#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 -2.53 115.31 115.24 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 0.16 -1.48 0.49 0.09 0.00 0.00 178.44 177.71 1hgi n PHE 3 N -4.01 0.07 -2.52 1.13 3.01 -1.26 -4.99 117.46 108.90 1hgi n PHE 3 Ca -0.02 0.02 -0.12 0.00 1.01 0.00 0.00 57.45 58.34 1hgi n PHE 3 Cb 0.25 -0.33 0.01 0.00 -0.01 0.00 0.00 39.48 39.40 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 1.36 0.01 0.06 1.37 0.00 -0.95 -4.95 105.19 102.07 1hgi n GLY 4 Ca -0.00 -0.34 -0.06 0.00 0.00 0.00 0.00 46.02 45.62 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 -2.34 0.54 -1.96 4.61 0.00 -1.26 -0.74 120.51 119.36 1hgi n ALA 5 Ca -0.08 -0.60 -0.42 0.00 0.00 0.00 0.00 53.44 52.34 1hgi n ALA 5 Cb 0.58 0.02 -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 -2.19 2.89 -1.44 0.00 1.01 -1.26 -1.28 121.20 118.92 1hgi s ILE 6 Ca -0.18 0.70 -0.11 0.00 0.00 0.00 0.00 60.65 61.06 1hgi s ILE 6 Cb 0.02 -3.45 0.08 0.00 0.01 0.00 0.00 42.46 39.12 1hgi s ILE 6 CO 0.27 0.09 0.70 0.00 0.00 0.00 0.00 174.94 176.00 1hgi n ALA 7 N 2.92 -1.14 -2.06 9.38 0.00 -1.20 -3.87 120.51 124.54 1hgi n ALA 7 Ca 0.08 0.14 0.00 0.00 0.00 0.00 0.00 53.44 53.66 1hgi n ALA 7 Cb 0.41 -3.57 0.00 0.00 0.00 0.00 0.00 19.45 16.29 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 -1.41 3.93 0.14 0.00 0.00 -0.41 -4.83 105.19 102.61 1hgi n GLY 8 Ca 0.00 -0.39 0.12 0.00 0.00 0.00 0.00 46.02 45.75 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 0.80 -3.45 1.61 1.16 0.08 -3.88 117.46 113.78 1hgi n PHE 9 Ca 0.00 0.33 -0.43 0.00 -1.87 0.00 0.00 57.45 55.49 1hgi n PHE 9 Cb 0.00 -1.03 -0.10 0.00 -1.61 0.00 0.00 39.48 36.74 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 -3.36 5.24 0.18 1.97 1.01 -0.62 -3.95 121.20 121.67 1hgi s ILE 10 Ca 0.03 -0.53 -0.16 0.00 0.00 0.00 0.00 60.65 59.98 1hgi s ILE 10 Cb 0.09 -3.91 0.12 0.00 0.01 0.00 0.00 42.46 38.77 1hgi s ILE 10 CO 0.36 -0.27 1.66 -0.08 0.00 0.00 0.00 174.94 176.60 1hgi h GLU 11 N 8.62 -0.01 -2.88 2.79 4.57 -1.84 -3.18 114.58 122.65 1hgi h GLU 11 Ca -0.28 0.00 0.05 0.00 -1.18 0.00 0.00 59.36 57.95 1hgi h GLU 11 Cb 1.13 0.00 -0.09 0.00 -0.16 0.00 0.00 28.75 29.63 1hgi h GLU 11 CO 0.72 -0.00 0.27 0.54 -1.18 0.00 0.00 179.01 179.36 1hgi s ASN 12 N -5.22 -0.39 0.93 1.04 4.22 -1.26 -4.67 114.94 109.59 1hgi s ASN 12 Ca -0.14 -0.28 -0.13 0.00 -2.14 0.00 0.00 52.86 50.17 1hgi s ASN 12 Cb 0.15 0.62 0.15 0.00 1.28 0.00 0.00 41.25 43.46 1hgi s ASN 12 CO 0.71 -1.08 1.16 -0.83 -2.04 0.00 0.00 177.10 175.02 1hgi s GLY 13 N -2.81 1.60 -0.33 0.45 0.00 -1.26 -5.00 107.32 99.96 1hgi s GLY 13 Ca 0.06 -0.63 -0.05 0.00 0.00 0.00 0.00 44.72 44.10 1hgi s GLY 13 CO -0.03 -0.04 0.08 -0.98 0.00 0.00 0.00 173.10 172.13 1hgi s TRP 14 N -3.35 3.26 0.32 1.90 0.51 -1.26 -4.93 118.94 115.39 1hgi s TRP 14 Ca 0.65 -1.52 0.32 0.00 -2.12 0.00 0.00 56.10 53.43 1hgi s TRP 14 Cb -0.13 -2.25 1.51 0.00 -0.81 0.00 0.00 33.47 31.79 1hgi s TRP 14 CO 0.53 -0.75 2.06 0.93 -0.51 0.00 0.00 176.95 179.21 1hgi h GLU 15 N 8.17 0.00 0.00 4.98 5.08 -2.04 -2.52 114.58 128.26 1hgi h GLU 15 Ca -0.23 0.00 -0.05 0.00 -1.00 0.00 0.00 59.36 58.09 1hgi h GLU 15 Cb 1.08 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.32 1hgi h GLU 15 CO 0.59 0.08 -0.22 0.78 -1.00 0.00 0.00 179.01 179.24 1hgi h GLY 16 N 1.24 0.00 -6.72 -3.84 0.00 -2.03 -3.42 103.07 88.30 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 -4.07 3.71 -0.00 4.80 -2.45 -0.95 -4.80 119.30 115.54 1hgi s MET 17 Ca -0.02 0.59 0.10 0.00 -1.25 0.00 0.00 55.69 55.11 1hgi s MET 17 Cb 0.13 -3.92 -0.13 0.00 1.25 0.00 0.00 34.83 32.16 1hgi s MET 17 CO 0.64 -1.40 0.36 0.44 1.05 0.00 0.00 175.02 176.10 1hgi n ILE 18 N 6.87 0.00 0.55 10.11 -5.35 -1.26 -4.57 119.36 125.71 1hgi n ILE 18 Ca 0.12 -0.25 0.10 0.00 -0.27 0.00 0.00 62.75 62.45 1hgi n ILE 18 Cb 0.49 0.76 0.27 0.00 -1.74 0.00 0.00 39.64 39.41 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 -1.44 2.75 0.00 7.28 5.75 -1.26 -4.98 116.55 124.65 1hgi n ASP 19 Ca 0.01 -1.92 0.00 0.00 -0.01 0.00 0.00 54.79 52.87 1hgi n ASP 19 Cb 0.19 -0.25 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 1.35 1.14 0.09 6.12 0.00 -1.26 -4.80 105.19 107.83 1hgi n GLY 20 Ca 0.18 -0.83 -0.12 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 0.26 -3.31 1.61 4.06 -1.90 -3.47 115.95 113.20 1hgi h TRP 21 Ca 0.00 -0.19 -0.46 0.00 2.06 0.00 0.00 58.89 60.30 1hgi h TRP 21 Cb 0.00 -0.01 -0.17 0.00 -1.00 0.00 0.00 29.16 27.98 1hgi h TRP 21 CO 0.00 1.16 -0.76 0.71 -3.56 0.00 0.00 178.44 175.99 1hgi s TYR 22 N -2.67 1.62 0.00 0.49 2.02 -1.26 -5.02 117.35 112.53 1hgi s TYR 22 Ca -0.02 -0.54 0.00 0.00 -0.37 0.00 0.00 57.07 56.14 1hgi s TYR 22 Cb 0.08 -0.81 0.00 0.00 -0.40 0.00 0.00 41.96 40.83 1hgi s TYR 22 CO 0.85 0.26 0.00 0.41 -1.57 0.00 0.00 175.55 175.50 1hgi n GLY 23 N 0.21 0.60 3.29 0.71 0.00 -1.26 0.20 105.19 108.93 1hgi n GLY 23 Ca -0.13 -0.82 -0.23 0.00 0.00 0.00 0.00 46.02 44.84 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 -2.83 1.76 -0.03 1.61 0.40 0.30 -4.88 117.98 114.31 1hgi s PHE 24 Ca 0.00 -0.43 -0.01 0.00 -0.60 0.00 0.00 56.93 55.89 1hgi s PHE 24 Cb 0.00 -0.95 0.03 0.00 0.51 0.00 0.00 43.02 42.61 1hgi s PHE 24 CO 0.00 0.22 0.03 1.03 0.70 0.00 0.00 175.22 177.20 1hgi s ARG 25 N -2.09 0.03 0.19 0.44 0.52 -1.26 -0.26 118.95 116.53 1hgi s ARG 25 Ca 0.08 0.23 0.03 0.00 -0.52 0.00 0.00 55.73 55.54 1hgi s ARG 25 Cb -0.09 -0.40 -0.05 0.00 0.52 0.00 0.00 34.95 34.93 1hgi s ARG 25 CO 0.05 -0.22 -0.02 -3.38 0.02 0.00 0.00 175.30 171.75 1hgi s HIS 26 N 1.44 1.34 -0.14 -0.53 -3.43 0.11 -4.97 115.29 109.10 1hgi s HIS 26 Ca -0.04 -0.94 -0.04 0.00 -0.80 0.00 0.00 55.06 53.24 1hgi s HIS 26 Cb -0.13 -0.76 0.07 0.00 -1.43 0.00 0.00 32.58 30.33 1hgi s HIS 26 CO -0.03 -0.10 0.18 -1.14 -2.00 0.00 0.00 174.74 171.65 1hgi s GLN 27 N -3.87 0.10 0.36 -0.38 0.74 -1.26 -2.07 119.66 113.29 1hgi s GLN 27 Ca 0.24 0.36 0.04 0.00 0.05 0.00 0.00 55.36 56.05 1hgi s GLN 27 Cb 0.05 -0.81 -0.05 0.00 1.10 0.00 0.00 33.01 33.30 1hgi s GLN 27 CO 0.05 -0.48 0.07 0.54 -0.55 0.00 0.00 175.29 174.92 1hgi s ASN 28 N 2.29 2.62 0.00 6.67 2.20 -0.00 -5.01 114.94 123.71 1hgi s ASN 28 Ca 0.04 -1.47 0.00 0.00 -0.94 0.00 0.00 52.86 50.49 1hgi s ASN 28 Cb -0.14 0.10 0.00 0.00 -2.00 0.00 0.00 41.25 39.21 1hgi s ASN 28 CO -0.09 -0.71 0.60 -1.54 -2.94 0.00 0.00 177.10 172.43 1hgi n SER 29 N -0.89 0.00 -0.03 3.54 3.41 -1.26 -1.51 113.62 116.88 1hgi n SER 29 Ca -0.04 0.14 0.00 0.00 -0.26 0.00 0.00 58.87 58.71 1hgi n SER 29 Cb 0.66 -0.14 -0.08 0.00 -0.26 0.00 0.00 64.21 64.39 1hgi n SER 29 CO 0.00 0.00 0.00 1.21 -0.16 0.00 0.00 175.04 176.09 1hgi n GLU 30 N -1.10 1.29 -1.67 4.33 2.13 -1.26 -5.11 120.64 119.25 1hgi n GLU 30 Ca 0.00 -0.05 0.00 0.00 0.66 0.00 0.00 57.16 57.77 1hgi n GLU 30 Cb 0.02 -1.26 0.00 0.00 0.27 0.00 0.00 31.44 30.47 1hgi n GLU 30 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1hgi n GLY 31 N 2.11 -0.55 3.10 8.31 0.00 -0.57 -5.10 105.19 112.49 1hgi n GLY 31 Ca -0.09 -0.78 -0.12 0.00 0.00 0.00 0.00 46.02 45.03 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 -3.55 0.58 0.21 2.61 -4.23 -1.26 -0.82 115.64 109.19 1hgi s THR 32 Ca 0.00 -1.36 -0.23 0.00 -1.18 0.00 0.00 61.69 58.92 1hgi s THR 32 Cb 0.00 -0.96 0.05 0.00 1.34 0.00 0.00 72.50 72.93 1hgi s THR 32 CO 0.00 -0.55 0.87 -0.83 -0.54 0.00 0.00 174.62 173.57 1hgi s GLY 33 N -2.07 -0.12 0.09 3.99 0.00 -0.88 -4.97 107.32 103.36 1hgi s GLY 33 Ca -0.03 -0.11 0.02 0.00 0.00 0.00 0.00 44.72 44.60 1hgi s GLY 33 CO -0.01 0.08 -0.08 1.62 0.00 0.00 0.00 173.10 174.71 1hgi s GLN 34 N -3.39 0.79 -0.29 2.90 0.74 -1.26 -0.71 119.66 118.44 1hgi s GLN 34 Ca 0.13 -1.20 -0.16 0.00 0.05 0.00 0.00 55.36 54.17 1hgi s GLN 34 Cb -0.03 -0.31 0.12 0.00 1.10 0.00 0.00 33.01 33.89 1hgi s GLN 34 CO 0.05 0.02 0.87 0.00 -0.55 0.00 0.00 175.29 175.68 1hgi s ALA 35 N -2.96 -2.13 0.65 1.58 0.00 0.64 -4.96 121.76 114.57 1hgi s ALA 35 Ca 0.07 2.28 -0.14 0.00 0.00 0.00 0.00 51.96 54.17 1hgi s ALA 35 Cb 0.01 -1.61 -0.01 0.00 0.00 0.00 0.00 23.12 21.51 1hgi s ALA 35 CO -0.03 -0.36 1.08 0.00 0.00 0.00 0.00 175.76 176.45 1hgi s ALA 36 N 1.43 2.60 -0.27 0.00 0.00 -1.26 -0.54 121.76 123.73 1hgi s ALA 36 Ca -0.09 0.37 -0.08 0.00 0.00 0.00 0.00 51.96 52.16 1hgi s ALA 36 Cb -0.04 -3.25 -0.02 0.00 0.00 0.00 0.00 23.12 19.80 1hgi s ALA 36 CO -0.17 -1.11 0.10 0.34 0.00 0.00 0.00 175.76 174.92 1hgi s ASP 37 N -2.95 5.29 0.28 0.00 2.15 0.13 -4.80 116.67 116.78 1hgi s ASP 37 Ca 0.63 -0.29 0.21 0.00 0.43 0.00 0.00 52.55 53.53 1hgi s ASP 37 Cb -0.17 -1.95 0.12 0.00 -0.30 0.00 0.00 42.92 40.61 1hgi s ASP 37 CO 0.43 -0.08 1.27 -0.07 -0.17 0.00 0.00 175.17 176.55 1hgi h LEU 38 N 8.27 0.00 -0.01 -1.34 3.38 -1.94 -2.93 115.31 120.75 1hgi h LEU 38 Ca -0.36 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.60 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 0.59 0.10 -0.01 0.11 0.09 0.00 0.00 178.44 179.32 1hgi h LYS 39 N 0.00 0.02 -0.39 1.13 1.57 -1.97 -1.41 116.57 115.51 1hgi h LYS 39 Ca -0.02 -0.01 -0.15 0.00 -1.87 0.00 0.00 60.65 58.61 1hgi h LYS 39 Cb 1.09 -0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.39 1hgi h LYS 39 CO 0.01 0.47 -0.34 0.66 -0.57 0.00 0.00 179.45 179.68 1hgi h SER 40 N -0.43 0.94 -0.83 0.86 4.64 -1.96 -1.05 113.55 115.71 1hgi h SER 40 Ca 0.00 -0.41 0.13 0.00 -0.47 0.00 0.00 61.79 61.04 1hgi h SER 40 Cb 0.46 -0.26 -0.09 0.00 -0.31 0.00 0.00 62.40 62.20 1hgi h SER 40 CO 0.00 1.18 0.44 0.74 -0.87 0.00 0.00 176.83 178.33 1hgi h THR 41 N 0.74 0.80 -0.24 2.95 2.02 -1.50 -0.76 112.91 116.92 1hgi h THR 41 Ca 0.07 -0.23 -0.14 0.00 0.77 0.00 0.00 66.41 66.88 1hgi h THR 41 Cb 0.91 0.06 -0.00 0.00 -1.74 0.00 0.00 68.15 67.38 1hgi h THR 41 CO 0.08 0.12 -0.39 -0.61 0.37 0.00 0.00 175.52 175.10 1hgi h GLN 42 N 0.67 0.69 -0.21 6.66 5.75 -0.86 -0.90 115.11 126.91 1hgi h GLN 42 Ca 0.43 -0.42 0.05 0.00 -0.15 0.00 0.00 58.65 58.56 1hgi h GLN 42 Cb 0.53 0.04 -0.05 0.00 1.07 0.00 0.00 27.48 29.08 1hgi h GLN 42 CO -0.32 1.04 -0.11 0.00 -2.65 0.00 0.00 178.83 176.79 1hgi h ALA 43 N 0.64 0.07 -0.29 3.38 0.00 -0.60 0.40 119.26 122.86 1hgi h ALA 43 Ca 0.02 0.08 0.01 0.00 0.00 0.00 0.00 54.91 55.02 1hgi h ALA 43 Cb 0.98 0.26 -0.02 0.00 0.00 0.00 0.00 17.79 19.01 1hgi h ALA 43 CO 0.09 -0.53 0.18 0.00 0.00 0.00 0.00 179.25 178.99 1hgi h ALA 44 N 1.09 0.36 -0.58 0.00 0.00 -1.10 -2.44 119.26 116.60 1hgi h ALA 44 Ca 0.12 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.99 1hgi h ALA 44 Cb 0.26 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 17.93 1hgi h ALA 44 CO -0.27 -0.19 0.26 0.82 0.00 0.00 0.00 179.25 179.87 1hgi h ILE 45 N 0.37 1.22 -0.60 0.00 2.04 0.00 -2.25 117.51 118.29 1hgi h ILE 45 Ca 0.11 -0.64 -0.07 0.00 1.00 0.00 0.00 64.86 65.27 1hgi h ILE 45 Cb -0.02 0.56 -0.02 0.00 -0.74 0.00 0.00 36.82 36.60 1hgi h ILE 45 CO -0.04 0.25 0.12 0.44 0.00 0.00 0.00 178.15 178.92 1hgi h ASP 46 N 0.79 0.94 -0.40 1.72 3.32 -0.15 0.01 116.42 122.64 1hgi h ASP 46 Ca 0.20 -0.25 -0.02 0.00 0.02 0.00 