#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1hgi h LEU 2 N 0.00 0.00 0.00 0.99 3.38 -1.91 -2.43 115.31 115.35 1hgi h LEU 2 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1hgi h LEU 2 Cb 0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 1hgi h LEU 2 CO 0.00 0.19 -1.37 0.49 0.09 0.00 0.00 178.44 177.84 1hgi n PHE 3 N -3.98 0.08 -2.45 1.13 3.01 -1.26 -4.99 117.46 109.01 1hgi n PHE 3 Ca -0.02 0.02 -0.12 0.00 1.01 0.00 0.00 57.45 58.35 1hgi n PHE 3 Cb 0.27 -0.31 0.01 0.00 -0.01 0.00 0.00 39.48 39.44 1hgi n PHE 3 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1hgi n GLY 4 N 1.37 -0.04 0.04 1.37 0.00 -0.92 -4.96 105.19 102.06 1hgi n GLY 4 Ca 0.00 -0.34 -0.04 0.00 0.00 0.00 0.00 46.02 45.64 1hgi n GLY 4 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1hgi n ALA 5 N -2.16 0.38 -1.93 4.61 0.00 -1.26 -0.63 120.51 119.53 1hgi n ALA 5 Ca -0.10 -0.47 -0.42 0.00 0.00 0.00 0.00 53.44 52.45 1hgi n ALA 5 Cb 0.59 0.01 -0.03 0.00 0.00 0.00 0.00 19.45 20.02 1hgi n ALA 5 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1hgi s ILE 6 N -1.85 2.66 -1.35 0.00 1.01 -1.26 -0.98 121.20 119.42 1hgi s ILE 6 Ca -0.12 0.50 -0.07 0.00 0.00 0.00 0.00 60.65 60.95 1hgi s ILE 6 Cb 0.02 -3.32 0.05 0.00 0.01 0.00 0.00 42.46 39.22 1hgi s ILE 6 CO 0.19 0.05 0.49 0.00 0.00 0.00 0.00 174.94 175.67 1hgi n ALA 7 N 3.40 -1.02 -2.00 9.38 0.00 -1.20 -3.88 120.51 125.20 1hgi n ALA 7 Ca 0.11 0.15 0.00 0.00 0.00 0.00 0.00 53.44 53.70 1hgi n ALA 7 Cb 0.39 -3.04 0.00 0.00 0.00 0.00 0.00 19.45 16.80 1hgi n ALA 7 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1hgi n GLY 8 N -1.26 4.08 0.13 0.00 0.00 -0.15 -4.83 105.19 103.16 1hgi n GLY 8 Ca -0.05 -0.48 0.12 0.00 0.00 0.00 0.00 46.02 45.60 1hgi n GLY 8 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 1hgi n PHE 9 N 0.00 0.81 -3.47 1.61 1.16 0.20 -3.95 117.46 113.82 1hgi n PHE 9 Ca 0.00 0.32 -0.41 0.00 -1.87 0.00 0.00 57.45 55.48 1hgi n PHE 9 Cb 0.00 -1.01 -0.10 0.00 -1.61 0.00 0.00 39.48 36.76 1hgi n PHE 9 CO 0.00 0.00 0.00 0.42 -1.87 0.00 0.00 176.76 175.31 1hgi s ILE 10 N -3.31 5.24 0.22 1.97 1.01 -0.62 -3.97 121.20 121.74 1hgi s ILE 10 Ca 0.04 -0.30 -0.08 0.00 0.00 0.00 0.00 60.65 60.31 1hgi s ILE 10 Cb 0.09 -3.82 0.19 0.00 0.01 0.00 0.00 42.46 38.93 1hgi s ILE 10 CO 0.39 -0.14 1.88 -0.33 0.00 0.00 0.00 174.94 176.74 1hgi h GLU 11 N 8.55 1.04 -2.87 2.79 5.08 -1.84 -3.17 114.58 124.15 1hgi h GLU 11 Ca -0.29 -0.06 0.05 0.00 -1.00 0.00 0.00 59.36 58.06 1hgi h GLU 11 Cb 1.14 -0.24 -0.09 0.00 0.50 0.00 0.00 28.75 30.07 1hgi h GLU 11 CO 0.69 0.69 0.27 0.54 -1.00 0.00 0.00 179.01 180.20 1hgi s ASN 12 N -5.90 -0.37 0.92 1.42 4.22 -1.26 -4.68 114.94 109.29 1hgi s ASN 12 Ca -0.13 -0.32 -0.13 0.00 -2.14 0.00 0.00 52.86 50.14 1hgi s ASN 12 Cb 0.16 0.63 0.15 0.00 1.28 0.00 0.00 41.25 43.47 1hgi s ASN 12 CO 0.79 -1.10 1.17 -0.83 -2.04 0.00 0.00 177.10 175.09 1hgi s GLY 13 N -2.82 1.61 -0.34 0.45 0.00 -1.26 -5.00 107.32 99.95 1hgi s GLY 13 Ca 0.07 -0.68 -0.05 0.00 0.00 0.00 0.00 44.72 44.06 1hgi s GLY 13 CO -0.02 -0.08 0.09 -0.98 0.00 0.00 0.00 173.10 172.11 1hgi s TRP 14 N -3.40 3.30 0.43 1.90 0.51 -1.26 -4.93 118.94 115.49 1hgi s TRP 14 Ca 0.65 -1.68 0.32 0.00 -2.12 0.00 0.00 56.10 53.27 1hgi s TRP 14 Cb -0.12 -2.38 1.67 0.00 -0.81 0.00 0.00 33.47 31.83 1hgi s TRP 14 CO 0.53 -0.79 2.14 0.93 -0.51 0.00 0.00 176.95 179.24 1hgi h GLU 15 N 8.14 0.00 0.00 4.98 5.08 -2.04 -2.42 114.58 128.33 1hgi h GLU 15 Ca -0.21 0.00 -0.05 0.00 -1.00 0.00 0.00 59.36 58.10 1hgi h GLU 15 Cb 1.07 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.31 1hgi h GLU 15 CO 0.60 0.07 -0.24 0.78 -1.00 0.00 0.00 179.01 179.22 1hgi h GLY 16 N 0.79 0.00 -6.57 -3.84 0.00 -2.03 -3.42 103.07 88.00 1hgi h GLY 16 Ca -0.00 0.00 -0.56 0.00 0.00 0.00 0.00 47.33 46.77 1hgi h GLY 16 CO 0.01 0.00 0.94 -0.29 0.00 0.00 0.00 176.54 177.20 1hgi s MET 17 N -4.14 3.75 -0.00 4.80 -2.45 -0.91 -4.79 119.30 115.55 1hgi s MET 17 Ca -0.02 0.70 0.09 0.00 -1.25 0.00 0.00 55.69 55.21 1hgi s MET 17 Cb 0.13 -3.90 -0.11 0.00 1.25 0.00 0.00 34.83 32.20 1hgi s MET 17 CO 0.65 -1.34 0.33 0.44 1.05 0.00 0.00 175.02 176.15 1hgi n ILE 18 N 6.74 0.00 0.63 10.11 -5.35 -1.26 -4.59 119.36 125.64 1hgi n ILE 18 Ca 0.13 -0.26 0.10 0.00 -0.27 0.00 0.00 62.75 62.45 1hgi n ILE 18 Cb 0.49 0.77 0.27 0.00 -1.74 0.00 0.00 39.64 39.43 1hgi n ILE 18 CO 0.00 0.00 0.00 -0.90 -1.76 0.00 0.00 176.55 173.89 1hgi n ASP 19 N -1.41 2.67 0.00 7.28 5.75 -1.26 -4.98 116.55 124.59 1hgi n ASP 19 Ca 0.01 -1.90 0.00 0.00 -0.01 0.00 0.00 54.79 52.88 1hgi n ASP 19 Cb 0.18 -0.23 0.00 0.00 -1.03 0.00 0.00 41.12 40.03 1hgi n ASP 19 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1hgi n GLY 20 N 1.33 1.05 0.08 6.12 0.00 -1.26 -4.80 105.19 107.70 1hgi n GLY 20 Ca 0.18 -0.85 -0.10 0.00 0.00 0.00 0.00 46.02 45.25 1hgi n GLY 20 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 173.32 174.81 1hgi h TRP 21 N 0.00 0.17 -3.15 1.61 4.06 -1.90 -3.47 115.95 113.27 1hgi h TRP 21 Ca 0.00 -0.12 -0.48 0.00 2.06 0.00 0.00 58.89 60.35 1hgi h TRP 21 Cb 0.00 -0.01 -0.16 0.00 -1.00 0.00 0.00 29.16 27.99 1hgi h TRP 21 CO 0.00 1.10 -0.76 0.71 -3.56 0.00 0.00 178.44 175.93 1hgi s TYR 22 N -2.69 1.73 0.00 0.49 2.02 -1.26 -5.02 117.35 112.63 1hgi s TYR 22 Ca -0.01 -0.52 0.00 0.00 -0.37 0.00 0.00 57.07 56.17 1hgi s TYR 22 Cb 0.09 -0.84 0.00 0.00 -0.40 0.00 0.00 41.96 40.81 1hgi s TYR 22 CO 0.84 0.32 0.00 0.41 -1.57 0.00 0.00 175.55 175.56 1hgi n GLY 23 N 0.04 0.67 3.27 0.71 0.00 -1.26 0.08 105.19 108.71 1hgi n GLY 23 Ca -0.11 -0.83 -0.25 0.00 0.00 0.00 0.00 46.02 44.82 1hgi n GLY 23 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1hgi s PHE 24 N -3.16 1.86 -0.05 1.61 0.40 0.26 -4.88 117.98 114.02 1hgi s PHE 24 Ca 0.00 -0.39 0.01 0.00 -0.60 0.00 0.00 56.93 