg7 h TRP 50 CO 0.01 -0.19 0.42 1.49 -1.03 0.00 0.00 178.44 179.15 2hg7 h GLU 51 N -0.49 0.81 -0.38 2.65 4.81 -0.85 -1.71 114.58 119.42 2hg7 h GLU 51 Ca -0.04 -0.05 0.02 0.00 -0.13 0.00 0.00 59.36 59.16 2hg7 h GLU 51 Cb 0.37 -0.18 -0.03 0.00 0.63 0.00 0.00 28.75 29.54 2hg7 h GLU 51 CO 0.07 0.54 0.21 0.93 -0.73 0.00 0.00 179.01 180.03 2hg7 h GLU 52 N 0.83 0.42 -0.16 1.92 5.08 -0.47 0.53 114.58 122.74 2hg7 h GLU 52 Ca 0.27 -0.03 -0.02 0.00 -1.00 0.00 0.00 59.36 58.58 2hg7 h GLU 52 Cb 0.00 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.15 2hg7 h GLU 52 CO -0.10 0.28 -0.01 1.25 -1.00 0.00 0.00 179.01 179.43 2hg7 h LEU 53 N 0.43 0.21 0.24 1.33 5.85 -0.46 0.29 115.31 123.19 2hg7 h LEU 53 Ca 0.15 -0.02 -0.33 0.00 0.84 0.00 0.00 57.88 58.52 2hg7 h LEU 53 Cb 0.03 -0.05 0.03 0.00 0.37 0.00 0.00 40.66 41.04 2hg7 h LEU 53 CO -0.08 0.27 -1.45 1.56 -0.34 0.00 0.00 178.44 178.39 2hg7 h GLN 54 N 0.23 0.51 0.00 1.25 1.08 -0.70 -3.34 115.11 114.13 2hg7 h GLN 54 Ca 0.05 -0.86 0.00 0.00 -1.45 0.00 0.00 58.65 56.39 2hg7 h GLN 54 Cb 0.18 0.32 0.00 0.00 -0.05 0.00 0.00 27.48 27.93 2hg7 h GLN 54 CO 0.00 1.41 -0.36 0.87 -0.95 0.00 0.00 178.83 179.80 2hg7 h LYS 55 N 0.14 0.00 -6.29 1.46 1.57 -0.60 -3.46 116.57 109.39 2hg7 h LYS 55 Ca -0.24 0.00 -0.53 0.00 -1.87 0.00 0.00 60.65 58.01 2hg7 h LYS 55 Cb 2.14 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 34.44 2hg7 h LYS 55 CO 0.27 0.00 -0.29 -0.80 -0.57 0.00 0.00 179.45 178.06 2hg7 s ASN 56 N -4.97 6.39 0.15 0.86 -0.87 0.06 -5.04 114.94 111.53 2hg7 s ASN 56 Ca 0.07 0.46 -0.31 0.00 -1.57 0.00 0.00 52.86 51.50 2hg7 s ASN 56 Cb 0.10 -2.04 -0.11 0.00 -0.02 0.00 0.00 41.25 39.19 2hg7 s ASN 56 CO 0.68 -0.09 1.81 -2.16 -2.57 0.00 0.00 177.10 174.78 2hg7 s PRO 57 N -3.42 4.13 1.12 -0.60 0.04 -1.26 -4.89 135.00 130.12 2hg7 s PRO 57 Ca 0.40 2.62 -0.13 0.00 0.04 0.00 0.00 61.00 63.93 2hg7 s PRO 57 Cb -0.11 -3.43 0.26 0.00 0.04 0.00 0.00 34.50 31.27 2hg7 s PRO 57 CO 0.29 -0.82 1.04 -1.25 0.04 0.00 0.00 177.00 176.31 2hg7 s PRO 58 N 2.25 -0.60 -0.09 0.56 0.04 -1.26 -4.86 135.00 131.04 2hg7 s PRO 58 Ca 0.79 0.78 -0.31 0.00 0.04 0.00 0.00 61.00 62.30 2hg7 s PRO 58 Cb -0.48 -1.60 -0.09 0.00 0.04 0.00 0.00 34.50 32.38 2hg7 s PRO 58 CO 0.35 -3.50 2.02 0.98 0.04 0.00 0.00 177.00 176.90 2hg7 n TYR 59 N -4.75 2.27 1.41 0.56 9.36 -1.26 -5.25 117.16 119.49 2hg7 n TYR 59 Ca 0.04 -0.16 0.11 0.00 3.32 0.00 0.00 57.90 61.21 2hg7 n TYR 59 Cb 0.55 -2.72 0.67 0.00 -0.63 0.00 0.00 39.34 37.20 2hg7 n TYR 59 CO 0.00 0.00 0.00 -1.91 0.22 0.00 0.00 176.86 175.17