0.00 57.03 56.98 1hgi h ASP 46 Cb 0.15 -0.25 -0.02 0.00 0.22 0.00 0.00 39.33 39.44 1hgi h ASP 46 CO -0.02 0.94 0.18 1.56 -1.72 0.00 0.00 179.24 180.18 1hgi h GLN 47 N 0.89 0.59 -0.05 3.56 4.20 -1.33 -0.86 115.11 122.11 1hgi h GLN 47 Ca 0.19 -0.10 -0.08 0.00 0.06 0.00 0.00 58.65 58.72 1hgi h GLN 47 Cb 0.39 -0.10 -0.01 0.00 0.30 0.00 0.00 27.48 28.06 1hgi h GLN 47 CO 0.01 0.54 -0.32 0.82 -0.67 0.00 0.00 178.83 179.20 1hgi h ILE 48 N 0.51 1.25 -0.06 2.54 2.04 -0.92 -1.46 117.51 121.41 1hgi h ILE 48 Ca 0.14 -1.19 -0.22 0.00 1.00 0.00 0.00 64.86 64.59 1hgi h ILE 48 Cb 0.15 1.57 0.00 0.00 -0.74 0.00 0.00 36.82 37.81 1hgi h ILE 48 CO -0.01 0.35 -0.85 0.78 0.00 0.00 0.00 178.15 178.42 1hgi h ASN 49 N 0.09 0.66 -0.36 1.72 -0.26 -0.69 -1.04 115.58 115.70 1hgi h ASN 49 Ca 0.01 -0.47 0.01 0.00 -0.56 0.00 0.00 56.30 55.29 1hgi h ASN 49 Cb 0.61 -0.20 -0.02 0.00 -1.06 0.00 0.00 38.32 37.65 1hgi h ASN 49 CO 0.04 1.25 0.22 1.23 -1.06 0.00 0.00 177.43 179.12 1hgi h GLY 50 N 0.99 0.50 0.99 2.83 0.00 -0.69 0.14 103.07 107.84 1hgi h GLY 50 Ca -0.06 -0.16 0.00 0.00 0.00 0.00 0.00 47.33 47.10 1hgi h GLY 50 CO 0.16 0.15 0.17 1.70 0.00 0.00 0.00 176.54 178.71 1hgi h LYS 51 N 0.44 0.35 -0.82 4.80 3.64 -1.23 -1.60 116.57 122.15 1hgi h LYS 51 Ca 0.14 -0.03 -0.01 0.00 -1.27 0.00 0.00 60.65 59.49 1hgi h LYS 51 Cb -0.01 -0.08 -0.04 0.00 -0.41 0.00 0.00 32.23 31.69 1hgi h LYS 51 CO -0.06 0.26 0.49 1.25 -2.27 0.00 0.00 179.45 179.12 1hgi h LEU 52 N 0.35 0.99 -0.39 5.20 5.85 -0.35 -2.53 115.31 124.42 1hgi h LEU 52 Ca 0.10 -0.06 -0.15 0.00 0.84 0.00 0.00 57.88 58.60 1hgi h LEU 52 Cb -0.01 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 40.76 1hgi h LEU 52 CO -0.02 0.77 -0.35 0.78 -0.34 0.00 0.00 178.44 179.27 1hgi h ASN 53 N 1.14 0.99 -0.17 1.25 2.35 -0.10 -2.59 115.58 118.46 1hgi h ASN 53 Ca 0.30 -0.45 -0.02 0.00 -0.55 0.00 0.00 56.30 55.57 1hgi h ASN 53 Cb -0.04 -0.28 -0.01 0.00 0.05 0.00 0.00 38.32 38.04 1hgi h ASN 53 CO -0.05 1.24 0.04 -0.09 -1.65 0.00 0.00 177.43 176.92 1hgi h ARG 54 N 0.76 0.35 0.00 0.81 9.65 -0.88 -1.35 114.38 123.71 1hgi h ARG 54 Ca 0.07 -0.05 -0.15 0.00 -1.10 0.00 0.00 59.98 58.75 1hgi h ARG 54 Cb 0.94 -0.06 -0.02 0.00 -1.39 0.00 0.00 29.97 29.44 1hgi h ARG 54 CO 0.09 0.34 -0.70 0.28 2.80 0.00 0.00 179.97 182.79 1hgi h VAL 55 N 0.35 1.33 -0.01 0.20 2.07 -1.28 -3.05 116.25 115.86 1hgi h VAL 55 Ca 0.08 -2.53 0.00 0.00 0.82 0.00 0.00 66.70 65.07 1hgi h VAL 55 Cb 0.17 2.43 0.00 0.00 -1.52 0.00 0.00 31.29 32.37 1hgi h VAL 55 CO -0.00 0.68 -0.15 -0.38 0.02 0.00 0.00 177.57 177.74 1hgi n ILE 56 N -3.46 0.00 -1.68 4.57 5.41 -0.58 -4.91 119.36 118.71 1hgi n ILE 56 Ca 0.00 -0.21 -0.47 0.00 1.00 0.00 0.00 62.75 63.07 1hgi n ILE 56 Cb 0.75 0.57 -0.04 0.00 -0.71 0.00 0.00 39.64 40.20 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 2.29 -0.55 0.38 2.13 -0.76 -4.57 120.64 119.40 1hgi n GLU 57 Ca 0.15 0.84 0.00 0.00 0.66 0.00 0.00 57.16 58.80 1hgi n GLU 57 Cb 0.38 -2.68 0.00 0.00 0.27 0.00 0.00 31.44 29.41 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 5.96 0.00 -2.58 5.31 3.00 -1.26 -4.95 118.16 123.64 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 0.31 -0.16 -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 4.53 0.31 3.15 -4.23 -1.26 -5.02 115.64 113.12 1hgi s THR 59 Ca 0.00 1.83 -0.21 0.00 -1.18 0.00 0.00 61.69 62.13 1hgi s THR 59 Cb 0.00 -4.18 -0.09 0.00 1.34 0.00 0.00 72.50 69.57 1hgi s THR 59 CO 0.00 -0.02 0.84 0.54 -0.54 0.00 0.00 174.62 175.44 1hgi s ASN 60 N 1.30 7.08 0.03 3.99 4.22 -1.26 -5.05 114.94 125.26 1hgi s ASN 60 Ca 0.51 1.58 -0.00 0.00 -2.14 0.00 0.00 52.86 52.81 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 0.15 -1.83 -2.04 0.00 0.00 177.10 173.45 1hgi s GLU 61 N -2.39 3.25 0.01 3.55 -1.05 -1.26 -5.10 118.70 115.71 1hgi s GLU 61 Ca 0.51 -0.47 0.01 0.00 -0.15 0.00 0.00 54.97 54.86 1hgi s GLU 61 Cb -0.15 -2.95 -0.01 0.00 -0.44 0.00 0.00 34.13 30.58 1hgi s GLU 61 CO 0.20 0.62 -0.03 0.15 0.95 0.00 0.00 175.26 177.15 1hgi s LYS 62 N -2.19 0.24 0.00 -4.83 -0.14 -1.26 -5.13 119.74 106.43 1hgi s LYS 62 Ca 0.29 -0.25 0.00 0.00 -1.36 0.00 0.00 55.97 54.65 1hgi s LYS 62 Cb -0.13 -0.13 0.00 0.00 -1.68 0.00 0.00 37.83 35.89 1hgi s LYS 62 CO 0.22 0.03 0.00 1.19 -0.76 0.00 0.00 175.35 176.03 1hgi n PHE 63 N 2.59 0.00 -2.03 3.18 3.72 -1.26 -5.02 117.46 118.64 1hgi n PHE 63 Ca -0.16 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 2.08 3.12 0.00 1.38 2.46 -1.26 -4.98 115.29 118.09 1hgi s HIS 64 Ca 0.00 0.82 0.00 0.00 0.47 0.00 0.00 55.06 56.35 1hgi s HIS 64 Cb 0.00 -3.82 0.00 0.00 -0.13 0.00 0.00 32.58 28.63 1hgi s HIS 64 CO 0.00 -2.91 0.00 1.04 -2.47 0.00 0.00 174.74 170.40 1hgi n GLN 65 N 3.67 1.17 -4.08 2.88 6.02 -1.26 -5.16 117.38 120.62 1hgi n GLN 65 Ca 0.12 0.00 -0.23 0.00 -0.01 0.00 0.00 57.00 56.88 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 2.50 4.64 0.47 5.09 -4.36 -1.26 -5.09 121.20 123.20 1hgi s ILE 66 Ca 0.00 -1.25 -0.23 0.00 -0.26 0.00 0.00 60.65 58.91 1hgi s ILE 66 Cb 0.00 -3.49 -0.07 0.00 1.25 0.00 0.00 42.46 40.15 1hgi s ILE 66 CO 0.00 -0.30 1.22 -1.61 0.24 0.00 0.00 174.94 174.49 1hgi s GLU 67 N -3.73 3.67 0.00 0.37 0.41 -1.26 -4.96 118.70 113.19 1hgi s GLU 67 Ca 0.33 1.92 0.00 0.00 -0.41 0.00 0.00 54.97 56.81 1hgi s GLU 67 Cb -0.09 -2.43 0.00 0.00 -1.78 0.00 0.00 34.13 29.83 1hgi s GLU 67 CO 0.26 -0.67 0.56 1.63 -0.49 0.00 0.00 175.26 176.55 1hgi n LYS 68 N -0.50 0.74 -3.72 1.61 5.02 -1.26 -4.88 118.16 115.18 1hgi n LYS 68 Ca 0.07 -0.72 -0.11 0.00 -2.02 0.00 0.00 58.31 55.53 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 -0.31 0.32 0.05 1.97 2.02 -1.26 -5.06 118.70 116.43 1hgi s GLU 69 Ca 0.00 0.65 0.04 0.00 0.02 0.00 0.00 54.97 55.68 1hgi s GLU 69 Cb 0.00 -0.03 -0.02 0.00 0.10 0.00 0.00 34.13 34.17 1hgi s GLU 69 CO 0.00 -0.15 -0.12 -0.06 0.02 0.00 0.00 175.26 174.96 1hgi s PHE 70 N 1.19 1.03 -0.62 1.61 0.40 -1.26 -5.07 117.98 115.26 1hgi s PHE 70 Ca -0.08 -0.42 0.10 0.00 -0.60 0.00 0.00 56.93 55.93 1hgi s PHE 70 Cb -0.08 -0.60 -0.09 0.00 0.51 0.00 0.00 43.02 42.76 1hgi s PHE 70 CO -0.09 0.01 0.50 -1.13 0.70 0.00 0.00 175.22 175.21 1hgi n SER 71 N 1.59 0.69 -4.61 1.36 3.41 -1.26 -5.01 113.62 109.79 1hgi n SER 71 Ca -0.20 -0.84 -0.25 0.00 -0.26 0.00 0.00 58.87 57.31 1hgi n SER 71 Cb 0.55 0.87 -0.09 0.00 -0.26 0.00 0.00 64.21 65.27 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 -1.85 2.02 -0.29 4.33 0.41 -1.26 -5.11 118.70 116.95 1hgi s GLU 72 Ca 0.05 -1.81 -0.12 0.00 -0.41 0.00 0.00 54.97 52.68 1hgi s GLU 72 Cb 0.08 -1.87 -0.04 0.00 -1.78 0.00 0.00 34.13 30.53 1hgi s GLU 72 CO 0.39 0.12 0.24 0.08 -0.49 0.00 0.00 175.26 175.60 1hgi s VAL 73 N -2.55 5.27 -0.03 2.63 1.01 -1.26 -4.95 120.40 120.52 1hgi s VAL 73 Ca 0.34 0.16 0.04 0.00 0.00 0.00 0.00 61.98 62.52 1hgi s VAL 73 Cb 0.01 -3.61 -0.05 0.00 0.00 0.00 0.00 36.38 32.72 1hgi s VAL 73 CO 0.19 0.16 0.04 -0.62 0.00 0.00 0.00 175.10 174.87 1hgi n GLU 74 N 5.14 2.20 0.00 2.72 1.02 -1.26 -5.12 120.64 125.33 1hgi n GLU 74 Ca -0.12 -0.02 0.00 0.00 -0.02 0.00 0.00 57.16 57.00 1hgi n GLU 74 Cb 0.51 -1.10 0.00 0.00 -0.02 0.00 0.00 31.44 30.83 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 2.58 1.08 0.31 0.62 0.00 -1.26 -4.74 105.19 103.77 1hgi n GLY 75 Ca -0.04 -1.63 0.01 0.00 0.00 0.00 0.00 46.02 44.36 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 -0.02 -0.20 1.61 2.43 -2.00 -1.39 114.38 114.81 1hgi h ARG 76 Ca 0.00 0.00 -0.15 0.00 -0.81 0.00 0.00 59.98 59.02 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 -0.01 -0.47 0.97 -1.51 0.00 0.00 179.97 178.94 1hgi h ILE 77 N -0.02 1.32 0.00 1.20 6.09 -2.01 -2.86 117.51 121.22 1hgi h ILE 77 Ca 0.37 -1.70 -0.06 0.00 -1.37 0.00 0.00 64.86 62.09 1hgi h ILE 77 Cb 0.58 1.86 -0.01 0.00 0.47 0.00 0.00 36.82 39.73 1hgi h ILE 77 CO -0.82 0.53 -0.31 -0.61 -3.07 0.00 0.00 178.15 173.88 1hgi h GLN 78 N 0.38 0.00 -0.52 2.19 4.15 -1.62 -1.30 115.11 118.39 1hgi h GLN 78 Ca -0.00 0.00 -0.09 0.00 0.77 0.00 0.00 58.65 59.33 1hgi h GLN 78 Cb 1.08 0.00 -0.02 0.00 0.21 0.00 0.00 27.48 28.75 1hgi h GLN 78 CO 0.10 0.31 -0.03 -0.44 -1.93 0.00 0.00 178.83 176.83 1hgi h ASP 79 N 0.00 0.89 -0.37 -0.69 3.32 -1.13 -1.84 116.42 116.59 1hgi h ASP 79 Ca -0.00 -0.25 -0.08 0.00 0.02 0.00 0.00 57.03 56.72 1hgi h ASP 79 Cb 0.73 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 40.03 1hgi h ASP 79 CO 0.04 0.97 -0.06 0.25 -1.72 0.00 0.00 179.24 178.71 1hgi h LEU 80 N 0.83 0.70 -0.35 1.55 5.85 -1.06 -0.32 115.31 122.52 1hgi h LEU 80 Ca 0.15 -0.35 0.06 0.00 0.84 0.00 0.00 57.88 58.58 1hgi h LEU 80 Cb 0.54 -0.19 -0.05 0.00 0.37 0.00 0.00 40.66 41.33 1hgi h LEU 80 CO 0.03 0.89 0.04 -0.33 -0.34 0.00 0.00 178.44 178.73 1hgi h GLU 81 N 0.51 0.15 -0.69 1.25 5.08 -1.17 0.21 114.58 119.92 1hgi h GLU 81 Ca 0.10 -0.01 -0.07 0.00 -1.00 0.00 0.00 59.36 58.38 1hgi h GLU 81 Cb 0.57 -0.03 -0.03 0.00 0.50 0.00 0.00 28.75 29.76 1hgi h GLU 81 CO 0.03 0.10 0.14 0.87 -1.00 0.00 0.00 179.01 179.15 1hgi h LYS 82 N 0.15 1.11 -0.30 2.33 1.57 -1.20 -2.83 116.57 117.39 1hgi h LYS 82 Ca 0.17 -0.28 -0.13 0.00 -1.87 0.00 0.00 60.65 58.54 1hgi h LYS 82 Cb 0.21 -0.14 -0.01 0.00 0.08 0.00 0.00 32.23 32.36 1hgi h LYS 82 CO -0.24 1.00 -0.33 -0.92 -0.57 0.00 0.00 179.45 178.39 1hgi h TYR 83 N 1.04 0.77 -0.58 -1.35 3.20 -0.14 -0.44 116.97 119.46 1hgi h TYR 83 Ca 0.21 -0.20 -0.03 0.00 3.14 0.00 0.00 58.73 61.86 1hgi h TYR 83 Cb 0.40 -0.17 -0.03 0.00 1.54 0.00 0.00 36.73 38.47 1hgi h TYR 83 CO 0.03 0.90 0.26 0.28 -1.64 0.00 0.00 178.16 178.00 1hgi h VAL 84 N 0.56 1.22 -0.07 1.81 2.07 -0.49 -0.65 116.25 120.69 1hgi h VAL 84 Ca 0.06 -0.63 -0.25 0.00 0.82 0.00 0.00 66.70 66.71 1hgi h VAL 84 Cb 0.83 0.55 0.02 0.00 -1.52 0.00 0.00 31.29 31.17 1hgi h VAL 84 CO 0.07 0.25 -0.91 -0.08 0.02 0.00 0.00 177.57 176.92 1hgi h GLU 85 N 0.80 0.75 -0.20 1.57 4.57 -1.31 -1.63 114.58 119.13 1hgi h GLU 85 Ca 0.20 -0.71 -0.13 0.00 -1.18 0.00 0.00 59.36 57.54 1hgi h GLU 85 Cb 0.15 0.18 -0.01 0.00 -0.16 0.00 0.00 28.75 28.90 1hgi h GLU 85 CO -0.02 1.30 -0.42 0.22 -1.18 0.00 0.00 179.01 178.91 1hgi h ASP 86 N 0.46 0.49 1.18 1.04 3.58 -0.90 0.08 116.42 122.36 1hgi h ASP 86 Ca -0.09 -0.22 -0.05 0.00 0.42 0.00 0.00 57.03 57.09 1hgi h ASP 86 Cb 1.56 -0.14 -0.01 0.00 1.72 0.00 0.00 39.33 42.46 1hgi h ASP 86 CO 0.18 0.85 -0.25 0.71 -2.88 0.00 0.00 179.24 177.85 1hgi h THR 87 N 0.38 0.53 -0.23 2.25 1.35 -1.07 -1.55 112.91 114.57 1hgi h THR 87 Ca 0.03 -1.33 -0.07 0.00 -0.55 0.00 0.00 66.41 64.49 1hgi h THR 87 Cb 0.89 1.93 -0.01 0.00 -1.73 0.00 0.00 68.15 69.24 1hgi h THR 87 CO 0.08 0.25 -0.14 0.50 -0.25 0.00 0.00 175.52 175.96 1hgi h LYS 88 N 0.00 0.50 -0.27 4.72 3.64 -0.36 -2.44 116.57 122.36 1hgi h LYS 88 Ca -0.00 -0.23 -0.02 0.00 -1.27 0.00 0.00 60.65 59.12 1hgi h LYS 88 Cb 0.91 -0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 32.71 1hgi h LYS 88 CO 0.03 0.79 0.08 0.82 -2.27 0.00 0.00 179.45 178.89 1hgi h ILE 89 N 0.21 1.21 -0.30 2.00 2.04 -0.68 -1.03 117.51 120.95 1hgi h ILE 89 Ca 0.05 -0.67 -0.02 0.00 1.00 0.00 0.00 64.86 65.22 1hgi h ILE 89 Cb 0.65 1.13 -0.02 0.00 -0.74 0.00 0.00 36.82 37.85 1hgi h ILE 89 CO 0.04 0.22 0.10 0.44 0.00 0.00 0.00 178.15 178.95 1hgi h ASP 90 N 0.27 0.38 -0.18 1.72 3.32 -1.31 -0.02 116.42 120.61 1hgi h ASP 90 Ca 0.09 -0.04 -0.10 0.00 0.02 0.00 0.00 57.03 57.00 1hgi h ASP 90 Cb 0.26 -0.10 -0.00 0.00 0.22 0.00 0.00 39.33 39.71 1hgi h ASP 90 CO -0.00 0.37 -0.28 -0.07 -1.72 0.00 0.00 179.24 177.54 1hgi h LEU 91 N 0.43 0.55 -1.06 1.55 3.38 -1.00 -0.71 115.31 118.45 1hgi h LEU 91 Ca 0.11 -0.53 -0.08 0.00 0.09 0.00 0.00 57.88 57.46 1hgi h LEU 91 Cb 0.13 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.70 1hgi h LEU 91 CO -0.01 0.98 -0.23 -0.50 0.09 0.00 0.00 178.44 178.76 1hgi h TRP 92 N 0.15 0.43 -0.65 1.13 4.06 -0.81 -1.87 115.95 118.39 1hgi h TRP 92 Ca 0.02 -0.08 -0.07 0.00 2.06 0.00 0.00 58.89 60.81 1hgi h TRP 92 Cb 0.86 -0.11 -0.03 0.00 -1.00 0.00 0.00 29.16 28.89 1hgi h TRP 92 CO 0.09 0.60 0.12 0.77 -3.56 0.00 0.00 178.44 176.46 1hgi h SER 93 N 0.35 1.00 -0.01 -3.49 0.02 -0.84 -0.57 113.55 110.01 1hgi h SER 93 Ca 0.06 -0.22 0.01 0.00 -0.84 0.00 0.00 61.79 60.79 1hgi h SER 93 Cb 0.61 -0.26 -0.01 0.00 0.14 0.00 0.00 62.40 62.87 1hgi h SER 93 CO 0.04 0.98 -0.03 0.22 -1.14 0.00 0.00 176.83 176.90 1hgi h TYR 94 N 0.99 -0.08 -0.20 3.45 3.20 -0.75 -1.98 116.97 121.60 1hgi h TYR 94 Ca 0.20 0.00 0.04 0.00 3.14 0.00 0.00 58.73 62.11 1hgi h TYR 94 Cb 0.40 0.04 -0.03 0.00 1.54 0.00 0.00 36.73 38.67 1hgi h TYR 94 CO 0.03 -0.05 -0.02 -0.91 -1.64 0.00 0.00 178.16 175.57 1hgi h ASN 95 N -0.05 -0.12 -0.32 -2.11 2.35 -0.62 -0.39 115.58 114.33 1hgi h ASN 95 Ca 0.02 0.05 0.03 0.00 -0.55 0.00 0.00 56.30 55.85 1hgi h ASN 95 Cb 0.07 0.10 -0.03 0.00 0.05 0.00 0.00 38.32 38.51 1hgi h ASN 95 CO -0.04 -0.03 0.11 0.00 -1.65 0.00 0.00 177.43 175.82 1hgi h ALA 96 N 1.18 0.36 -0.57 -0.83 0.00 -0.92 0.39 119.26 118.87 1hgi h ALA 96 Ca 0.10 0.03 -0.03 0.00 0.00 0.00 0.00 54.91 55.01 1hgi h ALA 96 Cb 0.13 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.90 1hgi h ALA 96 CO -0.18 -0.28 0.25 1.49 0.00 0.00 0.00 179.25 180.53 1hgi h GLU 97 N 0.25 0.85 -0.04 0.00 4.57 -0.97 -1.59 114.58 117.64 1hgi h GLU 97 Ca 0.14 -0.14 -0.14 0.00 -1.18 0.00 0.00 59.36 58.04 1hgi h GLU 97 Cb 0.11 -0.14 -0.01 0.00 -0.16 0.00 0.00 28.75 28.54 1hgi h GLU 97 CO -0.14 0.71 -0.59 1.25 -1.18 0.00 0.00 179.01 179.06 1hgi h LEU 98 N 0.78 0.17 0.26 1.64 5.85 -0.76 -2.57 115.31 120.68 1hgi h LEU 98 Ca 0.19 -0.09 -0.01 0.00 0.84 0.00 0.00 57.88 58.81 1hgi h LEU 98 Cb 0.17 -0.05 0.00 0.00 0.37 0.00 0.00 40.66 41.15 1hgi h LEU 98 CO -0.02 0.72 -0.13 0.25 -0.34 0.00 0.00 178.44 178.93 1hgi h LEU 99 N 0.11 -0.30 -1.42 2.25 5.85 -0.35 -1.66 115.31 119.80 1hgi h LEU 99 Ca -0.01 -0.19 -0.06 0.00 0.84 0.00 0.00 57.88 58.46 1hgi h LEU 99 Cb 1.07 0.08 -0.01 0.00 0.37 0.00 0.00 40.66 42.17 1hgi h LEU 99 CO 0.09 0.05 -0.29 -0.37 -0.34 0.00 0.00 178.44 177.57 1hgi h VAL 100 N -0.68 1.10 0.26 1.05 -1.51 -1.34 -0.75 116.25 114.39 1hgi h VAL 100 Ca -0.04 -1.04 -0.01 0.00 -1.23 0.00 0.00 66.70 64.39 1hgi h VAL 100 Cb 0.47 1.57 0.00 0.00 -2.13 0.00 0.00 31.29 31.21 1hgi h VAL 100 CO 0.06 0.29 -0.13 0.00 -1.23 0.00 0.00 177.57 176.56 1hgi h ALA 101 N 1.71 -0.35 0.02 5.19 0.00 -1.28 0.26 119.26 124.80 1hgi h ALA 101 Ca -0.00 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.79 1hgi h ALA 101 Cb 0.55 0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.48 1hgi h ALA 101 CO 0.04 -0.64 -0.01 -0.07 0.00 0.00 0.00 179.25 178.57 1hgi h LEU 102 N -0.47 -0.03 -0.14 0.00 3.38 -1.02 -1.76 115.31 115.26 1hgi h LEU 102 Ca -0.04 0.00 0.05 0.00 0.09 0.00 0.00 57.88 57.99 1hgi h LEU 102 Cb 0.35 0.01 -0.06 0.00 0.09 0.00 0.00 40.66 41.05 1hgi h LEU 102 CO 0.06 -0.02 -0.32 -0.33 0.09 0.00 0.00 178.44 177.92 1hgi h GLU 103 N -0.03 -0.37 -0.76 1.13 4.39 -1.01 -0.71 114.58 117.21 1hgi h GLU 103 Ca 0.00 0.03 -0.02 0.00 0.34 0.00 0.00 59.36 59.70 1hgi h GLU 103 Cb 0.03 0.08 -0.04 0.00 -0.10 0.00 0.00 28.75 28.73 1hgi h GLU 103 CO -0.00 -0.25 0.38 -0.91 -1.16 0.00 0.00 179.01 177.07 1hgi h ASN 104 N -0.39 0.98 -0.72 1.42 2.35 -0.87 0.23 115.58 118.59 1hgi h ASN 104 Ca 0.10 -0.13 0.07 0.00 -0.55 0.00 0.00 56.30 55.79 1hgi h ASN 104 Cb 0.54 -0.25 -0.06 0.00 0.05 0.00 0.00 38.32 38.60 1hgi h ASN 104 CO -0.36 0.83 0.41 -0.61 -1.65 0.00 0.00 177.43 176.05 1hgi h GLN 105 N 1.06 0.71 -0.17 0.81 5.75 -0.78 -1.01 115.11 121.48 1hgi h GLN 105 Ca 0.26 -0.04 -0.18 0.00 -0.15 0.00 0.00 58.65 58.54 1hgi h GLN 105 Cb 0.10 -0.16 0.01 0.00 1.07 0.00 0.00 27.48 28.49 1hgi h GLN 105 CO -0.04 0.47 -0.60 1.25 -2.65 0.00 0.00 178.83 177.27 1hgi h HIS 106 N 0.73 0.92 -0.73 3.99 2.76 0.14 -2.79 115.15 120.18 1hgi h HIS 106 Ca 0.33 -0.38 0.01 0.00 -2.20 0.00 0.00 60.37 58.12 1hgi h HIS 106 Cb 0.22 -0.15 -0.04 0.00 1.55 0.00 0.00 27.41 29.00 1hgi h HIS 106 CO -0.07 1.19 0.48 1.15 -1.30 0.00 0.00 177.93 179.38 1hgi h THR 107 N 0.39 1.18 -0.42 6.26 2.02 0.32 0.10 112.91 122.78 1hgi h THR 107 Ca -0.03 -0.34 -0.09 0.00 0.77 0.00 0.00 66.41 66.73 1hgi h THR 107 Cb 1.22 0.11 -0.01 0.00 -1.74 0.00 0.00 68.15 67.73 1hgi h THR 107 CO 0.13 0.18 -0.08 0.40 0.37 0.00 0.00 175.52 176.52 1hgi h ILE 108 N 0.98 1.27 -0.12 3.11 2.04 -1.16 -2.42 117.51 121.21 1hgi h ILE 108 Ca 0.27 -1.16 -0.13 0.00 1.00 0.00 0.00 64.86 64.84 1hgi h ILE 108 Cb -0.11 1.17 -0.01 0.00 -0.74 0.00 0.00 36.82 37.13 1hgi h ILE 108 CO -0.06 0.39 -0.49 0.44 0.00 0.00 0.00 178.15 178.43 1hgi h ASP 109 N 0.61 