#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 3.25 0.16 3.17 1.09 -1.26 -4.78 121.20 122.82 2hg7 s ILE 2 Ca 0.00 -0.58 -0.11 0.00 -1.10 0.00 0.00 60.65 58.86 2hg7 s ILE 2 Cb 0.00 -2.39 0.01 0.00 -1.06 0.00 0.00 42.46 39.02 2hg7 s ILE 2 CO 0.00 0.51 1.57 -0.07 -0.10 0.00 0.00 174.94 176.84 2hg7 h LEU 3 N 6.87 0.99 -0.54 2.97 -0.00 -1.97 -3.24 115.31 120.39 2hg7 h LEU 3 Ca -0.29 -0.37 0.10 0.00 -0.00 0.00 0.00 57.88 57.32 2hg7 h LEU 3 Cb 1.20 -0.27 -0.08 0.00 -0.00 0.00 0.00 40.66 41.51 2hg7 h LEU 3 CO 0.58 1.13 0.10 0.22 -0.00 0.00 0.00 178.44 180.47 2hg7 h TYR 4 N 0.84 0.16 -0.56 1.13 3.20 -1.94 -0.15 116.97 119.64 2hg7 h TYR 4 Ca 0.12 0.03 0.01 0.00 3.14 0.00 0.00 58.73 62.04 2hg7 h TYR 4 Cb 0.71 0.01 -0.03 0.00 1.54 0.00 0.00 36.73 38.96 2hg7 h TYR 4 CO 0.05 -0.03 0.36 -0.44 -1.64 0.00 0.00 178.16 176.46 2hg7 h ASP 5 N 0.23 0.60 -0.30 -2.11 3.32 -1.98 0.11 116.42 116.30 2hg7 h ASP 5 Ca 0.28 -0.01 -0.03 0.00 0.02 0.00 0.00 57.03 57.29 2hg7 h ASP 5 Cb 0.39 -0.14 -0.01 0.00 0.22 0.00 0.00 39.33 39.79 2hg7 h ASP 5 CO -0.37 0.43 0.07 0.00 -1.72 0.00 0.00 179.24 177.66 2hg7 h ALA 6 N 1.22 0.40 -0.22 3.45 0.00 -1.42 -2.09 119.26 120.59 2hg7 h ALA 6 Ca 0.21 -0.17 0.02 0.00 0.00 0.00 0.00 54.91 54.96 2hg7 h ALA 6 Cb -0.05 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.61 2hg7 h ALA 6 CO -0.06 0.06 0.10 0.82 0.00 0.00 0.00 179.25 180.17 2hg7 h ILE 7 N 0.32 0.99 0.00 0.00 2.04 -0.69 -2.05 117.51 118.12 2hg7 h ILE 7 Ca 0.09 -0.08 -0.01 0.00 1.00 0.00 0.00 64.86 65.86 2hg7 h ILE 7 Cb 0.29 0.74 -0.00 0.00 -0.74 0.00 0.00 36.82 37.11 2hg7 h ILE 7 CO 0.00 0.04 -0.07 -0.03 0.00 0.00 0.00 178.15 178.10 2hg7 h MET 8 N 0.22 0.00 -0.01 2.37 4.05 -0.69 0.17 114.93 121.05 2hg7 h MET 8 Ca 0.09 0.00 -0.00 0.00 -0.28 0.00 0.00 59.70 59.51 2hg7 h MET 8 Cb 0.03 0.00 -0.00 0.00 -0.80 0.00 0.00 31.60 30.83 2hg7 h MET 8 CO -0.07 0.07 -0.01 -0.92 0.23 0.00 0.00 176.91 176.21 2hg7 h TYR 9 N 0.00 0.04 0.07 1.39 3.20 -0.66 -3.06 116.97 117.95 2hg7 h TYR 9 Ca -0.00 -0.01 -0.25 0.00 3.14 0.00 0.00 58.73 61.61 2hg7 h TYR 9 Cb 0.16 -0.01 0.01 0.00 1.54 0.00 0.00 36.73 38.42 2hg7 h TYR 9 CO 0.00 0.48 -1.10 -0.22 -1.64 0.00 0.00 178.16 175.68 2hg7 h LYS 10 N -0.42 0.37 -3.12 1.82 3.64 -1.17 -3.39 116.57 114.30 2hg7 h LYS 10 Ca 0.00 -0.49 -0.64 0.00 -1.27 0.00 0.00 60.65 58.26 2hg7 h LYS 10 Cb 0.47 0.16 -0.40 0.00 -0.41 0.00 0.00 32.23 32.05 2hg7 h LYS 10 CO 0.00 1.18 -0.46 0.66 -2.27 0.00 0.00 179.45 178.56 2hg7 n TYR 11 N -3.66 3.50 0.18 1.91 4.01 0.57 -4.88 117.16 118.79 2hg7 n TYR 11 Ca -0.08 -4.27 0.07 0.00 -0.16 0.00 0.00 57.90 53.46 2hg7 n TYR 11 Cb 0.93 -0.75 0.15 0.00 -0.31 0.00 0.00 39.34 39.36 2hg7 n TYR 11 CO 0.00 0.00 0.00 -1.35 -0.46 0.00 0.00 176.86 175.05 2hg7 h PRO 12 N 5.49 0.00 -0.00 -0.72 0.11 -1.73 -3.10 132.00 132.04 2hg7 h PRO 12 Ca 0.15 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.26 2hg7 h PRO 12 Cb 0.76 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.87 2hg7 h PRO 12 CO 0.76 0.30 -0.17 0.09 -0.21 0.00 0.00 178.00 178.77 2hg7 n ASN 13 N -3.21 0.44 -4.70 -2.05 3.02 -1.26 -4.82 115.26 102.68 2hg7 n ASN 13 Ca 0.02 -0.37 -0.40 0.00 -0.03 0.00 0.00 54.58 53.80 2hg7 n ASN 13 Cb 0.62 -0.07 -0.04 0.00 -0.61 0.00 0.00 39.78 39.67 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 -2.65 3.37 -0.21 5.41 0.00 -1.17 -5.02 121.76 121.49 2hg7 s ALA 14 Ca 0.23 0.13 -0.27 0.00 0.00 0.00 0.00 51.96 52.06 2hg7 s ALA 14 Cb 0.19 -3.07 -0.00 0.00 0.00 0.00 0.00 23.12 20.24 2hg7 s ALA 14 CO 0.52 -0.29 0.92 0.08 0.00 0.00 0.00 175.76 176.99 2hg7 s VAL 15 N 1.24 4.79 0.39 0.00 1.01 -1.26 -5.02 120.40 121.56 2hg7 s VAL 15 Ca 0.39 1.78 -0.26 0.00 0.00 0.00 0.00 61.98 63.89 2hg7 s VAL 15 Cb -0.18 -4.20 -0.09 0.00 0.00 0.00 0.00 36.38 31.91 2hg7 s VAL 15 CO 0.17 -0.09 1.21 -0.55 0.00 0.00 0.00 175.10 175.85 2hg7 s SER 16 N 1.24 6.50 -1.83 3.32 0.15 -1.26 -2.65 113.70 119.16 2hg7 s SER 16 Ca 0.40 2.45 0.00 0.00 0.70 0.00 0.00 55.95 59.50 2hg7 s SER 16 Cb -0.16 -2.62 0.00 0.00 -1.71 0.00 0.00 66.02 61.53 2hg7 s SER 16 CO 0.09 -0.70 0.00 0.54 1.20 0.00 0.00 173.24 174.37 2hg7 n ARG 17 N 0.18 -1.26 -0.00 5.44 1.74 -0.41 -4.84 116.66 117.51 2hg7 n ARG 17 Ca 0.04 1.09 -0.00 0.00 -0.77 0.00 0.00 57.85 58.20 2hg7 n ARG 17 Cb 0.45 -5.37 -0.00 0.00 -1.02 0.00 0.00 32.46 26.52 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 -2.52 0.01 -0.13 5.56 3.00 -1.08 -4.92 118.16 118.07 2hg7 n LYS 18 Ca -0.18 0.00 -0.25 0.00 -0.00 0.00 0.00 58.31 57.88 2hg7 n LYS 18 Cb 0.59 -0.29 -0.11 0.00 0.00 0.00 0.00 35.03 35.22 2hg7 n LYS 18 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.40 177.15 2hg7 n ASP 19 N -2.55 1.97 -4.83 3.14 8.00 -1.24 -4.93 116.55 116.10 2hg7 n ASP 19 Ca -0.00 0.17 -0.36 0.00 0.71 0.00 0.00 54.79 55.30 2hg7 n ASP 19 Cb 0.01 -0.68 -0.07 0.00 -0.02 0.00 0.00 41.12 40.36 2hg7 n ASP 19 CO 0.00 0.00 0.00 0.72 -0.39 0.00 0.00 177.20 177.53 2hg7 s PHE 20 N -2.51 3.52 0.01 1.24 -0.71 -1.26 -1.68 117.98 116.60 2hg7 s PHE 20 Ca -0.37 0.46 0.04 0.00 -1.04 0.00 0.00 56.93 56.02 2hg7 s PHE 20 Cb 0.12 -1.97 -0.01 0.00 -1.21 0.00 0.00 43.02 39.95 2hg7 s PHE 20 CO 0.54 0.63 -0.12 -2.00 -1.34 0.00 0.00 175.22 172.93 2hg7 s GLU 21 N -0.76 0.90 -0.03 1.99 -6.30 0.79 -1.29 118.70 114.01 2hg7 s GLU 21 Ca 0.13 -0.55 -0.03 0.00 -2.50 0.00 0.00 54.97 52.03 2hg7 s GLU 21 Cb -0.12 -0.88 -0.04 0.00 0.00 0.00 0.00 34.13 33.10 2hg7 s GLU 21 CO 0.03 0.23 0.14 -0.51 0.02 0.00 0.00 175.26 175.16 2hg7 s LEU 22 N -0.64 4.19 0.20 2.70 1.43 -1.26 -2.27 118.68 123.03 2hg7 s LEU 22 Ca 0.03 0.29 -0.04 0.00 -1.03 0.00 0.00 54.13 53.37 2hg7 s LEU 22 Cb -0.06 -2.39 -0.03 0.00 0.03 0.00 0.00 46.19 43.74 2hg7 s LEU 22 CO 0.00 0.29 0.22 -0.13 0.23 0.00 0.00 176.35 176.96 2hg7 s ARG 23 N -1.71 1.26 -0.34 1.70 3.00 -0.55 -4.91 118.95 117.42 2hg7 s ARG 23 Ca 0.24 -1.49 -0.09 0.00 0.00 0.00 0.00 55.73 54.38 2hg7 s ARG 23 Cb -0.12 0.33 0.02 0.00 0.00 0.00 0.00 34.95 35.17 2hg7 s ARG 23 CO 0.14 -0.45 0.15 1.21 0.00 0.00 0.00 175.30 176.36 2hg7 s ASN 24 N -3.10 5.50 0.18 0.23 2.47 -1.26 0.04 114.94 118.99 2hg7 s ASN 24 Ca 0.32 -0.86 0.10 0.00 0.42 0.00 0.00 52.86 52.84 2hg7 s ASN 24 Cb 0.05 -1.96 -0.09 0.00 -1.45 0.00 0.00 41.25 37.79 2hg7 s ASN 24 CO 0.10 -0.29 1.35 -0.78 -3.72 0.00 0.00 177.10 173.75 2hg7 h ASP 25 N 8.34 0.00 0.00 -4.21 3.58 -1.77 -3.49 116.42 118.87 2hg7 h ASP 25 Ca -0.28 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.17 2hg7 h ASP 25 Cb 1.11 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.16 2hg7 h ASP 25 CO 0.63 0.82 0.00 0.61 -2.88 0.00 0.00 179.24 178.42 2hg7 n GLY 26 N 1.26 -1.81 2.07 -0.78 0.00 -1.26 -4.95 105.19 99.73 2hg7 n GLY 26 Ca 0.01 0.75 -0.24 0.00 0.00 0.00 0.00 46.02 46.54 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 5.52 0.00 1.61 5.15 -1.26 -4.88 115.26 121.40 2hg7 n ASN 27 Ca 0.00 -3.40 0.00 0.00 -0.60 0.00 0.00 54.58 50.58 2hg7 n ASN 27 Cb 0.00 -0.90 0.00 0.00 -0.53 0.00 0.00 39.78 38.35 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 -0.61 1.54 3.72 8.20 0.00 -1.26 -4.97 105.19 111.80 2hg7 n GLY 28 Ca 0.49 -0.30 -0.36 0.00 0.00 0.00 0.00 46.02 45.86 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 6.24 0.00 1.61 0.01 -1.26 -1.98 113.70 118.32 2hg7 s SER 29 Ca 0.00 0.27 0.00 0.00 1.31 0.00 0.00 55.95 57.53 2hg7 s SER 29 Cb 0.00 -2.11 0.00 0.00 0.21 0.00 0.00 66.02 64.12 2hg7 s SER 29 CO 0.00 0.14 0.00 0.00 0.41 0.00 0.00 173.24 173.79 2hg7 n TYR 30 N 3.69 0.00 -2.82 2.43 4.11 0.11 -3.61 117.16 121.06 2hg7 n TYR 30 Ca -0.15 0.00 -0.41 0.00 -0.00 0.00 0.00 57.90 57.34 2hg7 n TYR 30 Cb 0.52 0.00 -0.04 0.00 -0.00 0.00 0.00 39.34 39.82 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 -1.57 4.73 0.06 -3.48 1.01 -1.26 -1.47 121.20 119.21 2hg7 s ILE 31 Ca 0.00 1.88 0.00 0.00 0.00 0.00 0.00 60.65 62.53 2hg7 s ILE 31 Cb 0.00 -4.24 0.00 0.00 0.01 0.00 0.00 42.46 38.23 2hg7 s ILE 31 CO 0.00 0.27 0.00 1.21 0.00 0.00 0.00 174.94 176.42 2hg7 n GLU 32 N 3.24 0.00 -3.37 2.79 2.13 -1.03 -4.86 120.64 119.53 2hg7 n GLU 32 Ca 0.02 0.00 -0.39 0.00 0.66 0.00 0.00 57.16 57.45 2hg7 n GLU 32 Cb 0.50 -0.37 -0.08 0.00 0.27 0.00 0.00 31.44 31.76 2hg7 n GLU 32 CO 0.00 0.00 0.00 0.21 -0.41 0.00 0.00 177.13 176.93 2hg7 s LYS 33 N -2.00 4.11 -0.17 5.31 2.20 -0.96 -4.97 119.74 123.26 2hg7 s LYS 33 Ca 0.00 0.16 -0.03 0.00 -0.36 0.00 0.00 55.97 55.74 2hg7 s LYS 33 Cb 0.00 -3.59 0.06 0.00 -1.51 0.00 0.00 37.83 32.79 2hg7 s LYS 33 CO 0.00 -0.16 0.05 -0.46 -0.36 0.00 0.00 175.35 174.43 2hg7 s TRP 34 N 1.68 0.71 -0.24 4.03 -0.11 -1.26 -0.15 118.94 123.61 2hg7 s TRP 34 Ca 0.18 -0.61 0.02 0.00 1.22 0.00 0.00 56.10 56.91 2hg7 s TRP 34 Cb -0.15 -0.89 0.03 0.00 -1.50 0.00 0.00 33.47 30.96 2hg7 s TRP 34 CO 0.09 -0.55 0.75 0.09 -4.62 0.00 0.00 176.95 172.71 2hg7 n ASN 35 N 5.13 1.56 -4.75 5.86 3.02 -0.68 -4.97 115.26 120.44 2hg7 n ASN 35 Ca -0.08 -1.43 -0.41 0.00 -0.03 0.00 0.00 54.58 52.63 2hg7 n