55.95 1hgi s PHE 24 Cb 0.00 -1.08 0.02 0.00 0.51 0.00 0.00 43.02 42.48 1hgi s PHE 24 CO 0.00 0.14 -0.05 1.03 0.70 0.00 0.00 175.22 177.04 1hgi s ARG 25 N -1.46 0.94 0.29 0.44 0.52 -1.26 -0.41 118.95 118.01 1hgi s ARG 25 Ca 0.08 -0.13 0.03 0.00 -0.52 0.00 0.00 55.73 55.19 1hgi s ARG 25 Cb -0.09 -0.96 -0.06 0.00 0.52 0.00 0.00 34.95 34.36 1hgi s ARG 25 CO 0.03 -0.10 0.06 -3.38 0.02 0.00 0.00 175.30 171.92 1hgi s HIS 26 N 1.05 1.77 -0.01 -0.53 -3.43 -0.07 -4.99 115.29 109.08 1hgi s HIS 26 Ca -0.09 -1.01 0.01 0.00 -0.80 0.00 0.00 55.06 53.17 1hgi s HIS 26 Cb -0.14 -1.10 0.01 0.00 -1.43 0.00 0.00 32.58 29.92 1hgi s HIS 26 CO -0.01 -0.09 -0.01 -1.14 -2.00 0.00 0.00 174.74 171.49 1hgi s GLN 27 N -3.92 0.22 0.00 -0.38 0.74 -1.26 -1.45 119.66 113.60 1hgi s GLN 27 Ca 0.35 -0.02 0.00 0.00 0.05 0.00 0.00 55.36 55.74 1hgi s GLN 27 Cb 0.08 -0.29 0.00 0.00 1.10 0.00 0.00 33.01 33.90 1hgi s GLN 27 CO 0.14 -0.02 0.00 0.27 -0.55 0.00 0.00 175.29 175.13 1hgi n ASN 28 N 3.44 0.00 0.29 6.67 6.94 -0.43 -5.01 115.26 127.16 1hgi n ASN 28 Ca -0.18 -0.59 0.17 0.00 -0.02 0.00 0.00 54.58 53.96 1hgi n ASN 28 Cb 0.56 0.00 0.83 0.00 -2.36 0.00 0.00 39.78 38.81 1hgi n ASN 28 CO 0.00 0.00 0.00 0.77 -1.03 0.00 0.00 177.26 177.00 1hgi h SER 29 N 0.00 0.00 -0.55 0.53 4.64 -1.88 -2.37 113.55 113.92 1hgi h SER 29 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1hgi h SER 29 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1hgi h SER 29 CO 0.00 0.04 0.00 -0.62 -0.87 0.00 0.00 176.83 175.38 1hgi n GLU 30 N -3.22 3.09 0.00 4.77 1.02 -1.26 -5.07 120.64 119.97 1hgi n GLU 30 Ca -0.01 -2.56 0.00 0.00 -0.02 0.00 0.00 57.16 54.57 1hgi n GLU 30 Cb 0.23 -1.60 0.00 0.00 -0.02 0.00 0.00 31.44 30.06 1hgi n GLU 30 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1hgi n GLY 31 N 0.97 0.26 3.63 0.62 0.00 -0.89 -5.01 105.19 104.76 1hgi n GLY 31 Ca 0.21 -2.18 -0.24 0.00 0.00 0.00 0.00 46.02 43.80 1hgi n GLY 31 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1hgi s THR 32 N 0.00 2.70 -0.03 2.61 -4.23 -1.26 -1.32 115.64 114.11 1hgi s THR 32 Ca 0.00 -1.97 -0.30 0.00 -1.18 0.00 0.00 61.69 58.24 1hgi s THR 32 Cb 0.00 -2.79 0.11 0.00 1.34 0.00 0.00 72.50 71.16 1hgi s THR 32 CO 0.00 -0.22 0.98 -0.83 -0.54 0.00 0.00 174.62 174.01 1hgi s GLY 33 N -3.71 -0.40 0.10 3.99 0.00 -0.53 -4.98 107.32 101.79 1hgi s GLY 33 Ca 0.34 1.02 0.03 0.00 0.00 0.00 0.00 44.72 46.12 1hgi s GLY 33 CO 0.19 0.33 -0.09 1.62 0.00 0.00 0.00 173.10 175.15 1hgi s GLN 34 N -2.96 0.85 -0.28 2.90 0.74 -1.26 -0.89 119.66 118.76 1hgi s GLN 34 Ca 0.07 -1.20 -0.16 0.00 0.05 0.00 0.00 55.36 54.12 1hgi s GLN 34 Cb -0.01 -0.48 0.11 0.00 1.10 0.00 0.00 33.01 33.74 1hgi s GLN 34 CO -0.07 0.06 0.84 0.00 -0.55 0.00 0.00 175.29 175.58 1hgi s ALA 35 N -2.66 -2.07 0.62 1.58 0.00 0.45 -4.96 121.76 114.72 1hgi s ALA 35 Ca 0.07 2.29 -0.15 0.00 0.00 0.00 0.00 51.96 54.17 1hgi s ALA 35 Cb -0.01 -1.56 -0.02 0.00 0.00 0.00 0.00 23.12 21.52 1hgi s ALA 35 CO -0.01 -0.36 1.08 0.00 0.00 0.00 0.00 175.76 176.47 1hgi s ALA 36 N 1.42 2.64 -0.27 0.00 0.00 -1.26 -0.57 121.76 123.72 1hgi s ALA 36 Ca -0.09 0.42 -0.09 0.00 0.00 0.00 0.00 51.96 52.21 1hgi s ALA 36 Cb -0.04 -3.26 -0.03 0.00 0.00 0.00 0.00 23.12 19.79 1hgi s ALA 36 CO -0.17 -1.00 0.12 0.34 0.00 0.00 0.00 175.76 175.06 1hgi s ASP 37 N -2.78 5.48 0.29 0.00 2.15 0.11 -4.81 116.67 117.11 1hgi s ASP 37 Ca 0.64 -0.22 0.23 0.00 0.43 0.00 0.00 52.55 53.63 1hgi s ASP 37 Cb -0.17 -2.00 0.15 0.00 -0.30 0.00 0.00 42.92 40.59 1hgi s ASP 37 CO 0.40 -0.08 1.27 -0.07 -0.17 0.00 0.00 175.17 176.52 1hgi h LEU 38 N 8.30 0.00 -0.05 -1.34 3.38 -1.94 -3.01 115.31 120.66 1hgi h LEU 38 Ca -0.36 -0.01 -0.03 0.00 0.09 0.00 0.00 57.88 57.57 1hgi h LEU 38 Cb 1.17 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.92 1hgi h LEU 38 CO 0.58 0.00 -0.08 0.11 0.09 0.00 0.00 178.44 179.14 1hgi h LYS 39 N 0.00 0.15 -0.33 1.13 1.57 -1.97 -1.50 116.57 115.62 1hgi h LYS 39 Ca 0.00 -0.09 -0.15 0.00 -1.87 0.00 0.00 60.65 58.54 1hgi h LYS 39 Cb 0.99 0.01 -0.01 0.00 0.08 0.00 0.00 32.23 33.30 1hgi h LYS 39 CO 0.00 0.65 -0.41 0.66 -0.57 0.00 0.00 179.45 179.77 1hgi h SER 40 N -0.34 0.86 -0.81 0.86 4.64 -1.96 -1.42 113.55 115.38 1hgi h SER 40 Ca 0.00 -0.40 0.10 0.00 -0.47 0.00 0.00 61.79 61.03 1hgi h SER 40 Cb 0.63 -0.24 -0.08 0.00 -0.31 0.00 0.00 62.40 62.40 1hgi h SER 40 CO 0.02 1.16 0.45 0.74 -0.87 0.00 0.00 176.83 178.33 1hgi h THR 41 N 0.65 0.87 -0.34 2.95 2.02 -1.51 -0.57 112.91 116.98 1hgi h THR 41 Ca 0.05 -0.25 -0.17 0.00 0.77 0.00 0.00 66.41 66.80 1hgi h THR 41 Cb 0.98 0.07 -0.00 0.00 -1.74 0.00 0.00 68.15 67.46 1hgi h THR 41 CO 0.09 0.13 -0.47 -0.61 0.37 0.00 0.00 175.52 175.04 1hgi h GLN 42 N 0.74 0.92 -0.13 6.66 5.75 -0.97 -1.22 115.11 126.85 1hgi h GLN 42 Ca 0.40 -0.53 0.03 0.00 -0.15 0.00 0.00 58.65 58.40 1hgi h GLN 42 Cb 0.41 0.04 -0.03 0.00 1.07 0.00 0.00 27.48 28.98 1hgi h GLN 42 CO -0.27 1.18 -0.05 0.00 -2.65 0.00 0.00 178.83 177.04 1hgi h ALA 43 N 0.73 0.07 -0.36 3.38 0.00 -0.39 0.37 119.26 123.05 1hgi h ALA 43 Ca 0.04 0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.00 1hgi h ALA 43 Cb 1.08 0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.98 1hgi h ALA 43 CO 0.11 -0.50 0.23 0.00 0.00 0.00 0.00 179.25 179.09 1hgi h ALA 44 N 1.11 0.46 -0.47 0.00 0.00 -1.09 -2.44 119.26 116.83 1hgi h ALA 44 Ca 0.07 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 54.90 1hgi h ALA 44 Cb 0.13 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 1hgi h ALA 44 CO -0.15 -0.06 0.15 0.82 0.00 0.00 0.00 179.25 180.02 1hgi h ILE 45 N 0.48 1.22 -0.77 0.00 2.04 -0.23 -2.26 117.51 117.99 1hgi h ILE 45 Ca 0.13 -0.73 -0.05 0.00 1.00 0.00 0.00 64.86 65.21 1hgi h ILE 45 Cb -0.02 0.82 -0.03 0.00 -0.74 0.00 0.00 36.82 36.85 1hgi h ILE 45 CO -0.03 0.27 0.30 0.44 0.00 