0.33 0.32 1.72 3.32 -0.99 -1.70 116.42 120.02 1hgi h ASP 109 Ca 0.11 -0.16 -0.02 0.00 0.02 0.00 0.00 57.03 56.99 1hgi h ASP 109 Cb 0.60 -0.09 0.00 0.00 0.22 0.00 0.00 39.33 40.06 1hgi h ASP 109 CO 0.04 0.76 -0.15 0.25 -1.72 0.00 0.00 179.24 178.42 1hgi h LEU 110 N 0.24 -0.36 -1.10 1.55 6.46 -0.78 0.57 115.31 121.89 1hgi h LEU 110 Ca 0.01 -0.04 -0.07 0.00 -0.12 0.00 0.00 57.88 57.66 1hgi h LEU 110 Cb 0.95 0.09 -0.02 0.00 -0.73 0.00 0.00 40.66 40.96 1hgi h LEU 110 CO 0.08 -0.19 -0.11 0.71 -0.62 0.00 0.00 178.44 178.31 1hgi h THR 111 N -0.50 1.23 -0.45 1.05 1.35 -1.38 -0.68 112.91 113.52 1hgi h THR 111 Ca -0.04 -1.00 -0.00 0.00 -0.55 0.00 0.00 66.41 64.81 1hgi h THR 111 Cb 0.38 1.13 -0.02 0.00 -1.73 0.00 0.00 68.15 67.90 1hgi h THR 111 CO 0.07 0.33 0.26 -0.78 -0.25 0.00 0.00 175.52 175.15 1hgi h ASP 112 N 0.47 0.55 0.17 5.36 3.58 -1.06 -1.41 116.42 124.08 1hgi h ASP 112 Ca 0.09 -0.07 0.01 0.00 0.42 0.00 0.00 57.03 57.48 1hgi h ASP 112 Cb 0.48 -0.14 -0.03 0.00 1.72 0.00 0.00 39.33 41.36 1hgi h ASP 112 CO 0.03 0.46 -0.27 -1.28 -2.88 0.00 0.00 179.24 175.29 1hgi h SER 113 N 0.59 -0.75 -0.96 2.28 0.87 -0.38 -1.08 113.55 114.13 1hgi h SER 113 Ca 0.16 0.08 0.11 0.00 -1.23 0.00 0.00 61.79 60.91 1hgi h SER 113 Cb 0.02 0.28 -0.08 0.00 -0.44 0.00 0.00 62.40 62.17 1hgi h SER 113 CO -0.03 -0.37 0.59 -0.33 -0.53 0.00 0.00 176.83 176.16 1hgi h GLU 114 N -0.51 0.92 -0.27 2.24 4.39 -0.93 0.36 114.58 120.78 1hgi h GLU 114 Ca 0.02 -0.06 0.02 0.00 0.34 0.00 0.00 59.36 59.68 1hgi h GLU 114 Cb 0.51 -0.21 -0.02 0.00 -0.10 0.00 0.00 28.75 28.93 1hgi h GLU 114 CO -0.12 0.61 0.13 1.98 -1.16 0.00 0.00 179.01 180.45 1hgi h MET 115 N 0.95 0.27 -0.17 2.33 4.05 -0.78 -1.10 114.93 120.49 1hgi h MET 115 Ca 0.47 -0.02 -0.13 0.00 -0.28 0.00 0.00 59.70 59.74 1hgi h MET 115 Cb 0.44 -0.06 -0.01 0.00 -0.80 0.00 0.00 31.60 31.16 1hgi h MET 115 CO -0.26 0.18 -0.45 -0.97 0.23 0.00 0.00 176.91 175.64 1hgi h ASN 116 N 0.28 0.44 -0.55 1.39 -1.24 0.25 -1.78 115.58 114.36 1hgi h ASN 116 Ca 0.11 -0.20 -0.04 0.00 0.71 0.00 0.00 56.30 56.88 1hgi h ASN 116 Cb 0.04 -0.12 -0.02 0.00 0.73 0.00 0.00 38.32 38.94 1hgi h ASN 116 CO -0.08 0.83 0.19 0.11 -1.29 0.00 0.00 177.43 177.19 1hgi h LYS 117 N 0.33 0.84 -0.39 6.67 1.57 0.12 -0.08 116.57 125.62 1hgi h LYS 117 Ca 0.02 -0.17 -0.04 0.00 -1.87 0.00 0.00 60.65 58.59 1hgi h LYS 117 Cb 0.92 -0.13 -0.02 0.00 0.08 0.00 0.00 32.23 33.09 1hgi h LYS 117 CO 0.08 0.75 0.07 1.25 -0.57 0.00 0.00 179.45 181.03 1hgi h LEU 118 N 0.76 0.54 -0.13 2.94 5.85 -0.97 -0.93 115.31 123.36 1hgi h LEU 118 Ca 0.18 -0.08 -0.02 0.00 0.84 0.00 0.00 57.88 58.80 1hgi h LEU 118 Cb 0.24 -0.14 -0.00 0.00 0.37 0.00 0.00 40.66 41.13 1hgi h LEU 118 CO -0.01 0.56 0.01 0.15 -0.34 0.00 0.00 178.44 178.81 1hgi h PHE 119 N 0.57 0.24 -0.94 1.25 3.57 -0.34 -2.24 116.94 119.06 1hgi h PHE 119 Ca 0.13 -0.04 0.02 0.00 3.53 0.00 0.00 57.97 61.61 1hgi h PHE 119 Cb 0.25 -0.06 -0.05 0.00 2.79 0.00 0.00 35.95 38.88 1hgi h PHE 119 CO 0.01 0.44 0.61 0.93 -2.23 0.00 0.00 178.31 178.07 1hgi h GLU 120 N -0.02 1.19 -0.38 1.11 4.39 -0.81 -1.43 114.58 118.63 1hgi h GLU 120 Ca 0.04 -0.07 -0.01 0.00 0.34 0.00 0.00 59.36 59.66 1hgi h GLU 120 Cb 0.33 -0.27 -0.02 0.00 -0.10 0.00 0.00 28.75 28.70 1hgi h GLU 120 CO 0.00 0.79 0.20 -0.22 -1.16 0.00 0.00 179.01 178.63 1hgi h LYS 121 N 1.23 0.54 -0.68 2.33 3.64 -1.07 -0.40 116.57 122.15 1hgi h LYS 121 Ca 0.36 -0.07 -0.07 0.00 -1.27 0.00 0.00 60.65 59.60 1hgi h LYS 121 Cb -0.08 -0.10 -0.03 0.00 -0.41 0.00 0.00 32.23 31.61 1hgi h LYS 121 CO -0.10 0.45 0.16 1.15 -2.27 0.00 0.00 179.45 178.84 1hgi h THR 122 N 0.49 1.26 0.67 1.00 2.02 -1.11 -2.56 112.91 114.67 1hgi h THR 122 Ca 0.13 -0.97 -0.03 0.00 0.77 0.00 0.00 66.41 66.32 1hgi h THR 122 Cb 0.07 0.56 -0.01 0.00 -1.74 0.00 0.00 68.15 67.04 1hgi h THR 122 CO -0.02 0.37 -0.48 -0.09 0.37 0.00 0.00 175.52 175.67 1hgi h ARG 123 N 1.04 -1.07 -0.90 6.66 2.43 -0.75 -2.47 114.38 119.33 1hgi h ARG 123 Ca 0.21 0.07 0.21 0.00 -0.81 0.00 0.00 59.98 59.67 1hgi h ARG 123 Cb 0.38 0.24 -0.12 0.00 -0.42 0.00 0.00 29.97 30.05 1hgi h ARG 123 CO 0.00 -0.71 0.42 0.00 -1.51 0.00 0.00 179.97 178.17 1hgi h ARG 124 N -1.11 0.44 -0.67 0.20 3.08 -1.01 -1.44 114.38 113.87 1hgi h ARG 124 Ca -0.09 -0.03 -0.04 0.00 0.07 0.00 0.00 59.98 59.90 1hgi h ARG 124 Cb 0.91 -0.10 -0.03 0.00 0.08 0.00 0.00 29.97 30.84 1hgi h ARG 124 CO 0.04 0.29 0.27 0.37 -1.07 0.00 0.00 179.97 179.87 1hgi h GLN 125 N 0.45 1.00 0.00 0.04 4.15 -1.16 -2.95 115.11 116.64 1hgi h GLN 125 Ca 0.55 -0.18 0.00 0.00 0.77 0.00 0.00 58.65 59.79 1hgi h GLN 125 Cb 1.01 -0.16 0.00 0.00 0.21 0.00 0.00 27.48 28.54 1hgi h GLN 125 CO -0.50 0.83 0.00 1.28 -1.93 0.00 0.00 178.83 178.51 1hgi n LEU 126 N -4.40 0.32 0.00 -2.39 4.77 -0.55 -4.61 117.00 110.14 1hgi n LEU 126 Ca 0.05 0.55 0.00 0.00 -0.03 0.00 0.00 56.01 56.58 1hgi n LEU 126 Cb 0.17 -0.48 0.00 0.00 -2.33 0.00 0.00 43.42 40.79 1hgi n LEU 126 CO 0.40 -0.22 0.00 0.54 -1.33 0.00 0.00 177.39 176.77 1hgi n ARG 127 N -1.82 0.00 0.00 3.23 5.12 -1.12 -1.46 116.66 120.62 1hgi n ARG 127 Ca 0.05 0.00 0.02 0.00 -1.93 0.00 0.00 57.85 55.98 1hgi n ARG 127 Cb 0.29 0.00 0.10 0.00 -1.16 0.00 0.00 32.46 31.69 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 0.85 0.00 5.56 4.71 -1.26 -3.90 120.64 140.60 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 -1.06 0.21 0.00 -1.01 0.00 0.00 31.44 29.58 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 -0.56 2.39 -3.90 1.62 3.02 -0.53 -4.63 115.26 112.67 