ASN 35 Cb 0.48 -0.02 -0.03 0.00 -0.61 0.00 0.00 39.78 39.60 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 -0.49 4.48 -1.55 3.41 1.43 -1.26 -4.90 118.68 119.80 2hg7 s LEU 36 Ca 0.03 2.35 -0.10 0.00 -1.03 0.00 0.00 54.13 55.39 2hg7 s LEU 36 Cb 0.02 -3.62 -0.10 0.00 0.03 0.00 0.00 46.19 42.52 2hg7 s LEU 36 CO 0.03 -0.34 2.98 0.54 0.23 0.00 0.00 176.35 179.79 2hg7 n ARG 37 N 1.75 3.60 -3.99 1.70 1.74 -1.26 -4.80 116.66 115.40 2hg7 n ARG 37 Ca 0.02 -2.13 -0.09 0.00 -0.77 0.00 0.00 57.85 54.87 2hg7 n ARG 37 Cb 0.44 -2.76 -0.11 0.00 -1.02 0.00 0.00 32.46 29.01 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 2.15 0.17 0.46 7.54 0.00 -1.26 -5.15 121.76 125.67 2hg7 s ALA 38 Ca 0.69 -0.64 -0.22 0.00 0.00 0.00 0.00 51.96 51.80 2hg7 s ALA 38 Cb 0.18 0.15 -0.08 0.00 0.00 0.00 0.00 23.12 23.38 2hg7 s ALA 38 CO -0.06 -0.16 1.09 -1.25 0.00 0.00 0.00 175.76 175.38 2hg7 s PRO 39 N -1.61 3.81 0.20 0.00 0.04 -1.26 -4.98 135.00 131.20 2hg7 s PRO 39 Ca -0.14 1.57 -0.31 0.00 0.04 0.00 0.00 61.00 62.15 2hg7 s PRO 39 Cb -0.09 -2.29 -0.11 0.00 0.04 0.00 0.00 34.50 32.05 2hg7 s PRO 39 CO -0.01 -0.46 1.63 -0.51 0.04 0.00 0.00 177.00 177.69 2hg7 s LEU 40 N -3.17 4.37 1.01 -3.56 2.01 -1.26 -4.98 118.68 113.10 2hg7 s LEU 40 Ca 0.65 2.77 -0.12 0.00 0.01 0.00 0.00 54.13 57.43 2hg7 s LEU 40 Cb -0.23 -3.60 0.20 0.00 0.01 0.00 0.00 46.19 42.57 2hg7 s LEU 40 CO 0.28 -0.89 1.08 -2.16 1.01 0.00 0.00 176.35 175.66 2hg7 s PRO 41 N 0.89 0.32 0.34 1.29 0.04 -1.26 -5.07 135.00 131.54 2hg7 s PRO 41 Ca 0.71 0.63 0.07 0.00 0.04 0.00 0.00 61.00 62.45 2hg7 s PRO 41 Cb -0.47 -1.71 -0.02 0.00 0.04 0.00 0.00 34.50 32.34 2hg7 s PRO 41 CO 0.34 -2.84 0.35 0.95 0.04 0.00 0.00 177.00 175.85 2hg7 s THR 42 N -2.87 3.67 0.21 1.26 -4.23 -1.26 -4.97 115.64 107.45 2hg7 s THR 42 Ca 0.66 -1.25 -0.09 0.00 -1.18 0.00 0.00 61.69 59.82 2hg7 s THR 42 Cb -0.20 -3.25 0.14 0.00 1.34 0.00 0.00 72.50 70.54 2hg7 s THR 42 CO 0.59 -0.16 1.82 -0.61 -0.54 0.00 0.00 174.62 175.71 2hg7 h GLN 43 N 1.13 0.72 -0.42 3.99 5.75 -1.99 0.80 115.11 125.09 2hg7 h GLN 43 Ca -0.45 -0.04 0.07 0.00 -0.15 0.00 0.00 58.65 58.07 2hg7 h GLN 43 Cb 1.25 -0.16 -0.06 0.00 1.07 0.00 0.00 27.48 29.59 2hg7 h GLN 43 CO 0.57 0.48 0.09 0.00 -2.65 