0.00 0.00 178.15 179.13 1hgi h ASP 46 N 0.62 1.07 -0.26 1.72 3.32 -0.22 -0.13 116.42 122.54 1hgi h ASP 46 Ca 0.15 -0.18 -0.02 0.00 0.02 0.00 0.00 57.03 57.00 1hgi h ASP 46 Cb 0.26 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 39.52 1hgi h ASP 46 CO -0.01 0.96 0.08 1.56 -1.72 0.00 0.00 179.24 180.11 1hgi h GLN 47 N 1.11 0.40 -0.17 3.56 4.20 -1.31 -1.19 115.11 121.71 1hgi h GLN 47 Ca 0.25 -0.08 -0.06 0.00 0.06 0.00 0.00 58.65 58.82 1hgi h GLN 47 Cb 0.23 -0.06 -0.01 0.00 0.30 0.00 0.00 27.48 27.94 1hgi h GLN 47 CO -0.02 0.46 -0.15 0.82 -0.67 0.00 0.00 178.83 179.28 1hgi h ILE 48 N 0.25 1.20 -0.14 2.54 2.04 -0.83 -1.10 117.51 121.47 1hgi h ILE 48 Ca 0.08 -0.87 -0.20 0.00 1.00 0.00 0.00 64.86 64.87 1hgi h ILE 48 Cb 0.23 1.24 0.00 0.00 -0.74 0.00 0.00 36.82 37.55 1hgi h ILE 48 CO -0.00 0.27 -0.72 0.78 0.00 0.00 0.00 178.15 178.48 1hgi h ASN 49 N 0.26 0.75 -0.37 1.72 -0.26 -0.82 -0.73 115.58 116.13 1hgi h ASN 49 Ca 0.05 -0.48 0.01 0.00 -0.56 0.00 0.00 56.30 55.32 1hgi h ASN 49 Cb 0.42 -0.22 -0.02 0.00 -1.06 0.00 0.00 38.32 37.44 1hgi h ASN 49 CO 0.03 1.25 0.24 1.23 -1.06 0.00 0.00 177.43 179.11 1hgi h GLY 50 N 0.88 0.52 0.96 2.83 0.00 -0.57 0.21 103.07 107.91 1hgi h GLY 50 Ca -0.03 -0.19 0.01 0.00 0.00 0.00 0.00 47.33 47.12 1hgi h GLY 50 CO 0.14 0.18 0.22 1.70 0.00 0.00 0.00 176.54 178.78 1hgi h LYS 51 N 0.49 0.43 -0.83 4.80 3.64 -1.15 -1.54 116.57 122.41 1hgi h LYS 51 Ca 0.14 -0.03 -0.01 0.00 -1.27 0.00 0.00 60.65 59.48 1hgi h LYS 51 Cb -0.05 -0.10 -0.04 0.00 -0.41 0.00 0.00 32.23 31.63 1hgi h LYS 51 CO -0.03 0.29 0.47 1.25 -2.27 0.00 0.00 179.45 179.15 1hgi h LEU 52 N 0.44 1.03 -0.54 5.20 5.85 -0.10 -2.62 115.31 124.58 1hgi h LEU 52 Ca 0.13 -0.09 -0.11 0.00 0.84 0.00 0.00 57.88 58.66 1hgi h LEU 52 Cb -0.03 -0.26 -0.02 0.00 0.37 0.00 0.00 40.66 40.72 1hgi h LEU 52 CO -0.04 0.82 -0.08 0.78 -0.34 0.00 0.00 178.44 179.58 1hgi h ASN 53 N 1.16 1.00 -0.34 1.25 2.35 -0.00 -2.38 115.58 118.62 1hgi h ASN 53 Ca 0.30 -0.34 -0.01 0.00 -0.55 0.00 0.00 56.30 55.70 1hgi h ASN 53 Cb 0.01 -0.27 -0.02 0.00 0.05 0.00 0.00 38.32 38.09 1hgi h ASN 53 CO -0.05 1.11 0.19 -0.09 -1.65 0.00 0.00 177.43 176.94 1hgi h ARG 54 N 0.88 0.50 0.00 0.81 9.65 -0.93 -1.75 114.38 123.55 1hgi h ARG 54 Ca 0.14 -0.05 -0.15 0.00 -1.10 0.00 0.00 59.98 58.83 1hgi h ARG 54 Cb 0.64 -0.10 -0.02 0.00 -1.39 0.00 0.00 29.97 29.09 1hgi h ARG 54 CO 0.04 0.38 -0.72 0.28 2.80 0.00 0.00 179.97 182.75 1hgi h VAL 55 N 0.51 1.38 -0.01 0.20 2.07 -1.25 -3.00 116.25 116.14 1hgi h VAL 55 Ca 0.13 -2.60 0.00 0.00 0.82 0.00 0.00 66.70 65.06 1hgi h VAL 55 Cb 0.03 2.46 0.00 0.00 -1.52 0.00 0.00 31.29 32.26 1hgi h VAL 55 CO -0.02 0.71 -0.13 -0.38 0.02 0.00 0.00 177.57 177.76 1hgi n ILE 56 N -3.47 0.00 -1.68 4.57 5.41 -0.72 -4.92 119.36 118.55 1hgi n ILE 56 Ca 0.00 -0.21 -0.46 0.00 1.00 0.00 0.00 62.75 63.08 1hgi n ILE 56 Cb 0.76 0.52 -0.04 0.00 -0.71 0.00 0.00 39.64 40.17 1hgi n ILE 56 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 176.55 177.76 1hgi n GLU 57 N -0.15 2.35 -0.62 0.38 2.13 -0.80 -4.57 120.64 119.36 1hgi n GLU 57 Ca 0.15 0.86 0.00 0.00 0.66 0.00 0.00 57.16 58.83 1hgi n GLU 57 Cb 0.37 -2.71 0.00 0.00 0.27 0.00 0.00 31.44 29.36 1hgi n GLU 57 CO 0.00 0.00 0.00 1.17 -0.41 0.00 0.00 177.13 177.89 1hgi n LYS 58 N 6.10 0.00 -2.57 5.31 3.00 -1.26 -4.95 118.16 123.79 1hgi n LYS 58 Ca 0.21 0.00 -0.42 0.00 -0.00 0.00 0.00 58.31 58.09 1hgi n LYS 58 Cb 0.32 -0.18 -0.03 0.00 0.00 0.00 0.00 35.03 35.15 1hgi n LYS 58 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.40 178.35 1hgi s THR 59 N 0.00 4.51 0.31 3.15 -4.23 -1.26 -5.02 115.64 113.09 1hgi s THR 59 Ca 0.00 1.81 -0.21 0.00 -1.18 0.00 0.00 61.69 62.11 1hgi s THR 59 Cb 0.00 -4.16 -0.09 0.00 1.34 0.00 0.00 72.50 69.58 1hgi s THR 59 CO 0.00 -0.02 0.83 0.54 -0.54 0.00 0.00 174.62 175.43 1hgi s ASN 60 N 1.32 7.06 0.03 3.99 4.22 -1.26 -5.05 114.94 125.25 1hgi s ASN 60 Ca 0.52 1.56 -0.01 0.00 -2.14 0.00 0.00 52.86 52.78 1hgi s ASN 60 Cb -0.21 -2.48 -0.04 0.00 1.28 0.00 0.00 41.25 39.80 1hgi s ASN 60 CO 0.19 -0.11 0.18 -1.83 -2.04 0.00 0.00 177.10 173.49 1hgi s GLU 61 N -2.40 3.36 0.01 3.55 -1.05 -1.26 -5.10 118.70 115.81 1hgi s GLU 61 Ca 0.50 -0.41 0.01 0.00 -0.15 0.00 0.00 54.97 54.92 1hgi s GLU 61 Cb -0.15 -3.02 -0.01 0.00 -0.44 0.00 0.00 34.13 30.51 1hgi s GLU 61 CO 0.20 0.64 -0.04 0.15 0.95 0.00 0.00 175.26 177.15 1hgi s LYS 62 N -2.20 0.34 0.00 -4.83 -0.14 -1.26 -5.13 119.74 106.52 1hgi s LYS 62 Ca 0.30 -0.28 0.00 0.00 -1.36 0.00 0.00 55.97 54.63 1hgi s LYS 62 Cb -0.13 -0.26 0.00 0.00 -1.68 0.00 0.00 37.83 35.77 1hgi s LYS 62 CO 0.22 0.06 0.00 1.19 -0.76 0.00 0.00 175.35 176.07 1hgi n PHE 63 N 2.61 0.00 -2.01 3.18 3.72 -1.26 -5.01 117.46 118.70 1hgi n PHE 63 Ca -0.15 0.00 -0.42 0.00 -0.05 0.00 0.00 57.45 56.83 1hgi n PHE 63 Cb 0.58 0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 39.09 1hgi n PHE 63 CO 0.00 0.00 0.00 -1.58 -0.05 0.00 0.00 176.76 175.13 1hgi s HIS 64 N 2.13 3.00 0.00 1.38 2.46 -1.26 -4.98 115.29 118.03 1hgi s HIS 64 Ca 0.00 0.67 0.00 0.00 0.47 0.00 0.00 55.06 56.20 1hgi s HIS 64 Cb 0.00 -3.86 0.00 0.00 -0.13 0.00 0.00 32.58 28.59 1hgi s HIS 64 CO 0.00 -3.18 0.00 1.04 -2.47 0.00 0.00 174.74 170.13 1hgi n GLN 65 N 4.28 1.48 -4.10 2.88 6.02 -1.26 -5.16 117.38 121.52 1hgi n GLN 65 Ca 0.14 0.00 -0.22 0.00 -0.01 0.00 0.00 57.00 56.90 1hgi n GLN 65 Cb 0.40 0.00 -0.04 0.00 1.02 0.00 0.00 30.24 31.62 1hgi n GLN 65 CO 0.00 0.00 0.00 0.96 -1.01 0.00 0.00 177.06 177.01 1hgi s ILE 66 N 2.67 4.54 0.46 5.09 -4.36 -1.26 -5.08 121.20 123.27 1hgi s ILE 66 Ca 0.00 -1.33 -0.23 0.00 -0.26 0.00 0.00 60.65 58.83 1hgi s ILE 66 Cb 0.00 -3.45 -0.07 0.00 1.25 0.00 0.00 42.46 40.19 1hgi s ILE 66 CO 0.00 -0.33 1.19 -1.61 0.24 0.00 0.00 174.94 174.43 1hgi s GLU 67 N -3.81 3.71 0.00 