1hgi n ASN 129 Ca 0.02 -1.75 -0.09 0.00 -0.03 0.00 0.00 54.58 52.73 1hgi n ASN 129 Cb 0.01 0.07 -0.08 0.00 -0.61 0.00 0.00 39.78 39.17 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 -2.09 -0.10 0.07 5.41 0.00 -1.25 -0.74 121.76 123.05 1hgi s ALA 130 Ca 0.29 -0.65 0.07 0.00 0.00 0.00 0.00 51.96 51.67 1hgi s ALA 130 Cb 0.20 0.39 -0.03 0.00 0.00 0.00 0.00 23.12 23.68 1hgi s ALA 130 CO 0.35 -0.44 -0.19 -1.21 0.00 0.00 0.00 175.76 174.28 1hgi s GLU 131 N -3.50 1.15 -0.18 0.00 2.02 -0.20 -4.94 118.70 113.05 1hgi s GLU 131 Ca 0.02 -0.99 -0.28 0.00 0.02 0.00 0.00 54.97 53.74 1hgi s GLU 131 Cb 0.04 -1.29 -0.00 0.00 0.10 0.00 0.00 34.13 32.98 1hgi s GLU 131 CO -0.09 0.31 0.97 -2.00 0.02 0.00 0.00 175.26 174.48 1hgi s GLU 132 N -1.50 4.31 0.00 1.61 2.12 -1.26 -0.46 118.70 123.52 1hgi s GLU 132 Ca 0.05 1.27 0.31 0.00 0.36 0.00 0.00 54.97 56.96 1hgi s GLU 132 Cb -0.09 -3.60 1.59 0.00 0.26 0.00 0.00 34.13 32.30 1hgi s GLU 132 CO 0.03 -0.46 2.08 -1.33 -0.54 0.00 0.00 175.26 175.03 1hgi n MET 133 N 5.66 0.62 -0.72 4.30 2.81 0.28 -4.91 117.12 125.16 1hgi n MET 133 Ca 0.09 -0.03 0.00 0.00 -1.81 0.00 0.00 57.70 55.95 1hgi n MET 133 Cb 0.48 -1.50 0.00 0.00 -0.71 0.00 0.00 33.22 31.49 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 1.21 0.84 0.70 3.03 0.00 -1.26 -4.86 105.19 104.85 1hgi n GLY 134 Ca 0.17 0.00 0.06 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 1.63 0.00 1.61 6.94 -1.26 -4.87 115.26 119.31 1hgi n ASN 135 Ca 0.00 -3.66 0.00 0.00 -0.02 0.00 0.00 54.58 50.90 1hgi n ASN 135 Cb 0.00 -0.50 0.00 0.00 -2.36 0.00 0.00 39.78 36.92 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 -0.93 0.75 3.50 4.83 0.00 -1.25 -4.61 105.19 107.48 1hgi n GLY 136 Ca 0.17 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.86 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 -0.23 3.63 -0.47 0.00 0.08 -1.26 -0.56 117.98 119.18 1hgi s PHE 138 Ca 0.03 0.71 -0.19 0.00 0.12 0.00 0.00 56.93 57.60 1hgi s PHE 138 Cb -0.13 -2.08 0.04 0.00 -0.57 0.00 0.00 43.02 40.28 1hgi s PHE 138 CO 0.03 0.65 0.57 0.21 -0.10 0.00 0.00 175.22 176.58 1hgi s LYS 139 N -1.34 3.14 -0.20 0.44 2.47 0.39 -4.91 119.74 119.74 1hgi s LYS 139 Ca 0.23 -0.76 -0.26 0.00 -1.56 0.00 0.00 55.97 53.62 1hgi s LYS 139 Cb -0.14 -4.03 -0.01 0.00 -1.46 0.00 0.00 37.83 32.19 1hgi s LYS 139 CO 0.12 -1.07 0.88 0.42 0.16 0.00 0.00 175.35 175.85 1hgi s ILE 140 N 2.50 4.83 -0.44 5.43 1.01 -1.26 -1.03 121.20 132.23 1hgi s ILE 140 Ca 0.15 1.71 -0.02 0.00 0.00 0.00 0.00 60.65 62.50 1hgi s ILE 140 Cb -0.18 -4.17 0.22 0.00 0.01 0.00 0.00 42.46 38.34 1hgi s ILE 140 CO 0.14 -0.04 2.22 -1.22 0.00 0.00 0.00 174.94 176.03 1hgi n TYR 141 N 5.63 1.94 -3.68 3.97 4.02 0.08 -4.88 117.16 124.23 1hgi n TYR 141 Ca 0.06 -2.17 -0.10 0.00 -0.01 0.00 0.00 57.90 55.68 1hgi n TYR 141 Cb 0.48 -1.17 -0.03 0.00 -0.02 0.00 0.00 39.34 38.60 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 -2.27 -0.21 -0.12 -0.72 -3.43 -1.26 -3.56 115.29 103.71 1hgi s HIS 142 Ca 0.45 -0.12 -0.29 0.00 -0.80 0.00 0.00 55.06 54.30 1hgi s HIS 142 Cb 0.34 0.43 -0.04 0.00 -1.43 0.00 0.00 32.58 31.88 1hgi s HIS 142 CO -0.08 -0.91 1.58 0.21 -2.00 0.00 0.00 174.74 173.54 1hgi s LYS 143 N -3.85 4.07 -0.29 -0.38 2.20 -1.26 -4.96 119.74 115.27 1hgi s LYS 143 Ca 0.07 1.94 0.01 0.00 -0.36 0.00 0.00 55.97 57.63 1hgi s LYS 143 Cb -0.01 -3.97 0.09 0.00 -1.51 0.00 0.00 37.83 32.43 1hgi s LYS 143 CO -0.05 -0.97 0.04 0.00 -0.36 0.00 0.00 175.35 174.01 1hgi n ASP 145 N 4.65 -0.01 0.23 0.00 5.68 -1.26 -4.51 116.55 121.33 1hgi n ASP 145 Ca -0.04 -1.24 0.08 0.00 -0.50 0.00 0.00 54.79 53.09 1hgi n ASP 145 Cb 0.43 -0.53 0.55 0.00 -1.14 0.00 0.00 41.12 40.42 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 -0.95 0.00 0.16 -1.12 2.35 -1.98 -0.41 115.58 113.62 1hgi h ASN 146 Ca -0.23 0.00 -0.20 0.00 -0.55 0.00 0.00 56.30 55.32 1hgi h ASN 146 Cb 0.62 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.99 1hgi h ASN 146 CO 0.16 0.22 -0.78 0.00 -1.65 0.00 0.00 177.43 175.37 1hgi h ALA 147 N 1.78 0.48 0.22 -0.83 0.00 -1.98 0.93 119.26 119.85 1hgi h ALA 147 Ca -0.00 -0.62 -0.01 0.00 0.00 0.00 0.00 54.91 54.28 1hgi h ALA 147 Cb 0.45 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.20 1hgi h ALA 147 CO 0.03 0.75 -0.10 0.00 0.00 0.00 0.00 179.25 179.92 1hgi h ILE 149 N -0.30 0.93 -0.87 0.00 1.08 -0.91 -1.02 117.51 116.43 1hgi h ILE 149 Ca -0.03 -0.26 -0.01 0.00 -0.39 0.00 0.00 64.86 64.17 1hgi h ILE 149 Cb 0.23 0.09 -0.04 0.00 -3.07 0.00 0.00 36.82 34.03 1hgi h ILE 149 CO 0.05 0.14 0.50 -0.08 -0.69 0.00 0.00 178.15 178.07 1hgi h GLU 150 N 0.77 1.19 -0.06 2.37 4.22 -0.42 -1.69 114.58 120.96 1hgi h GLU 150 Ca 0.37 -0.12 -0.09 0.00 0.08 0.00 0.00 59.36 59.60 1hgi h GLU 150 Cb 0.30 -0.24 -0.01 0.00 0.50 0.00 0.00 28.75 29.29 1hgi h GLU 150 CO -0.23 0.84 -0.39 0.66 -2.18 0.00 0.00 179.01 177.72 1hgi h SER 151 N 1.20 0.13 -0.37 1.04 4.64 0.18 0.18 113.55 120.55 1hgi h SER 151 Ca 0.31 -0.05 -0.07 0.00 -0.47 0.00 0.00 61.79 61.51 1hgi h SER 151 Cb -0.02 -0.04 -0.01 0.00 -0.31 0.00 0.00 62.40 62.02 1hgi h SER 151 CO -0.06 0.51 -0.03 0.40 -0.87 0.00 0.00 176.83 176.78 1hgi h ILE 152 N 0.11 1.27 -0.13 0.95 2.04 -0.79 0.18 117.51 121.13 1hgi h ILE 152 Ca 0.01 -1.06 -0.03 0.00 1.00 0.00 0.00 64.86 64.78 1hgi h ILE 152 Cb 0.74 1.21 -0.00 0.00 -0.74 0.00 0.00 36.82 38.02 1hgi h ILE 152 CO 0.06 0.35 -0.04 0.03 0.00 0.00 0.00 178.15 178.54 1hgi h ARG 153 N 0.49 0.26 -0.05 2.37 3.08 -0.86 -2.73 114.38 116.94 1hgi h ARG 153 Ca 