0.00 0.00 178.83 177.31 2hg7 h ALA 44 N 1.33 0.46 0.23 3.38 0.00 -1.99 -0.76 119.26 121.92 2hg7 h ALA 44 Ca 0.29 0.08 -0.00 0.00 0.00 0.00 0.00 54.91 55.29 2hg7 h ALA 44 Cb 0.13 0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 2hg7 h ALA 44 CO -0.16 -0.31 -0.19 0.93 0.00 0.00 0.00 179.25 179.52 2hg7 h GLU 45 N 0.22 -0.41 -0.44 0.00 5.08 -1.72 -1.33 114.58 115.98 2hg7 h GLU 45 Ca 0.21 0.03 0.09 0.00 -1.00 0.00 0.00 59.36 58.68 2hg7 h GLU 45 Cb 0.25 0.09 -0.08 0.00 0.50 0.00 0.00 28.75 29.52 2hg7 h GLU 45 CO -0.27 -0.27 -0.03 -0.07 -1.00 0.00 0.00 179.01 177.37 2hg7 h LEU 46 N -0.43 -0.25 -0.90 1.33 3.38 -0.39 -0.39 115.31 117.67 2hg7 h LEU 46 Ca -0.01 0.11 -0.11 0.00 0.09 0.00 0.00 57.88 57.96 2hg7 h LEU 46 Cb 0.38 0.21 -0.01 0.00 0.09 0.00 0.00 40.66 41.33 2hg7 h LEU 46 CO -0.02 -0.08 -0.38 -0.33 0.09 0.00 0.00 178.44 177.72 2hg7 h GLU 47 N 0.08 0.34 -0.35 1.13 5.08 -1.10 -1.87 114.58 117.88 2hg7 h GLU 47 Ca 0.22 -0.16 -0.03 0.00 -1.00 0.00 0.00 59.36 58.39 2hg7 h GLU 47 Cb 0.33 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.55 2hg7 h GLU 47 CO -0.39 0.67 0.11 1.15 -1.00 0.00 0.00 179.01 179.55 2hg7 h THR 48 N 0.29 1.21 -0.61 1.13 2.02 0.01 0.24 112.91 117.20 2hg7 h THR 48 Ca 0.03 -0.69 -0.04 0.00 0.77 0.00 0.00 66.41 66.48 2hg7 h THR 48 Cb 0.80 0.99 -0.03 0.00 -1.74 0.00 0.00 68.15 68.18 2hg7 h THR 48 CO 0.06 0.24 0.21 -0.50 0.37 0.00 0.00 175.52 175.90 2hg7 h TRP 49 N 0.42 0.96 -0.46 3.16 6.55 -0.98 0.24 115.95 125.84 2hg7 h TRP 49 Ca 0.11 -0.09 -0.03 0.00 0.95 0.00 0.00 58.89 59.84 2hg7 h TRP 49 Cb 0.26 -0.28 -0.02 0.00 -0.86 0.00 0.00 29.16 28.26 2hg7 h TRP 49 CO 0.01 0.78 0.19 2.35 -1.05 0.00 0.00 178.44 180.72 2hg7 h TRP 50 N 0.86 0.70 -0.28 0.49 2.91 -1.15 0.18 115.95 119.66 2hg7 h TRP 50 Ca 0.20 -0.05 -0.01 0.00 1.13 0.00 0.00 58.89 60.16 2hg7 h TRP 50 Cb 0.26 -0.21 -0.01 0.00 -0.51 0.00 0.00 29.16 28.68 2hg7 h TRP 50 CO 0.02 0.59 0.14 0.93 -1.03 0.00 0.00 178.44 179.08 2hg7 h GLU 51 N 0.61 0.41 -0.56 2.65 5.08 -0.13 -1.44 114.58 121.19 2hg7 h GLU 51 Ca 0.16 -0.06 -0.06 0.00 -1.00 0.00 0.00 59.36 58.40 2hg7 h GLU 51 Cb 0.18 -0.07 -0.03 0.00 0.50 0.00 0.00 28.75 29.33 2hg7 h GLU 51 CO -0.01 0.39 0.12 0.93 -1.00 0.00 0.00 179.01 