0.37 0.41 -1.26 -4.95 118.70 113.17 1hgi s GLU 67 Ca 0.33 1.85 0.00 0.00 -0.41 0.00 0.00 54.97 56.74 1hgi s GLU 67 Cb -0.08 -2.42 0.00 0.00 -1.78 0.00 0.00 34.13 29.85 1hgi s GLU 67 CO 0.25 -0.61 0.51 1.63 -0.49 0.00 0.00 175.26 176.55 1hgi n LYS 68 N -0.49 0.53 -3.73 1.61 5.02 -1.26 -4.87 118.16 114.96 1hgi n LYS 68 Ca 0.07 -0.64 -0.12 0.00 -2.02 0.00 0.00 58.31 55.61 1hgi n LYS 68 Cb 0.47 -0.75 -0.12 0.00 -0.02 0.00 0.00 35.03 34.61 1hgi n LYS 68 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 1hgi s GLU 69 N -0.26 0.28 0.04 1.97 2.02 -1.26 -5.05 118.70 116.44 1hgi s GLU 69 Ca 0.00 0.55 0.03 0.00 0.02 0.00 0.00 54.97 55.58 1hgi s GLU 69 Cb 0.00 -0.02 -0.02 0.00 0.10 0.00 0.00 34.13 34.18 1hgi s GLU 69 CO 0.00 -0.13 -0.10 -0.06 0.02 0.00 0.00 175.26 174.99 1hgi s PHE 70 N 1.00 0.89 -0.55 1.61 0.40 -1.26 -5.07 117.98 115.00 1hgi s PHE 70 Ca -0.07 -0.40 0.11 0.00 -0.60 0.00 0.00 56.93 55.97 1hgi s PHE 70 Cb -0.08 -0.52 -0.13 0.00 0.51 0.00 0.00 43.02 42.80 1hgi s PHE 70 CO -0.07 -0.02 0.49 -1.13 0.70 0.00 0.00 175.22 175.19 1hgi n SER 71 N 1.73 0.55 -4.64 1.36 3.41 -1.26 -5.01 113.62 109.76 1hgi n SER 71 Ca -0.20 -0.77 -0.25 0.00 -0.26 0.00 0.00 58.87 57.39 1hgi n SER 71 Cb 0.55 1.00 -0.09 0.00 -0.26 0.00 0.00 64.21 65.41 1hgi n SER 71 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 1hgi s GLU 72 N -2.09 2.07 -0.30 4.33 0.41 -1.26 -5.11 118.70 116.76 1hgi s GLU 72 Ca 0.04 -1.78 -0.12 0.00 -0.41 0.00 0.00 54.97 52.71 1hgi s GLU 72 Cb 0.09 -1.91 -0.04 0.00 -1.78 0.00 0.00 34.13 30.49 1hgi s GLU 72 CO 0.47 0.11 0.21 0.08 -0.49 0.00 0.00 175.26 175.64 1hgi s VAL 73 N -2.54 5.28 -0.03 2.63 1.01 -1.26 -4.95 120.40 120.54 1hgi s VAL 73 Ca 0.35 0.02 0.05 0.00 0.00 0.00 0.00 61.98 62.40 1hgi s VAL 73 Cb 0.01 -3.59 -0.08 0.00 0.00 0.00 0.00 36.38 32.73 1hgi s VAL 73 CO 0.19 0.16 0.07 -0.62 0.00 0.00 0.00 175.10 174.90 1hgi n GLU 74 N 5.07 1.66 0.00 2.72 1.02 -1.26 -5.13 120.64 124.73 1hgi n GLU 74 Ca -0.14 -0.03 0.00 0.00 -0.02 0.00 0.00 57.16 56.98 1hgi n GLU 74 Cb 0.51 -1.14 0.00 0.00 -0.02 0.00 0.00 31.44 30.80 1hgi n GLU 74 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1hgi n GLY 75 N 2.43 1.08 0.30 0.62 0.00 -1.26 -4.75 105.19 103.61 1hgi n GLY 75 Ca -0.05 -1.60 0.02 0.00 0.00 0.00 0.00 46.02 44.40 1hgi n GLY 75 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 1hgi h ARG 76 N 0.00 -0.00 -0.22 1.61 2.43 -2.00 -1.02 114.38 115.18 1hgi h ARG 76 Ca 0.00 0.00 -0.19 0.00 -0.81 0.00 0.00 59.98 58.98 1hgi h ARG 76 Cb 0.00 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.56 1hgi h ARG 76 CO 0.00 -0.00 -0.62 0.97 -1.51 0.00 0.00 179.97 178.81 1hgi h ILE 77 N -0.00 1.28 0.00 1.20 6.09 -2.01 -2.84 117.51 121.23 1hgi h ILE 77 Ca 0.38 -1.82 -0.10 0.00 -1.37 0.00 0.00 64.86 61.95 1hgi h ILE 77 Cb 0.58 1.82 -0.01 0.00 0.47 0.00 0.00 36.82 39.68 1hgi h ILE 77 CO -0.82 0.58 -0.47 -0.61 -3.07 0.00 0.00 178.15 173.76 1hgi h GLN 78 N 0.55 0.00 -0.55 2.19 4.15 -1.56 -1.54 115.11 118.35 1hgi h GLN 78 Ca -0.02 0.00 -0.07 0.00 0.77 0.00 0.00 58.65 59.34 1hgi h GLN 78 Cb 1.24 0.00 -0.02 0.00 0.21 0.00 0.00 27.48 28.91 1hgi h GLN 78 CO 0.13 0.47 0.07 -0.44 -1.93 0.00 0.00 178.83 177.13 1hgi h ASP 79 N 0.00 0.84 -0.33 -0.69 3.32 -1.11 -1.52 116.42 116.93 1hgi h ASP 79 Ca -0.00 -0.18 -0.07 0.00 0.02 0.00 0.00 57.03 56.79 1hgi h ASP 79 Cb 0.90 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 40.22 1hgi h ASP 79 CO 0.06 0.86 -0.05 0.25 -1.72 0.00 0.00 179.24 178.64 1hgi h LEU 80 N 0.84 0.62 -0.38 1.55 5.85 -1.08 -0.30 115.31 122.41 1hgi h LEU 80 Ca 0.17 -0.35 0.06 0.00 0.84 0.00 0.00 57.88 58.61 1hgi h LEU 80 Cb 0.40 -0.17 -0.05 0.00 0.37 0.00 0.00 40.66 41.20 1hgi h LEU 80 CO 0.01 0.82 0.06 -0.33 -0.34 0.00 0.00 178.44 178.66 1hgi h GLU 81 N 0.41 0.18 -0.70 1.25 5.08 -1.11 0.34 114.58 120.03 1hgi h GLU 81 Ca 0.09 -0.01 -0.07 0.00 -1.00 0.00 0.00 59.36 58.37 1hgi h GLU 81 Cb 0.53 -0.04 -0.03 0.00 0.50 0.00 0.00 28.75 29.71 1hgi h GLU 81 CO 0.03 0.12 0.16 0.87 -1.00 0.00 0.00 179.01 179.19 1hgi h LYS 82 N 0.18 1.12 -0.27 2.33 1.57 -1.19 -2.87 116.57 117.45 1hgi h LYS 82 Ca 0.18 -0.27 -0.14 0.00 -1.87 0.00 0.00 60.65 58.55 1hgi h LYS 82 Cb 0.22 -0.15 -0.01 0.00 0.08 0.00 0.00 32.23 32.38 1hgi h LYS 82 CO -0.25 0.99 -0.41 -0.92 -0.57 0.00 0.00 179.45 178.29 1hgi h TYR 83 N 1.06 0.76 -0.60 -1.35 3.20 0.12 -0.40 116.97 119.76 1hgi h TYR 83 Ca 0.22 -0.22 -0.02 0.00 3.14 0.00 0.00 58.73 61.85 1hgi h TYR 83 Cb 0.38 -0.16 -0.03 0.00 1.54 0.00 0.00 36.73 38.46 1hgi h TYR 83 CO 0.03 0.94 0.31 0.28 -1.64 0.00 0.00 178.16 178.08 1hgi h VAL 84 N 0.52 1.21 -0.06 1.81 2.07 -0.29 -0.63 116.25 120.88 1hgi h VAL 84 Ca 0.04 -0.55 -0.25 0.00 0.82 0.00 0.00 66.70 66.76 1hgi h VAL 84 Cb 0.93 0.46 0.02 0.00 -1.52 0.00 0.00 31.29 31.18 1hgi h VAL 84 CO 0.08 0.23 -0.92 -0.08 0.02 0.00 0.00 177.57 176.90 1hgi h GLU 85 N 0.82 0.73 -0.31 1.57 4.57 -1.31 -1.53 114.58 119.13 1hgi h GLU 85 Ca 0.21 -0.71 -0.12 0.00 -1.18 0.00 0.00 59.36 57.56 1hgi h GLU 85 Cb 0.09 0.18 -0.01 0.00 -0.16 0.00 0.00 28.75 28.84 1hgi h GLU 85 CO -0.03 1.29 -0.30 0.22 -1.18 0.00 0.00 179.01 179.01 1hgi h ASP 86 N 0.44 0.66 1.01 1.04 3.58 -0.93 0.11 116.42 122.33 1hgi h ASP 86 Ca -0.10 -0.26 -0.06 0.00 0.42 0.00 0.00 57.03 57.03 1hgi h ASP 86 Cb 1.57 -0.18 -0.01 0.00 1.72 0.00 0.00 39.33 42.43 1hgi h ASP 86 CO 0.18 0.93 -0.30 0.71 -2.88 0.00 0.00 179.24 177.88 1hgi h THR 87 N 0.55 0.68 -0.37 2.25 1.35 -1.04 -1.10 112.91 115.23 1hgi h THR 87 Ca 0.07 -1.39 -0.09 0.00 -0.55 0.00 0.00 66.41 64.45 1hgi h THR 87 Cb 0.79 1.91 -0.01 0.00 -1.73 0.00 0.00 68.15 69.11 1hgi h THR 87 CO 0.06 0.30 -0.13 0.50 -0.25 0.00 0.00 175.52 176.00 1hgi h LYS 88 N 0.00 0.74 -0.23 4.72 3.64 -0.40 -2.47 116.57 122.56 1hgi h LYS 88 Ca -0.00 -0.30 -0.04 0.00 -1.27 0.00 0.00 60.65 59.03 1hgi h LYS 88 Cb 0.89 -0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 32.67 1hgi h LYS 88 CO 0.04 0.91 -0.02 0.82 -2.27 0.00 0.00 179.45 178.93 1hgi h ILE 89 N 0.53 1.26 -0.19 2.00 2.04 -0.53 -1.12 117.51 121.50 1hgi h ILE 89 Ca 0.09 -0.95 -0.02 0.00 1.00 0.00 0.00 64.86 64.99 1hgi h ILE 89 Cb 0.66 1.42 -0.01 0.00 -0.74 0.00 0.00 36.82 38.15 1hgi h ILE 89 CO 0.04 0.29 0.05 0.44 0.00 0.00 0.00 178.15 178.98 1hgi h ASP 90 N 0.18 0.23 -0.10 1.72 3.32 -1.23 0.09 116.42 120.63 1hgi h ASP 90 Ca 0.06 -0.02 -0.07 0.00 0.02 0.00 0.00 57.03 57.03 1hgi h ASP 90 Cb 0.44 -0.06 0.00 0.00 0.22 0.00 0.00 39.33 39.93 1hgi h ASP 90 CO 0.02 0.24 -0.20 -0.07 -1.72 0.00 0.00 179.24 177.51 1hgi h LEU 91 N 0.26 0.35 -1.23 1.55 3.38 -1.08 -0.69 115.31 117.85 1hgi h LEU 91 Ca 0.07 -0.56 -0.07 0.00 0.09 0.00 0.00 57.88 57.41 1hgi h LEU 91 Cb 0.10 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 40.74 1hgi h LEU 91 CO -0.00 0.85 -0.18 -0.50 0.09 0.00 0.00 178.44 178.69 1hgi h TRP 92 N -0.13 0.33 -0.59 1.13 4.06 -0.87 -1.68 115.95 118.20 1hgi h TRP 92 Ca 0.00 -0.05 -0.08 0.00 2.06 0.00 0.00 58.89 60.82 1hgi h TRP 92 Cb 0.79 -0.09 -0.02 0.00 -1.00 0.00 0.00 29.16 28.84 1hgi h TRP 92 CO 0.11 0.48 0.05 0.77 -3.56 0.00 0.00 178.44 176.29 1hgi h SER 93 N 0.29 0.95 0.13 -3.49 0.02 -0.81 -0.60 113.55 110.04 1hgi h SER 93 Ca 0.05 -0.23 -0.00 0.00 -0.84 0.00 0.00 61.79 60.77 1hgi h SER 93 Cb 0.49 -0.25 -0.01 0.00 0.14 0.00 0.00 62.40 62.77 1hgi h SER 93 CO 0.03 0.97 -0.10 0.22 -1.14 0.00 0.00 176.83 176.82 1hgi h TYR 94 N 0.92 -0.25 -0.30 3.45 3.20 -0.64 -1.85 116.97 121.48 1hgi h TYR 94 Ca 0.18 -0.00 0.06 0.00 3.14 0.00 0.00 58.73 62.11 1hgi h TYR 94 Cb 0.46 0.09 -0.06 0.00 1.54 0.00 0.00 36.73 38.77 1hgi h TYR 94 CO 0.03 -0.15 -0.07 -0.91 -1.64 0.00 0.00 178.16 175.41 1hgi h ASN 95 N -0.24 -0.28 -0.36 -2.11 2.35 -0.74 -0.26 115.58 113.95 1hgi h ASN 95 Ca -0.01 0.09 0.03 0.00 -0.55 0.00 0.00 56.30 55.87 1hgi h ASN 95 Cb 0.21 0.19 -0.03 0.00 0.05 0.00 0.00 38.32 38.73 1hgi h ASN 95 CO -0.00 -0.10 0.16 0.00 -1.65 0.00 0.00 177.43 175.84 1hgi h ALA 96 N 1.30 0.43 -0.46 -0.83 0.00 -0.87 0.57 119.26 119.39 1hgi h ALA 96 Ca 0.14 0.02 -0.02 0.00 0.00 0.00 0.00 54.91 55.06 1hgi h ALA 96 Cb 0.22 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 17.96 1hgi h ALA 96 CO -0.31 -0.22 0.21 1.49 0.00 0.00 0.00 179.25 180.42 1hgi h GLU 97 N 0.34 0.68 -0.08 0.00 4.57 -0.96 -1.51 114.58 117.62 1hgi h GLU 97 Ca 0.16 -0.11 -0.12 0.00 -1.18 0.00 0.00 59.36 58.10 1hgi h GLU 97 Cb 0.09 -0.12 -0.01 0.00 -0.16 0.00 0.00 28.75 28.55 1hgi h GLU 97 CO -0.13 0.59 -0.51 1.25 -1.18 0.00 0.00 179.01 179.04 1hgi h LEU 98 N 0.61 0.22 0.14 1.64 5.85 -0.71 -2.53 115.31 120.54 1hgi h LEU 98 Ca 0.16 -0.11 -0.01 0.00 0.84 0.00 0.00 57.88 58.76 1hgi h LEU 98 Cb 0.15 -0.06 0.00 0.00 0.37 0.00 0.00 40.66 41.12 1hgi h LEU 98 CO -0.02 0.69 -0.07 0.25 -0.34 0.00 0.00 178.44 178.96 1hgi h LEU 99 N 0.16 -0.16 -1.17 2.25 5.85 -0.34 -1.35 115.31 120.56 1hgi h LEU 99 Ca 0.01 -0.24 -0.08 0.00 0.84 0.00 0.00 57.88 58.40 1hgi h LEU 99 Cb 0.95 0.04 -0.01 0.00 0.37 0.00 0.00 40.66 42.01 1hgi h LEU 99 CO 0.08 0.16 -0.39 -0.37 -0.34 0.00 0.00 178.44 177.58 1hgi h VAL 100 N -0.50 1.12 0.16 1.05 -1.51 -1.30 -1.09 116.25 114.18 1hgi h VAL 100 Ca -0.02 -1.39 -0.01 0.00 -1.23 0.00 0.00 66.70 64.05 1hgi h VAL 100 Cb 0.40 1.79 0.00 0.00 -2.13 0.00 0.00 31.29 31.34 1hgi h VAL 100 CO 0.03 0.38 -0.08 0.00 -1.23 0.00 0.00 177.57 176.67 1hgi h ALA 101 N 1.61 -0.21 0.09 5.19 0.00 -1.17 0.02 119.26 124.78 1hgi h ALA 101 Ca -0.00 -0.12 0.01 0.00 0.00 0.00 0.00 54.91 54.79 1hgi h ALA 101 Cb 0.75 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.61 1hgi h ALA 101 CO 0.05 -0.53 -0.11 -0.07 0.00 0.00 0.00 179.25 178.59 1hgi h LEU 102 N -0.40 -0.29 -0.34 0.00 3.38 -0.99 -1.55 115.31 115.12 1hgi h LEU 102 Ca -0.02 0.03 0.07 0.00 0.09 0.00 0.00 57.88 58.06 1hgi h LEU 102 Cb 0.31 0.11 -0.08 0.00 0.09 0.00 0.00 40.66 41.09 1hgi h LEU 102 CO 0.04 -0.17 -0.18 -0.33 0.09 0.00 0.00 178.44 177.89 1hgi h GLU 103 N -0.23 -0.12 -0.62 1.13 4.39 -1.08 -0.58 114.58 117.46 1hgi h GLU 103 Ca 0.01 0.01 -0.09 0.00 0.34 0.00 0.00 59.36 59.63 1hgi h GLU 103 Cb 0.23 0.03 -0.02 0.00 -0.10 0.00 0.00 28.75 28.89 1hgi h GLU 103 CO -0.05 -0.08 0.02 -0.91 -1.16 0.00 0.00 179.01 176.83 1hgi h ASN 104 N -0.13 1.05 -0.70 1.42 2.35 -0.86 0.20 115.58 118.91 1hgi h ASN 104 Ca 0.17 -0.30 0.06 0.00 -0.55 0.00 0.00 56.30 55.69 1hgi h ASN 104 Cb 0.39 -0.28 -0.06 0.00 0.05 0.00 0.00 38.32 38.42 1hgi h ASN 104 CO -0.42 1.09 0.40 -0.61 -1.65 0.00 0.00 177.43 176.24 1hgi h GLN 105 N 0.98 0.71 -0.22 0.81 5.75 -0.65 -0.76 115.11 121.74 1hgi h GLN 105 Ca 0.18 -0.04 -0.19 0.00 -0.15 0.00 0.00 58.65 58.45 1hgi h GLN 105 Cb 0.53 -0.16 0.00 0.00 1.07 0.00 0.00 27.48 28.93 1hgi h GLN 105 CO 0.03 0.47 -0.59 1.25 -2.65 0.00 0.00 178.83 177.34 1hgi h HIS 106 N 0.73 1.01 -0.66 3.99 2.76 -0.18 -2.74 115.15 120.06 1hgi h HIS 106 Ca 0.32 -0.39 -0.02 0.00 -2.20 0.00 0.00 60.37 58.08 1hgi h HIS 106 Cb 0.19 -0.18 -0.03 0.00 1.55 0.00 0.00 27.41 28.95 1hgi h HIS 106 CO -0.07 1.21 0.35 1.15 -1.30 0.00 0.00 177.93 179.27 1hgi h THR 107 N 0.52 1.20 -0.44 6.26 2.02 0.39 0.14 112.91 123.01 1hgi h THR 107 Ca -0.01 -0.52 -0.10 0.00 0.77 0.00 0.00 66.41 66.54 1hgi h THR 107 Cb 1.21 0.32 -0.01 0.00 -1.74 0.00 0.00 68.15 67.93 1hgi h THR 107 CO 0.13 0.23 -0.13 0.40 0.37 0.00 0.00 175.52 176.51 1hgi h ILE 108 N 0.92 1.27 -0.12 3.11 2.04 -1.13 -2.41 117.51 121.19 1hgi h ILE 108 Ca 0.23 -1.25 -0.12 0.00 1.00 0.00 0.00 64.86 64.71 1hgi h ILE 108 Cb 0.04 1.18 -0.01 0.00 -0.74 0.00 0.00 36.82 37.29 1hgi h ILE 108 CO -0.04 0.43 -0.47 0.44 0.00 0.00 0.00 178.15 178.51 1hgi h ASP 109 N 0.69 0.33 0.29 1.72 3.32 -0.92 -1.65 116.42 120.18 1hgi h ASP 109 Ca 0.11 -0.15 -0.01 0.00 0.02 0.00 0.00 57.03 56.99 1hgi h ASP 109 Cb 0.68 -0.09 0.00 0.00 0.22 0.00 0.00 39.33 40.14 1hgi h ASP 109 CO 0.05 0.75 -0.14 0.25 -1.72 0.00 0.00 179.24 178.43 1hgi h LEU 110 N 0.25 -0.33 -1.04 1.55 6.46 -0.70 0.84 115.31 122.34 1hgi h LEU 110 Ca 0.01 -0.01 -0.09 0.00 -0.12 0.00 0.00 57.88 57.68 1hgi h LEU 110 Cb 0.92 0.08 -0.01 0.00 -0.73 0.00 0.00 40.66 40.93 1hgi h LEU 110 CO 0.08 -0.21 -0.27 0.71 -0.62 0.00 0.00 178.44 178.12 1hgi h THR 111 N -0.41 1.26 -0.52 1.05 1.35 -1.40 -1.03 112.91 113.21 1hgi h THR 111 Ca -0.04 -1.24 -0.02 0.00 -0.55 0.00 0.00 66.41 64.57 1hgi h THR 111 Cb 0.31 1.42 -0.02 0.00 -1.73 0.00 0.00 68.15 68.13 1hgi h THR 111 CO 0.06 0.38 0.26 -0.78 -0.25 0.00 0.00 175.52 175.20 1hgi h ASP 112 N 0.31 0.67 0.33 5.36 3.58 -1.02 -1.85 116.42 123.80 1hgi h ASP 112 Ca 0.05 -0.12 -0.00 0.00 0.42 0.00 0.00 57.03 57.38 1hgi h ASP 112 Cb 0.65 -0.17 -0.02 0.00 1.72 0.00 0.00 39.33 41.51 1hgi h ASP 112 CO 0.05 0.59 -0.31 -1.28 -2.88 0.00 0.00 179.24 175.41 1hgi h SER 113 N 0.69 -0.84 -0.86 2.28 0.87 -0.43 -0.89 113.55 114.37 1hgi h SER 113 Ca 0.18 0.07 0.10 0.00 -1.23 0.00 0.00 61.79 60.91 1hgi h SER 113 Cb 0.09 0.28 -0.06 0.00 -0.44 0.00 0.00 62.40 62.27 1hgi h SER 113 CO -0.02 -0.45 0.56 -0.33 -0.53 0.00 0.00 176.83 176.05 1hgi h GLU 114 N -0.67 0.80 -0.22 2.24 4.39 -1.04 0.47 114.58 120.54 1hgi h GLU 114 Ca -0.02 -0.05 0.00 0.00 0.34 0.00 0.00 59.36 59.64 1hgi h GLU 114 Cb 0.60 -0.18 -0.01 0.00 -0.10 0.00 0.00 28.75 29.06 1hgi h GLU 114 CO -0.05 0.53 0.14 1.98 -1.16 0.00 0.00 179.01 180.45 1hgi h MET 115 N 0.82 0.29 -0.16 2.33 4.05 -0.91 -1.53 114.93 119.81 1hgi h MET 115 Ca 0.40 -0.02 -0.12 0.00 -0.28 0.00 0.00 59.70 59.68 1hgi h MET 115 Cb 0.43 -0.06 -0.01 0.00 -0.80 0.00 0.00 31.60 31.15 1hgi h MET 115 CO -0.16 0.19 -0.43 -0.97 0.23 0.00 0.00 176.91 175.77 1hgi h ASN 116 N 0.30 0.41 -0.57 1.39 -1.24 0.62 -1.85 115.58 114.64 1hgi h ASN 116 Ca 0.08 -0.18 -0.04 0.00 0.71 0.00 0.00 56.30 56.87 1hgi h ASN 116 Cb -0.03 -0.12 -0.02 0.00 0.73 0.00 0.00 38.32 38.88 1hgi h ASN 116 CO -0.02 0.79 0.20 0.11 -1.29 0.00 0.00 177.43 177.22 1hgi h LYS 117 N 0.32 0.87 -0.33 6.67 1.57 0.15 -0.36 116.57 125.46 1hgi h LYS 117 Ca 0.03 -0.17 -0.06 0.00 -1.87 0.00 0.00 60.65 58.57 1hgi h LYS 117 Cb 0.89 -0.13 -0.02 0.00 0.08 0.00 0.00 32.23 33.05 1hgi h LYS 117 CO 0.07 0.77 -0.05 1.25 -0.57 0.00 0.00 179.45 180.92 1hgi h LEU 118 N 0.79 0.50 -0.20 2.94 5.85 -1.00 -0.69 115.31 123.49 1hgi h LEU 118 Ca 0.19 -0.11 -0.03 0.00 0.84 0.00 0.00 57.88 58.77 1hgi h LEU 118 Cb 0.24 -0.13 -0.01 0.00 0.37 0.00 0.00 40.66 41.13 1hgi h LEU 118 CO -0.01 0.61 0.01 0.15 -0.34 0.00 0.00 178.44 178.86 1hgi h PHE 119 N 0.50 0.38 -0.88 1.25 3.57 -0.40 -2.15 116.94 119.19 1hgi h PHE 119 Ca 0.10 -0.06 0.00 0.00 3.53 0.00 0.00 57.97 61.54 1hgi h PHE 119 Cb 0.40 -0.10 -0.04 0.00 2.79 0.00 0.00 35.95 39.00 1hgi h PHE 119 CO 0.01 0.53 0.57 0.93 -2.23 0.00 0.00 178.31 178.12 1hgi h GLU 120 N 0.13 1.18 -0.36 1.11 4.39 -0.81 -1.52 114.58 118.69 1hgi h GLU 120 Ca 0.06 -0.08 -0.00 0.00 0.34 0.00 0.00 59.36 59.67 1hgi h GLU 120 Cb 0.37 -0.26 -0.02 0.00 -0.10 0.00 0.00 28.75 28.74 1hgi h GLU 120 CO 0.01 0.80 0.21 -0.22 -1.16 0.00 0.00 179.01 178.65 1hgi h LYS 121 N 1.20 0.50 -0.71 2.33 3.64 -1.00 -0.68 116.57 121.85 1hgi h LYS 121 Ca 0.32 -0.05 -0.07 0.00 -1.27 0.00 0.00 60.65 59.58 1hgi h LYS 121 Cb -0.11 -0.10 -0.03 0.00 -0.41 0.00 0.00 32.23 31.58 1hgi h LYS 121 CO -0.07 0.38 0.16 1.15 -2.27 0.00 0.00 179.45 178.80 1hgi h THR 122 N 0.47 1.26 0.53 1.00 2.02 -1.10 -2.56 112.91 114.54 1hgi h THR 122 Ca 0.13 -1.00 -0.02 0.00 0.77 0.00 0.00 66.41 66.30 1hgi h THR 122 Cb 0.02 0.55 -0.02 0.00 -1.74 0.00 0.00 68.15 66.95 1hgi h THR 122 CO -0.02 0.38 -0.51 -0.09 0.37 0.00 0.00 175.52 175.65 1hgi h ARG 123 N 1.08 -0.99 -0.85 6.66 2.43 -0.81 -2.37 114.38 119.53 1hgi h ARG 123 Ca 0.22 0.07 0.20 0.00 -0.81 0.00 0.00 59.98 59.66 1hgi h ARG 123 Cb 0.39 0.22 -0.12 0.00 -0.42 0.00 0.00 29.97 30.05 1hgi h ARG 123 CO 0.01 -0.66 0.33 0.00 -1.51 0.00 0.00 179.97 178.13 1hgi h ARG 124 N -1.03 0.36 -0.64 0.20 3.08 -1.07 -1.35 114.38 113.92 1hgi h ARG 124 Ca -0.07 -0.02 -0.04 0.00 0.07 0.00 0.00 59.98 59.93 1hgi h ARG 124 Cb 0.89 -0.08 -0.03 0.00 0.08 0.00 0.00 29.97 30.83 1hgi h ARG 124 CO -0.05 0.24 0.26 0.37 -1.07 0.00 0.00 179.97 179.72 1hgi h GLN 125 N 0.37 0.96 0.00 0.04 4.15 -1.14 -3.02 115.11 116.47 1hgi h GLN 125 Ca 0.51 -0.17 0.00 0.00 0.77 0.00 0.00 58.65 59.77 1hgi h GLN 125 Cb 0.94 -0.16 0.00 0.00 0.21 0.00 0.00 27.48 28.47 1hgi h GLN 125 CO -0.52 0.80 0.00 1.28 -1.93 0.00 0.00 178.83 178.46 1hgi n LEU 126 N -4.43 0.46 0.00 -2.39 4.77 -0.52 -4.62 117.00 110.28 1hgi n LEU 126 Ca 0.04 0.58 0.00 0.00 -0.03 0.00 0.00 56.01 56.61 1hgi n LEU 126 Cb 0.16 -0.48 0.00 0.00 -2.33 0.00 0.00 43.42 40.77 1hgi n LEU 126 CO 0.39 -0.32 0.00 0.54 -1.33 0.00 0.00 177.39 176.68 1hgi n ARG 127 N -1.98 0.00 0.00 3.23 5.12 -1.14 -1.48 116.66 120.41 1hgi n ARG 127 Ca 0.04 0.00 0.01 0.00 -1.93 0.00 0.00 57.85 55.97 1hgi n ARG 127 Cb 0.28 0.00 0.04 0.00 -1.16 0.00 0.00 32.46 31.62 1hgi n ARG 127 CO 0.00 0.00 0.00 0.39 -1.93 0.00 0.00 177.63 176.09 1hgi n GLU 128 N 14.00 0.91 0.00 5.56 4.71 -1.26 -3.92 120.64 140.64 1hgi n GLU 128 Ca 0.00 0.00 0.12 0.00 -0.01 0.00 0.00 57.16 57.27 1hgi n GLU 128 Cb 0.00 -1.02 0.17 0.00 -1.01 0.00 0.00 31.44 29.57 1hgi n GLU 128 CO 0.00 0.00 0.00 0.09 0.09 0.00 0.00 177.13 177.31 1hgi n ASN 129 N -0.52 2.38 -3.96 1.62 3.02 -0.55 -4.64 115.26 112.61 1hgi n ASN 129 Ca 0.01 -1.72 -0.08 0.00 -0.03 0.00 0.00 54.58 52.76 1hgi n ASN 129 Cb 0.00 0.12 -0.08 0.00 -0.61 0.00 0.00 39.78 39.21 1hgi n ASN 129 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1hgi s