0.10 -0.11 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1hgi h ARG 153 Cb 0.52 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.55 1hgi h ARG 153 CO 0.03 0.57 0.00 0.27 -1.07 0.00 0.00 179.97 179.77 1hgi n ASN 154 N -4.70 0.36 -0.25 7.04 0.23 0.58 -4.89 115.26 113.63 1hgi n ASN 154 Ca -0.06 -1.74 -0.03 0.00 -0.53 0.00 0.00 54.58 52.22 1hgi n ASN 154 Cb 0.27 -0.03 -0.01 0.00 -2.08 0.00 0.00 39.78 37.92 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 0.73 0.53 0.60 4.83 0.00 -0.31 -4.91 105.19 106.66 1hgi n GLY 155 Ca 0.08 -0.91 0.05 0.00 0.00 0.00 0.00 46.02 45.24 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 -3.14 0.99 -1.70 2.61 -2.24 0.48 -5.01 114.28 106.27 1hgi n THR 156 Ca -0.03 -0.99 -0.43 0.00 -2.27 0.00 0.00 64.05 60.33 1hgi n THR 156 Cb 0.18 0.51 -0.03 0.00 -2.10 0.00 0.00 70.33 68.89 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 0.45 2.63 -3.50 4.78 9.36 -0.85 -4.95 117.16 125.09 1hgi n TYR 157 Ca 0.11 -0.04 -0.42 0.00 3.32 0.00 0.00 57.90 60.86 1hgi n TYR 157 Cb 0.41 -2.69 -0.10 0.00 -0.63 0.00 0.00 39.34 36.34 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 2.06 5.95 0.41 2.98 2.15 -1.26 -4.95 116.67 124.01 1hgi s ASP 158 Ca 0.80 -1.17 0.09 0.00 0.43 0.00 0.00 52.55 52.70 1hgi s ASP 158 Cb -0.52 -2.10 0.85 0.00 -0.30 0.00 0.00 42.92 40.85 1hgi s ASP 158 CO 0.36 -0.51 1.98 1.12 -0.17 0.00 0.00 175.17 177.94 1hgi h HIS 159 N 8.58 0.30 -0.96 -5.34 2.07 -1.92 -2.73 115.15 115.15 1hgi h HIS 159 Ca -0.26 -0.02 0.01 0.00 -2.85 0.00 0.00 60.37 57.24 1hgi h HIS 159 Cb 1.11 -0.09 -0.05 0.00 2.57 0.00 0.00 27.41 30.95 1hgi h HIS 159 CO 0.59 0.32 0.62 -0.44 -3.07 0.00 0.00 177.93 175.96 1hgi h ASP 160 N 0.29 1.12 -1.00 3.10 3.32 -1.96 -0.19 116.42 121.11 1hgi h ASP 160 Ca 0.07 -0.04 0.25 0.00 0.02 0.00 0.00 57.03 57.32 1hgi h ASP 160 Cb 0.22 -0.28 -0.08 0.00 0.22 0.00 0.00 39.33 39.41 1hgi h ASP 160 CO 0.01 0.83 0.65 0.58 -1.72 0.00 0.00 179.24 179.59 1hgi h VAL 161 N 1.31 0.57 -0.01 -1.35 2.07 -1.92 -2.12 116.25 114.81 1hgi h VAL 161 Ca 0.35 -0.13 0.00 0.00 0.82 0.00 0.00 66.70 67.74 1hgi h VAL 161 Cb -0.12 0.16 0.00 0.00 -1.52 0.00 0.00 31.29 29.80 1hgi h VAL 161 CO -0.07 0.07 -0.08 -1.22 0.02 0.00 0.00 177.57 176.29 1hgi n TYR 162 N -4.56 0.00 -0.20 1.57 4.02 -0.23 -4.81 117.16 112.95 1hgi n TYR 162 Ca 0.23 0.00 -0.01 0.00 -0.01 0.00 0.00 57.90 58.11 1hgi n TYR 162 Cb 0.83 0.00 0.10 0.00 -0.02 0.00 0.00 39.34 40.25 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 1.41 0.47 -0.27 -0.72 2.43 -0.44 -0.09 114.38 117.17 1hgi h ARG 163 Ca 0.00 -0.03 -0.13 0.00 -0.81 0.00 0.00 59.98 59.01 1hgi h ARG 163 Cb 0.34 -0.11 -0.01 0.00 -0.42 0.00 0.00 29.97 29.77 1hgi h ARG 163 CO 0.00 0.31 -0.37 -0.44 -1.51 0.00 0.00 179.97 177.97 1hgi h ASP 164 N 0.49 0.63 0.29 -3.80 3.32 -1.87 0.18 116.42 115.65 1hgi h ASP 164 Ca 0.29 -0.27 -0.01 0.00 0.02 0.00 0.00 57.03 57.06 1hgi h ASP 164 Cb 0.30 -0.18 0.00 0.00 0.22 0.00 0.00 39.33 39.68 1hgi h ASP 164 CO -0.25 0.94 -0.14 -0.08 -1.72 0.00 0.00 179.24 177.99 1hgi h GLU 165 N 0.50 -0.37 0.35 3.56 4.81 -1.72 -1.86 114.58 119.85 1hgi h GLU 165 Ca 0.05 0.03 -0.01 0.00 -0.13 0.00 0.00 59.36 59.30 1hgi h GLU 165 Cb 0.86 0.08 -0.01 0.00 0.63 0.00 0.00 28.75 30.32 1hgi h GLU 165 CO 0.07 -0.21 -0.24 0.00 -0.73 0.00 0.00 179.01 177.90 1hgi h ALA 166 N 0.28 -0.57 -0.53 2.92 0.00 -0.72 -2.32 119.26 118.32 1hgi h ALA 166 Ca -0.04 -0.10 -0.02 0.00 0.00 0.00 0.00 54.91 54.75 1hgi h ALA 166 Cb 0.33 0.31 -0.03 0.00 0.00 0.00 0.00 17.79 18.40 1hgi h ALA 166 CO 0.06 -0.84 0.25 -0.07 0.00 0.00 0.00 179.25 178.66 1hgi h LEU 167 N -0.58 0.66 0.07 0.00 3.38 -0.63 0.94 115.31 119.14 1hgi h LEU 167 Ca -0.03 -0.06 -0.00 0.00 0.09 0.00 0.00 57.88 57.88 1hgi h LEU 167 Cb 0.49 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 41.08 1hgi h LEU 167 CO 0.01 0.56 -0.03 -1.13 0.09 0.00 0.00 178.44 177.94 1hgi h ASN 168 N 0.74 -0.07 -0.76 -0.43 -0.73 -1.18 -0.64 115.58 112.51 1hgi h ASN 168 Ca 0.18 -0.10 0.03 0.00 1.87 0.00 0.00 56.30 58.28 1hgi h ASN 168 Cb 0.07 0.02 -0.05 0.00 0.27 0.00 0.00 38.32 38.64 1hgi h ASN 168 CO -0.03 0.05 0.48 0.78 -0.37 0.00 0.00 177.43 178.35 1hgi h ASN 169 N -0.20 0.80 0.19 1.15 2.35 -0.83 -2.88 115.58 116.16 1hgi h ASN 169 Ca -0.01 -0.00 -0.28 0.00 -0.55 0.00 0.00 56.30 55.45 1hgi h ASN 169 Cb 0.17 -0.18 0.03 0.00 0.05 0.00 0.00 38.32 38.39 1hgi h ASN 169 CO 0.01 0.56 -1.23 -0.09 -1.65 0.00 0.00 177.43 175.03 1hgi h ARG 170 N 0.95 0.50 0.00 0.81 2.43 -0.65 -3.42 114.38 115.00 1hgi h ARG 170 Ca 0.30 -0.79 0.00 0.00 -0.81 0.00 0.00 59.98 58.68 1hgi h ARG 170 Cb -0.00 0.28 0.00 0.00 -0.42 0.00 0.00 29.97 29.83 1hgi h ARG 170 CO -0.10 1.37 0.00 1.19 -1.51 0.00 0.00 179.97 180.91 1hgi n PHE 171 N -3.86 0.00 -0.00 2.20 3.72 -0.26 -4.86 117.46 114.39 1hgi n PHE 171 Ca -0.15 0.00 -0.00 0.00 -0.05 0.00 0.00 57.45 57.25 1hgi n PHE 171 Cb 0.99 0.00 -0.00 0.00 -0.94 0.00 0.00 39.48 39.53 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 -1.60 -0.00 0.00 -1.08 6.02 -1.09 -4.45 117.38 115.17 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 -0.10 0.00 0.00 1.02 0.00 0.00 30.24 31.16 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 -2.19 0.00 -1.63 5.09 2.08 -1.25 -2.98 119.36 118.48 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 -0.06 0.00 0.00 -1.05 0.00 0.00 58.31 57.20 1hgi n LYS 174 Cb 0.00 0.05 0.00 0.00 -0.65 0.00 0.00 35.03 34.43 1hgi n LYS 174 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76