179.43 2hg7 h GLU 52 N 0.32 0.86 -0.00 2.33 5.08 -0.34 0.37 114.58 123.21 2hg7 h GLU 52 Ca 0.10 -0.19 -0.05 0.00 -1.00 0.00 0.00 59.36 58.22 2hg7 h GLU 52 Cb 0.11 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 29.23 2hg7 h GLU 52 CO -0.01 0.78 -0.25 1.25 -1.00 0.00 0.00 179.01 179.78 2hg7 h LEU 53 N 0.83 0.00 0.11 1.33 5.85 -0.32 0.51 115.31 123.62 2hg7 h LEU 53 Ca 0.18 -0.00 -0.37 0.00 0.84 0.00 0.00 57.88 58.53 2hg7 h LEU 53 Cb 0.32 -0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.33 2hg7 h LEU 53 CO 0.00 0.26 -2.05 0.00 -0.34 0.00 0.00 178.44 176.31 2hg7 n GLN 54 N -4.24 0.75 0.07 1.25 1.13 -0.57 -4.36 117.38 111.41 2hg7 n GLN 54 Ca -0.02 0.25 0.12 0.00 -1.94 0.00 0.00 57.00 55.41 2hg7 n GLN 54 Cb 0.31 -1.69 0.15 0.00 0.11 0.00 0.00 30.24 29.11 2hg7 n GLN 54 CO 0.00 0.00 0.00 -0.22 -1.44 0.00 0.00 177.06 175.40 2hg7 h LYS 55 N 0.06 0.00 -5.07 -1.09 3.64 -0.24 -3.43 116.57 110.44 2hg7 h LYS 55 Ca -0.44 0.00 -0.65 0.00 -1.27 0.00 0.00 60.65 58.29 2hg7 h LYS 55 Cb 2.02 0.00 -0.26 0.00 -0.41 0.00 0.00 32.23 33.58 2hg7 h LYS 55 CO 0.07 0.00 -0.70 1.21 -2.27 0.00 0.00 179.45 177.76 2hg7 s ASN 56 N -4.45 4.49 -0.18 4.20 2.47 0.16 -5.04 114.94 116.60 2hg7 s ASN 56 Ca 0.05 -0.31 -0.29 0.00 0.42 0.00 0.00 52.86 52.73 2hg7 s ASN 56 Cb 0.13 -1.76 -0.03 0.00 -1.45 0.00 0.00 41.25 38.13 2hg7 s ASN 56 CO 0.73 0.03 1.52 -2.84 -3.72 0.00 0.00 177.10 172.82 2hg7 s PRO 57 N 1.19 3.99 0.23 0.43 0.02 -1.26 -4.64 135.00 134.96 2hg7 s PRO 57 Ca 0.03 1.75 -0.30 0.00 0.02 0.00 0.00 61.00 62.50 2hg7 s PRO 57 Cb -0.14 -3.95 -0.09 0.00 0.02 0.00 0.00 34.50 30.34 2hg7 s PRO 57 CO -0.00 -1.04 1.07 -2.14 -0.33 0.00 0.00 177.00 174.55 2hg7 s PRO 58 N 4.22 4.66 -0.22 5.54 0.02 -1.26 -5.01 135.00 142.95 2hg7 s PRO 58 Ca 0.67 1.71 -0.22 0.00 0.02 0.00 0.00 61.00 63.18 2hg7 s PRO 58 Cb -0.25 -3.24 -0.02 0.00 0.02 0.00 0.00 34.50 31.00 2hg7 s PRO 58 CO 0.26 0.22 0.68 -0.47 -0.33 0.00 0.00 177.00 177.35 2hg7 s TYR 59 N -0.80 3.34 -2.78 6.54 5.04 -1.26 -5.26 117.35 122.17 2hg7 s TYR 59 Ca 0.46 0.95 0.22 0.00 -2.44 0.00 0.00 57.07 56.26 2hg7 s TYR 59 Cb -0.30 -2.87 0.18 0.00 0.35 0.00 0.00 41.96 39.32 2hg7 s TYR 59 CO 0.37 -0.26 1.21 -1.91 -1.34 0.00 0.00 175.55 173.61