ALA 130 N -2.15 0.11 0.08 5.41 0.00 -1.25 -0.73 121.76 123.22 1hgi s ALA 130 Ca 0.27 -0.88 0.07 0.00 0.00 0.00 0.00 51.96 51.42 1hgi s ALA 130 Cb 0.20 0.40 -0.03 0.00 0.00 0.00 0.00 23.12 23.69 1hgi s ALA 130 CO 0.39 -0.45 -0.19 -1.21 0.00 0.00 0.00 175.76 174.30 1hgi s GLU 131 N -3.89 1.08 -0.19 0.00 2.02 -0.28 -4.93 118.70 112.51 1hgi s GLU 131 Ca 0.06 -1.03 -0.28 0.00 0.02 0.00 0.00 54.97 53.74 1hgi s GLU 131 Cb 0.06 -1.23 -0.00 0.00 0.10 0.00 0.00 34.13 33.06 1hgi s GLU 131 CO -0.10 0.29 0.97 -2.00 0.02 0.00 0.00 175.26 174.43 1hgi s GLU 132 N -1.65 4.30 0.00 1.61 2.12 -1.26 -0.37 118.70 123.44 1hgi s GLU 132 Ca 0.04 1.25 0.30 0.00 0.36 0.00 0.00 54.97 56.92 1hgi s GLU 132 Cb -0.10 -3.60 1.54 0.00 0.26 0.00 0.00 34.13 32.23 1hgi s GLU 132 CO 0.03 -0.48 2.05 -1.33 -0.54 0.00 0.00 175.26 175.00 1hgi n MET 133 N 5.73 0.55 -0.71 4.30 2.81 0.34 -4.91 117.12 125.24 1hgi n MET 133 Ca 0.09 -0.04 0.00 0.00 -1.81 0.00 0.00 57.70 55.94 1hgi n MET 133 Cb 0.47 -1.50 0.00 0.00 -0.71 0.00 0.00 33.22 31.48 1hgi n MET 133 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1hgi n GLY 134 N 1.24 0.79 0.37 3.03 0.00 -1.26 -4.85 105.19 104.51 1hgi n GLY 134 Ca 0.16 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.25 1hgi n GLY 134 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1hgi n ASN 135 N 0.00 1.90 0.00 1.61 6.94 -1.26 -4.88 115.26 119.57 1hgi n ASN 135 Ca 0.00 -3.30 0.00 0.00 -0.02 0.00 0.00 54.58 51.26 1hgi n ASN 135 Cb 0.00 -0.45 0.00 0.00 -2.36 0.00 0.00 39.78 36.97 1hgi n ASN 135 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1hgi n GLY 136 N -1.14 0.77 3.50 4.83 0.00 -1.25 -4.62 105.19 107.27 1hgi n GLY 136 Ca 0.16 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.84 1hgi n GLY 136 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1hgi s PHE 138 N -0.17 3.70 -0.47 0.00 0.08 -1.26 -0.50 117.98 119.36 1hgi s PHE 138 Ca 0.02 0.89 -0.19 0.00 0.12 0.00 0.00 56.93 57.77 1hgi s PHE 138 Cb -0.13 -2.21 0.04 0.00 -0.57 0.00 0.00 43.02 40.15 1hgi s PHE 138 CO 0.03 0.66 0.59 0.21 -0.10 0.00 0.00 175.22 176.61 1hgi s LYS 139 N -1.08 3.16 -0.18 0.44 2.47 0.50 -4.91 119.74 120.14 1hgi s LYS 139 Ca 0.22 -0.72 -0.26 0.00 -1.56 0.00 0.00 55.97 53.66 1hgi s LYS 139 Cb -0.16 -4.03 -0.01 0.00 -1.46 0.00 0.00 37.83 32.17 1hgi s LYS 139 CO 0.11 -1.08 0.85 0.42 0.16 0.00 0.00 175.35 175.81 1hgi s ILE 140 N 2.58 4.86 -0.47 5.43 1.01 -1.26 -1.13 121.20 132.21 1hgi s ILE 140 Ca 0.17 1.66 -0.02 0.00 0.00 0.00 0.00 60.65 62.46 1hgi s ILE 140 Cb -0.17 -4.15 0.28 0.00 0.01 0.00 0.00 42.46 38.42 1hgi s ILE 140 CO 0.14 -0.01 2.11 -1.22 0.00 0.00 0.00 174.94 175.97 1hgi n TYR 141 N 5.44 2.15 -3.80 3.97 4.02 0.09 -4.88 117.16 124.15 1hgi n TYR 141 Ca 0.05 -2.32 -0.09 0.00 -0.01 0.00 0.00 57.90 55.53 1hgi n TYR 141 Cb 0.48 -1.17 -0.04 0.00 -0.02 0.00 0.00 39.34 38.59 1hgi n TYR 141 CO 0.00 0.00 0.00 -3.38 -1.01 0.00 0.00 176.86 172.47 1hgi s HIS 142 N -2.55 -0.00 -0.12 -0.72 -3.43 -1.26 -3.56 115.29 103.65 1hgi s HIS 142 Ca 0.46 -0.35 -0.29 0.00 -0.80 0.00 0.00 55.06 54.07 1hgi s HIS 142 Cb 0.35 0.32 -0.04 0.00 -1.43 0.00 0.00 32.58 31.79 1hgi s HIS 142 CO -0.05 -0.91 1.55 0.21 -2.00 0.00 0.00 174.74 173.53 1hgi s LYS 143 N -3.90 4.10 -0.28 -0.38 2.20 -1.26 -4.96 119.74 115.26 1hgi s LYS 143 Ca 0.12 1.93 0.00 0.00 -0.36 0.00 0.00 55.97 57.66 1hgi s LYS 143 Cb -0.01 -3.94 0.08 0.00 -1.51 0.00 0.00 37.83 32.46 1hgi s LYS 143 CO -0.01 -0.92 0.04 0.00 -0.36 0.00 0.00 175.35 174.10 1hgi n ASP 145 N 4.71 0.14 0.06 0.00 5.68 -1.26 -2.98 116.55 122.89 1hgi n ASP 145 Ca -0.05 -1.32 0.04 0.00 -0.50 0.00 0.00 54.79 52.96 1hgi n ASP 145 Cb 0.43 -0.58 0.45 0.00 -1.14 0.00 0.00 41.12 40.28 1hgi n ASP 145 CO 0.00 0.00 0.00 0.78 -1.33 0.00 0.00 177.20 176.65 1hgi h ASN 146 N -0.96 0.37 0.09 -1.12 2.35 -1.96 -0.67 115.58 113.68 1hgi h ASN 146 Ca -0.25 -0.02 -0.19 0.00 -0.55 0.00 0.00 56.30 55.30 1hgi h ASN 146 Cb 0.70 -0.09 -0.00 0.00 0.05 0.00 0.00 38.32 38.97 1hgi h ASN 146 CO 0.18 0.31 -0.69 0.00 -1.65 0.00 0.00 177.43 175.58 1hgi h ALA 147 N 1.76 0.56 0.16 -0.83 0.00 -1.98 0.65 119.26 119.57 1hgi h ALA 147 Ca 0.11 -0.58 -0.01 0.00 0.00 0.00 0.00 54.91 54.44 1hgi h ALA 147 Cb 0.02 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.76 1hgi h ALA 147 CO -0.02 0.72 -0.08 0.00 0.00 0.00 0.00 179.25 179.88 1hgi h ILE 149 N -0.23 1.03 -0.78 0.00 1.08 -0.94 -1.15 117.51 116.51 1hgi h ILE 149 Ca -0.02 -0.33 -0.01 0.00 -0.39 0.00 0.00 64.86 64.11 1hgi h ILE 149 Cb 0.17 -0.02 -0.04 0.00 -3.07 0.00 0.00 36.82 33.87 1hgi h ILE 149 CO 0.04 0.18 0.46 -0.08 -0.69 0.00 0.00 178.15 178.05 1hgi h GLU 150 N 0.97 1.07 -0.12 2.37 4.22 -0.45 -2.08 114.58 120.57 1hgi h GLU 150 Ca 0.38 -0.11 -0.09 0.00 0.08 0.00 0.00 59.36 59.63 1hgi h GLU 150 Cb 0.19 -0.22 -0.01 0.00 0.50 0.00 0.00 28.75 29.21 1hgi h GLU 150 CO -0.18 0.77 -0.32 0.66 -2.18 0.00 0.00 179.01 177.76 1hgi h SER 151 N 1.08 0.23 -0.34 1.04 4.64 0.14 0.12 113.55 120.44 1hgi h SER 151 Ca 0.28 -0.08 -0.05 0.00 -0.47 0.00 0.00 61.79 61.48 1hgi h SER 151 Cb -0.02 -0.06 -0.01 0.00 -0.31 0.00 0.00 62.40 62.00 1hgi h SER 151 CO -0.05 0.54 0.03 0.40 -0.87 0.00 0.00 176.83 176.88 1hgi h ILE 152 N 0.20 1.25 -0.10 0.95 2.04 -0.90 0.16 117.51 121.11 1hgi h ILE 152 Ca 0.03 -0.89 -0.02 0.00 1.00 0.00 0.00 64.86 64.98 1hgi h ILE 152 Cb 0.67 1.16 -0.00 0.00 -0.74 0.00 0.00 36.82 37.90 1hgi h ILE 152 CO 0.05 0.30 -0.00 0.03 0.00 0.00 0.00 178.15 178.52 1hgi h ARG 153 N 0.41 0.17 -0.04 2.37 3.08 -0.99 -2.70 114.38 116.67 1hgi h ARG 153 Ca 0.10 -0.06 0.00 0.00 0.07 0.00 0.00 59.98 60.09 1hgi h ARG 153 Cb 0.40 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.43 1hgi h ARG 153 CO 0.01 0.44 0.00 0.27 -1.07 0.00 0.00 179.97 179.62 1hgi n ASN 154 N -4.81 0.31 -0.35 7.04 0.23 0.37 -4.89 115.26 113.15 1hgi n ASN 154 Ca -0.06 -1.68 -0.04 0.00 -0.53 0.00 0.00 54.58 52.27 1hgi n ASN 154 Cb 0.21 -0.03 -0.01 0.00 -2.08 0.00 0.00 39.78 37.87 1hgi n ASN 154 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1hgi n GLY 155 N 0.75 0.51 0.57 4.83 0.00 -0.26 -4.92 105.19 106.67 1hgi n GLY 155 Ca 0.09 -0.83 0.05 0.00 0.00 0.00 0.00 46.02 45.33 1hgi n GLY 155 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1hgi n THR 156 N -3.30 0.88 -1.69 2.61 -2.24 0.40 -5.01 114.28 105.93 1hgi n THR 156 Ca -0.04 -0.94 -0.43 0.00 -2.27 0.00 0.00 64.05 60.37 1hgi n THR 156 Cb 0.28 0.59 -0.03 0.00 -2.10 0.00 0.00 70.33 69.06 1hgi n THR 156 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1hgi n TYR 157 N 0.46 2.59 -3.50 4.78 9.36 -0.88 -4.95 117.16 125.03 1hgi n TYR 157 Ca 0.10 -0.02 -0.42 0.00 3.32 0.00 0.00 57.90 60.88 1hgi n TYR 157 Cb 0.40 -2.68 -0.10 0.00 -0.63 0.00 0.00 39.34 36.33 1hgi n TYR 157 CO 0.00 0.00 0.00 0.34 0.22 0.00 0.00 176.86 177.42 1hgi s ASP 158 N 2.08 5.97 0.39 2.98 2.15 -1.26 -4.95 116.67 124.03 1hgi s ASP 158 Ca 0.80 -1.08 0.10 0.00 0.43 0.00 0.00 52.55 52.80 1hgi s ASP 158 Cb -0.53 -2.11 0.81 0.00 -0.30 0.00 0.00 42.92 40.78 1hgi s ASP 158 CO 0.37 -0.48 1.92 1.12 -0.17 0.00 0.00 175.17 177.93 1hgi h HIS 159 N 8.58 0.22 -0.88 -5.34 2.07 -1.92 -2.80 115.15 115.08 1hgi h HIS 159 Ca -0.26 -0.02 0.02 0.00 -2.85 0.00 0.00 60.37 57.25 1hgi h HIS 159 Cb 1.11 -0.06 -0.05 0.00 2.57 0.00 0.00 27.41 30.98 1hgi h HIS 159 CO 0.58 0.35 0.58 -0.44 -3.07 0.00 0.00 177.93 175.93 1hgi h ASP 160 N 0.21 0.98 -1.09 3.10 3.32 -1.96 -0.01 116.42 120.96 1hgi h ASP 160 Ca 0.04 -0.02 0.30 0.00 0.02 0.00 0.00 57.03 57.37 1hgi h ASP 160 Cb 0.36 -0.23 -0.09 0.00 0.22 0.00 0.00 39.33 39.59 1hgi h ASP 160 CO 0.02 0.69 0.72 0.58 -1.72 0.00 0.00 179.24 179.53 1hgi h VAL 161 N 1.15 0.46 -0.01 -1.35 2.07 -1.93 -1.93 116.25 114.71 1hgi h VAL 161 Ca 0.34 -0.10 0.00 0.00 0.82 0.00 0.00 66.70 67.76 1hgi h VAL 161 Cb -0.06 0.13 0.00 0.00 -1.52 0.00 0.00 31.29 29.84 1hgi h VAL 161 CO -0.10 0.05 -0.08 -1.22 0.02 0.00 0.00 177.57 176.25 1hgi n TYR 162 N -4.57 0.00 -0.23 1.57 4.02 -0.18 -4.81 117.16 112.97 1hgi n TYR 162 Ca 0.27 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 58.16 1hgi n TYR 162 Cb 1.00 0.00 0.12 0.00 -0.02 0.00 0.00 39.34 40.44 1hgi n TYR 162 CO 0.00 0.00 0.00 -0.09 -1.01 0.00 0.00 176.86 175.76 1hgi h ARG 163 N 1.30 0.54 -0.25 -0.72 2.43 -0.29 0.37 114.38 117.75 1hgi h ARG 163 Ca 0.00 -0.03 -0.12 0.00 -0.81 0.00 0.00 59.98 59.02 1hgi h ARG 163 Cb 0.32 -0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 29.73 1hgi h ARG 163 CO 0.00 0.35 -0.34 -0.44 -1.51 0.00 0.00 179.97 178.03 1hgi h ASP 164 N 0.55 0.57 0.18 -3.80 3.32 -1.87 0.19 116.42 115.57 1hgi h ASP 164 Ca 0.32 -0.23 -0.01 0.00 0.02 0.00 0.00 57.03 57.13 1hgi h ASP 164 Cb 0.33 -0.16 0.00 0.00 0.22 0.00 0.00 39.33 39.73 1hgi h ASP 164 CO -0.26 0.87 -0.09 -0.08 -1.72 0.00 0.00 179.24 177.96 1hgi h GLU 165 N 0.47 -0.24 0.32 3.56 4.81 -1.67 -1.87 114.58 119.97 1hgi h GLU 165 Ca 0.05 0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 59.29 1hgi h GLU 165 Cb 0.82 0.05 -0.01 0.00 0.63 0.00 0.00 28.75 30.24 1hgi h GLU 165 CO 0.07 -0.07 -0.22 0.00 -0.73 0.00 0.00 179.01 178.06 1hgi h ALA 166 N 0.45 -0.52 -0.65 2.92 0.00 -0.66 -2.20 119.26 118.59 1hgi h ALA 166 Ca -0.03 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 54.78 1hgi h ALA 166 Cb 0.27 0.29 -0.03 0.00 0.00 0.00 0.00 17.79 18.32 1hgi h ALA 166 CO 0.04 -0.81 0.37 -0.07 0.00 0.00 0.00 179.25 178.78 1hgi h LEU 167 N -0.54 0.79 0.06 0.00 3.38 -0.59 0.15 115.31 118.57 1hgi h LEU 167 Ca -0.03 -0.05 -0.00 0.00 0.09 0.00 0.00 57.88 57.88 1hgi h LEU 167 Cb 0.46 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 41.01 1hgi h LEU 167 CO 0.01 0.63 -0.03 -1.13 0.09 0.00 0.00 178.44 178.02 1hgi h ASN 168 N 0.91 -0.07 -0.77 -0.43 -0.73 -1.19 -0.32 115.58 112.98 1hgi h ASN 168 Ca 0.23 -0.05 0.03 0.00 1.87 0.00 0.00 56.30 58.38 1hgi h ASN 168 Cb 0.00 0.02 -0.05 0.00 0.27 0.00 0.00 38.32 38.57 1hgi h ASN 168 CO -0.04 0.00 0.49 0.78 -0.37 0.00 0.00 177.43 178.29 1hgi h ASN 169 N -0.14 0.82 0.14 1.15 2.35 -0.75 -2.93 115.58 116.22 1hgi h ASN 169 Ca -0.01 -0.01 -0.26 0.00 -0.55 0.00 0.00 56.30 55.48 1hgi h ASN 169 Cb 0.12 -0.18 0.03 0.00 0.05 0.00 0.00 38.32 38.33 1hgi h ASN 169 CO 0.01 0.57 -1.09 -0.09 -1.65 0.00 0.00 177.43 175.18 1hgi h ARG 170 N 0.97 0.49 0.00 0.81 2.43 -0.47 -3.42 114.38 115.19 1hgi h ARG 170 Ca 0.30 -0.72 0.00 0.00 -0.81 0.00 0.00 59.98 58.75 1hgi h ARG 170 Cb -0.01 0.25 0.00 0.00 -0.42 0.00 0.00 29.97 29.79 1hgi h ARG 170 CO -0.10 1.32 0.00 1.19 -1.51 0.00 0.00 179.97 180.87 1hgi n PHE 171 N -3.93 0.00 -0.00 2.20 3.72 -0.15 -4.87 117.46 114.43 1hgi n PHE 171 Ca -0.14 0.00 -0.00 0.00 -0.05 0.00 0.00 57.45 57.26 1hgi n PHE 171 Cb 0.93 0.00 -0.00 0.00 -0.94 0.00 0.00 39.48 39.47 1hgi n PHE 171 CO 0.00 0.00 0.00 1.04 -0.05 0.00 0.00 176.76 177.75 1hgi n GLN 172 N -1.57 -0.00 0.00 -1.08 6.02 -1.11 -4.45 117.38 115.19 1hgi n GLN 172 Ca 0.00 0.06 0.00 0.00 -0.01 0.00 0.00 57.00 57.05 1hgi n GLN 172 Cb 0.00 -0.09 0.00 0.00 1.02 0.00 0.00 30.24 31.17 1hgi n GLN 172 CO 0.00 0.00 0.00 -0.89 -1.01 0.00 0.00 177.06 175.16 1hgi n ILE 173 N -2.18 0.00 -1.61 5.09 2.08 -1.25 -2.99 119.36 118.50 1hgi n ILE 173 Ca 0.00 0.00 -0.00 0.00 0.56 0.00 0.00 62.75 63.31 1hgi n ILE 173 Cb 0.00 0.00 -0.00 0.00 -0.75 0.00 0.00 39.64 38.89 1hgi n ILE 173 CO 0.00 0.00 0.00 2.29 0.56 0.00 0.00 176.55 179.40 1hgi n LYS 174 N 0.00 0.00 0.00 0.38 2.85 -1.26 -5.19 118.16 114.94 1hgi n LYS 174 Ca 0.00 -0.04 0.00 0.00 -1.05 0.00 0.00 58.31 57.22 1hgi n LYS 174 Cb 0.00 0.04 0.00 0.00 -0.65 0.00 0.00 35.03 34.42 1hgi n LYS 174 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76