#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1hgh h LEU 2 N 0.00 0.00 0.00 0.99 3.38 -1.91 -2.29 115.31 115.47 1hgh h LEU 2 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1hgh h LEU 2 Cb 0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 1hgh h LEU 2 CO 0.00 0.00 -1.35 0.49 0.09 0.00 0.00 178.44 177.67 1hgh n PHE 3 N -4.41 0.12 -2.06 1.13 3.01 -1.26 -4.98 117.46 109.01 1hgh n PHE 3 Ca -0.03 0.04 -0.12 0.00 1.01 0.00 0.00 57.45 58.35 1hgh n PHE 3 Cb 0.09 -0.35 -0.01 0.00 -0.01 0.00 0.00 39.48 39.20 1hgh n PHE 3 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1hgh n GLY 4 N 1.36 0.14 0.02 1.37 0.00 -0.87 -4.93 105.19 102.29 1hgh n GLY 4 Ca 0.00 -0.42 -0.02 0.00 0.00 0.00 0.00 46.02 45.59 1hgh n GLY 4 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1hgh n ALA 5 N -1.05 0.17 -1.94 4.61 0.00 -1.26 -0.76 120.51 120.27 1hgh n ALA 5 Ca -0.13 -0.29 -0.42 0.00 0.00 0.00 0.00 53.44 52.60 1hgh n ALA 5 Cb 0.56 0.01 -0.03 0.00 0.00 0.00 0.00 19.45 19.99 1hgh n ALA 5 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1hgh s ILE 6 N -1.40 2.76 -1.51 0.00 1.01 -1.26 -0.99 121.20 119.81 1hgh s ILE 6 Ca -0.05 0.60 -0.14 0.00 0.00 0.00 0.00 60.65 61.05 1hgh s ILE 6 Cb 0.01 -3.38 0.10 0.00 0.01 0.00 0.00 42.46 39.20 1hgh s ILE 6 CO 0.08 0.07 0.79 0.00 0.00 0.00 0.00 174.94 175.89 1hgh n ALA 7 N 3.06 -1.20 -2.00 9.38 0.00 -1.21 -3.81 120.51 124.73 1hgh n ALA 7 Ca 0.09 0.12 0.00 0.00 0.00 0.00 0.00 53.44 53.66 1hgh n ALA 7 Cb 0.40 -3.79 0.00 0.00 0.00 0.00 0.00 19.45 16.06 1hgh n ALA 7 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1hgh n GLY 8 N -1.47 3.97 0.27 0.00 0.00 -0.16 -4.81 105.19 102.97 1hgh n GLY 8 Ca 0.03 -0.46 0.16 0.00 0.00 0.00 0.00 46.02 45.75 1hgh n GLY 8 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 173.32 173.59 1hgh h PHE 9 N 0.00 0.00 -3.24 1.61 -5.15 -0.56 -3.31 116.94 106.29 1hgh h PHE 9 Ca 0.00 0.00 -0.67 0.00 -0.20 0.00 0.00 57.97 57.10 1hgh h PHE 9 Cb 0.00 0.00 -0.17 0.00 0.22 0.00 0.00 35.95 36.00 1hgh h PHE 9 CO 0.00 0.04 0.15 0.42 -2.00 0.00 0.00 178.31 176.92 1hgh s ILE 10 N -3.66 4.78 0.24 0.88 1.01 -0.57 -4.19 121.20 119.68 1hgh s ILE 10 Ca 0.01 -0.35 -0.07 0.00 0.00 0.00 0.00 60.65 60.24 1hgh s ILE 10 Cb 0.09 -4.35 0.24 0.00 0.01 0.00 0.00 42.46 38.46 1hgh s ILE 10 CO 0.56 -0.87 1.66 -0.08 0.00 0.00 0.00 174.94 176.22 1hgh h GLU 11 N 9.06 0.15 -2.94 2.79 4.57 -1.85 -3.20 114.58 123.16 1hgh h GLU 11 Ca -0.27 -0.01 0.06 0.00 -1.18 0.00 0.00 59.36 57.96 1hgh h GLU 11 Cb 1.09 -0.03 -0.07 0.00 -0.16 0.00 0.00 28.75 29.58 1hgh h GLU 11 CO 0.99 0.10 0.25 0.54 -1.18 0.00 0.00 179.01 179.71 1hgh s ASN 12 N -5.21 -0.32 0.78 1.04 4.22 -1.26 -4.69 114.94 109.49 1hgh s ASN 12 Ca -0.13 -0.47 -0.10 0.00 -2.14 0.00 0.00 52.86 50.02 1hgh s ASN 12 Cb 0.21 0.68 0.09 0.00 1.28 0.00 0.00 41.25 43.51 1hgh s ASN 12 CO 0.75 -1.23 1.11 -0.83 -2.04 0.00 0.00 177.10 174.86 1hgh s GLY 13 N -2.88 1.66 -0.34 0.45 0.00 -1.26 -5.02 107.32 99.94 1hgh s GLY 13 Ca 0.09 -0.88 -0.05 0.00 0.00 0.00 0.00 44.72 43.88 1hgh s GLY 13 CO 0.03 -0.39 0.09 -0.98 0.00 0.00 0.00 173.10 171.85 1hgh s TRP 14 N -3.45 3.27 0.37 1.90 0.51 -1.26 -4.93 118.94 115.35 1hgh s TRP 14 Ca 0.63 -1.57 0.21 0.00 -2.12 0.00 0.00 56.10 53.25 1hgh s TRP 14 Cb -0.10 -2.31 1.12 0.00 -0.81 0.00 0.00 33.47 31.37 1hgh s TRP 14 CO 0.47 -0.76 1.96 0.93 -0.51 0.00 0.00 176.95 179.04 1hgh h GLU 15 N 8.17 0.00 0.00 4.98 5.08 -2.04 -2.55 114.58 128.23 1hgh h GLU 15 Ca -0.22 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.12 1hgh h GLU 15 Cb 1.08 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.32 1hgh h GLU 15 CO 0.60 0.22 -0.08 0.78 -1.00 0.00 0.00 179.01 179.52 1hgh h GLY 16 N 1.07 0.00 -7.02 -3.84 0.00 -2.03 -3.41 103.07 87.84 1hgh h GLY 16 Ca -0.00 0.00 -0.55 0.00 0.00 0.00 0.00 47.33 46.78 1hgh h GLY 16 CO 0.03 0.00 1.03 -0.29 0.00 0.00 0.00 176.54 177.30 1hgh s MET 17 N -3.97 3.43 0.00 4.80 -2.45 -0.96 -4.77 119.30 115.38 1hgh s MET 17 Ca -0.02 0.32 0.13 0.00 -1.25 0.00 0.00 55.69 54.87 1hgh s MET 17 Cb 0.12 -4.06 -0.11 0.00 1.25 0.00 0.00 34.83 32.03 1hgh s MET 17 CO 0.55 -1.78 0.58 0.44 1.05 0.00 0.00 175.02 175.86 1hgh n ILE 18 N 6.73 0.00 0.33 10.11 -5.35 -1.26 -4.51 119.36 125.41 1hgh n ILE 18 Ca 0.10 -0.23 0.12 0.00 -0.27 0.00 0.00 62.75 62.47 1hgh n ILE 18 Cb 0.49 1.03 0.23 0.00 -1.74 0.00 0.00 39.64 39.65 1hgh n ILE 18 CO 0.00 0.00 0.00 -0.90 -1.76 0.00 0.00 176.55 173.89 1hgh n ASP 19 N -1.08 3.40 0.00 7.28 5.75 -1.26 -5.02 116.55 125.62 1hgh n ASP 19 Ca 0.03 -1.98 0.00 0.00 -0.01 0.00 0.00 54.79 52.83 1hgh n ASP 19 Cb 0.21 -0.26 0.00 0.00 -1.03 0.00 0.00 41.12 40.05 1hgh n ASP 19 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1hgh n GLY 20 N 1.50 -0.01 0.08 6.12 0.00 -1.26 -4.80 105.19 106.82 1hgh n GLY 20 Ca 0.20 -0.98 -0.06 0.00 0.00 0.00 0.00 46.02 45.17 1hgh n GLY 20 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1hgh n TRP 21 N -0.27 0.92 -4.24 1.61 7.02 -1.26 -4.93 117.44 116.29 1hgh n TRP 21 Ca 0.00 0.33 -0.16 0.00 -1.02 0.00 0.00 57.50 56.65 1hgh n TRP 21 Cb 0.00 -1.14 -0.11 0.00 -2.42 0.00 0.00 31.31 27.64 1hgh n TRP 21 CO 0.00 0.00 0.00 0.71 -2.02 0.00 0.00 177.69 176.38 1hgh s TYR 22 N -2.68 1.31 -0.74 -5.99 2.02 -1.26 -5.03 117.35 104.98 1hgh s TYR 22 Ca -0.05 -0.63 0.00 0.00 -0.37 0.00 0.00 57.07 56.02 1hgh s TYR 22 Cb 0.08 -0.68 0.00 0.00 -0.40 0.00 0.00 41.96 40.96 1hgh s TYR 22 CO 0.82 0.11 0.00 0.41 -1.57 0.00 0.00 175.55 175.32 1hgh n GLY 23 N 0.28 -1.21 3.35 0.71 0.00 -1.26 0.32 105.19 107.38 1hgh n GLY 23 Ca -0.14 -0.85 -0.26 0.00 0.00 0.00 0.00 46.02 44.77 1hgh n GLY 23 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1hgh s PHE 24 N -3.00 2.07 -0.03 1.61 0.40 0.04 -4.88 117.98 114.19 1hgh s PHE 24 Ca 0.00 -0.40 0.01 0.00 -0.60 0.00 0.00 56.93 55.94 1hgh s PHE 24 Cb 0.00 -1.11 0.02 0.00 0.51 0.00 0.00 43.02 42.44 1hgh s PHE 24 CO 0.00 0.30 -0.02 1.03 0.70 0.00 0.00 175.22 177.23 1hgh s ARG 25 N -2.12 0.48 0.09 0.44 0.52 -1.26 -0.47 118.95 116.63 1hgh s ARG 25 Ca 0.12 -0.02 -0.01 0.00 -0.52 0.00 0.00 55.73 55.30 1hgh s ARG 25 Cb -0.09 -0.57 -0.04 0.00 0.52 0.00 0.00 34.95 34.76 1hgh s ARG 25 CO 0.06 -0.08 -0.00 -3.38 0.02 0.00 0.00 175.30 171.91 1hgh s HIS 26 N 0.80 0.70 -0.19 -0.53 -3.43 -0.18 -4.97 115.29 107.50 1hgh s HIS 26 Ca -0.09 -1.10 -0.04 0.00 -0.80 0.00 0.00 55.06 53.02 1hgh s HIS 26 Cb -0.12 -0.45 0.08 0.00 -1.43 0.00 0.00 32.58 30.66 1hgh s HIS 26 CO -0.01 -0.39 0.16 -1.14 -2.00 0.00 0.00 174.74 171.36 1hgh s GLN 27 N -3.95 0.13 0.51 -0.38 0.74 -1.26 -1.95 119.66 113.50 1hgh s GLN 27 Ca 0.14 0.05 0.00 0.00 0.05 0.00 0.00 55.36 55.60 1hgh s GLN 27 Cb 0.07 -1.51 0.00 0.00 1.10 0.00 0.00 33.01 32.67 1hgh s GLN 27 CO -0.05 -0.67 0.03 0.27 -0.55 0.00 0.00 175.29 174.32 1hgh n ASN 28 N 5.30 3.38 0.00 6.67 0.23 0.11 -4.98 115.26 125.96 1hgh n ASN 28 Ca -0.06 -3.22 0.01 0.00 -0.53 0.00 0.00 54.58 50.78 1hgh n ASN 28 Cb 0.49 0.33 0.06 0.00 -2.08 0.00 0.00 39.78 38.58 1hgh n ASN 28 CO 0.00 0.00 0.00 -1.54 -0.93 0.00 0.00 177.26 174.79 1hgh n SER 29 N -1.34 0.00 -0.08 0.53 3.41 -1.26 -1.52 113.62 113.36 1hgh n SER 29 Ca -0.20 0.39 -0.05 0.00 -0.26 0.00 0.00 58.87 58.75 1hgh n SER 29 Cb 0.65 -0.41 -0.15 0.00 -0.26 0.00 0.00 64.21 64.04 1hgh n SER 29 CO 0.00 0.00 0.00 1.21 -0.16 0.00 0.00 175.04 176.09 1hgh n GLU 30 N -1.41 0.82 -2.69 4.33 2.13 -1.26 -5.09 120.64 117.47 1hgh n GLU 30 Ca 0.01 -0.05 0.00 0.00 0.66 0.00 0.00 57.16 57.78 1hgh n GLU 30 Cb 0.02 -1.49 0.00 0.00 0.27 0.00 0.00 31.44 30.24 1hgh n GLU 30 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1hgh n GLY 31 N 1.72 -0.52 3.23 8.31 0.00 -0.57 -5.09 105.19 112.27 1hgh n GLY 31 Ca -0.25 -0.91 -0.19 0.00 0.00 0.00 0.00 46.02 44.67 1hgh n GLY 31 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1hgh s THR 32 N -3.29 1.32 0.15 2.61 -4.23 -1.26 0.06 115.64 111.00 1hgh s THR 32 Ca 0.00 -1.62 -0.24 0.00 -1.18 0.00 0.00 61.69 58.65 1hgh s THR 32 Cb 0.00 -1.44 0.07 0.00 1.34 0.00 0.00 72.50 72.46 1hgh s THR 32 CO 0.00 -0.35 0.71 -0.83 -0.54 0.00 0.00 174.62 173.61 1hgh s GLY 33 N -2.27 -0.46 0.17 3.99 0.00 -0.82 -4.97 107.32 102.96 1hgh s GLY 33 Ca 0.07 0.42 0.07 0.00 0.00 0.00 0.00 44.72 45.27 1hgh s GLY 33 CO 0.03 0.14 -0.15 1.62 0.00 0.00 0.00 173.10 174.74 1hgh s GLN 34 N -3.62 1.23 -0.29 2.90 0.74 -1.26 -1.01 119.66 118.35 1hgh s GLN 34 Ca 0.04 -1.47 -0.16 0.00 0.05 0.00 0.00 55.36 53.83 1hgh s GLN 34 Cb -0.02 -1.07 0.15 0.00 1.10 0.00 0.00 33.01 33.17 1hgh s GLN 34 CO -0.07 0.19 0.99 0.00 -0.55 0.00 0.00 175.29 175.85 1hgh s ALA 35 N -2.64 -2.32 0.55 1.58 0.00 0.38 -4.95 121.76 114.36 1hgh s ALA 35 Ca 0.18 2.19 -0.18 0.00 0.00 0.00 0.00 51.96 54.15 1hgh s ALA 35 Cb -0.02 -1.74 -0.06 0.00 0.00 0.00 0.00 23.12 21.30 1hgh s ALA 35 CO 0.05 -0.37 1.05 0.00 0.00 0.00 0.00 175.76 176.50 1hgh s ALA 36 N 1.36 2.79 -0.33 0.00 0.00 -1.26 -0.78 121.76 123.55 1hgh s ALA 36 Ca -0.09 0.50 -0.12 0.00 0.00 0.00 0.00 51.96 52.25 1hgh s ALA 36 Cb -0.04 -3.25 -0.02 0.00 0.00 0.00 0.00 23.12 19.82 1hgh s ALA 36 CO -0.15 -0.62 0.21 0.34 0.00 0.00 0.00 175.76 175.55 1hgh s ASP 37 N -2.42 5.94 0.32 0.00 2.15 0.15 -4.85 116.67 117.97 1hgh s ASP 37 Ca 0.66 -0.39 0.21 0.00 0.43 0.00 0.00 52.55 53.46 1hgh s ASP 37 Cb -0.17 -2.11 0.17 0.00 -0.30 0.00 0.00 42.92 40.52 1hgh s ASP 37 CO 0.30 -0.20 1.36 -0.07 -0.17 0.00 0.00 175.17 176.39 1hgh h LEU 38 N 8.44 0.00 -0.11 -1.34 3.38 -1.94 -3.01 115.31 120.74 1hgh h LEU 38 Ca -0.32 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.61 1hgh h LEU 38 Cb 1.16 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.91 1hgh h LEU 38 CO 0.62 0.10 -0.10 0.11 0.09 0.00 0.00 178.44 179.25 1hgh h LYS 39 N 0.00 0.26 -0.06 1.13 1.57 -1.97 -0.75 116.57 116.75 1hgh h LYS 39 Ca -0.01 -0.14 -0.17 0.00 -1.87 0.00 0.00 60.65 58.46 1hgh h LYS 39 Cb 1.08 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.39 1hgh h LYS 39 CO 0.01 0.67 -0.71 0.66 -0.57 0.00 0.00 179.45 179.51 1hgh h SER 40 N -0.14 0.35 -0.63 0.86 4.64 -1.97 -0.64 113.55 116.02 1hgh h SER 40 Ca 0.02 -0.23 0.06 0.00 -0.47 0.00 0.00 61.79 61.17 1hgh h SER 40 Cb 0.62 -0.10 -0.05 0.00 -0.31 0.00 0.00 62.40 62.55 1hgh h SER 40 CO 0.03 0.95 0.33 0.74 -0.87 0.00 0.00 176.83 178.01 1hgh h THR 41 N 0.20 0.95 -0.34 2.95 2.02 -1.43 -0.67 112.91 116.59 1hgh h THR 41 Ca -0.02 -0.21 -0.14 0.00 0.77 0.00 0.00 66.41 66.80 1hgh h THR 41 Cb 1.27 0.27 -0.01 0.00 -1.74 0.00 0.00 68.15 67.95 1hgh h THR 41 CO 0.11 0.11 -0.36 -0.61 0.37 0.00 0.00 175.52 175.14 1hgh h GLN 42 N 0.62 0.79 -0.25 6.66 5.75 -0.84 -0.87 115.11 126.96 1hgh h GLN 42 Ca 0.28 -0.39 0.02 0.00 -0.15 0.00 0.00 58.65 58.41 1hgh h GLN 42 Cb 0.19 0.00 -0.02 0.00 1.07 0.00 0.00 27.48 28.72 1hgh h GLN 42 CO -0.19 1.02 0.12 0.00 -2.65 0.00 0.00 178.83 177.13 1hgh h ALA 43 N 0.93 0.30 -0.52 3.38 0.00 -0.41 0.20 119.26 123.15 1hgh h ALA 43 Ca 0.06 0.01 -0.07 0.00 0.00 0.00 0.00 54.91 54.91 1hgh h ALA 43 Cb 0.91 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.65 1hgh h ALA 43 CO 0.08 -0.28 0.05 0.00 0.00 0.00 0.00 179.25 179.10 1hgh h ALA 44 N 1.14 0.69 -0.55 0.00 0.00 -1.04 -2.90 119.26 116.60 1hgh h ALA 44 Ca 0.11 -0.26 -0.06 0.00 0.00 0.00 0.00 54.91 54.69 1hgh h ALA 44 Cb 0.04 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.62 1hgh h ALA 44 CO -0.08 0.46 0.09 0.82 0.00 0.00 0.00 179.25 180.54 1hgh h ILE 45 N 0.75 1.25 -0.65 0.00 2.04 -0.44 -2.14 117.51 118.33 1hgh h ILE 45 Ca 0.15 -0.95 -0.04 0.00 1.00 0.00 0.00 64.86 65.02 1hgh h ILE 45 Cb 0.46 0.81 -0.03 0.00 -0.74 0.00 0.00 36.82 37.32 1hgh h ILE 45 CO 0.02 0.35 0.26 0.44 0.00 0.00 0.00 178.15 179.21 1hgh h ASP 46 N 0.79 0.87 -0.30 1.72 3.32 -0.63 0.19 116.42 122.39 1hgh h ASP 46 Ca 0.17 -0.12 -0.17 0.00 0.02 0.00 0.00 57.03 56.93 1hgh h ASP 46 Cb 0.40 -0.23 -0.00 0.00 0.22 0.00 0.00 39.33 39.73 1hgh h ASP 46 CO 0.01 0.78 -0.46 1.56 -1.72 0.00 0.00 179.24 179.41 1hgh h GLN 47 N 0.94 0.84 -0.21 3.56 4.20 -1.28 -0.69 115.11 122.47 1hgh h GLN 47 Ca 0.22 -0.50 -0.09 0.00 0.06 0.00 0.00 58.65 58.33 1hgh h GLN 47 Cb 0.19 0.05 -0.01 0.00 0.30 0.00 0.00 27.48 28.00 1hgh h GLN 47 CO -0.02 1.14 -0.28 0.82 -0.67 0.00 0.00 178.83 179.82 1hgh h ILE 48 N 0.62 1.27 -0.23 2.54 2.04 -1.06 -0.89 117.51 121.80 1hgh h ILE 48 Ca 0.03 -1.29 -0.14 0.00 1.00 0.00 0.00 64.86 64.46 1hgh h ILE 48 Cb 1.06 1.42 -0.01 0.00 -0.74 0.00 0.00 36.82 38.55 1hgh h ILE 48 CO 0.11 0.40 -0.45 0.78 0.00 0.00 0.00 178.15 178.99 1hgh h ASN 49 N 0.35 0.62 -0.66 1.72 -0.26 -0.74 -0.86 115.58 115.75 1hgh h ASN 49 Ca 0.05 -0.29 -0.01 0.00 -0.56 0.00 0.00 56.30 55.49 1hgh h ASN 49 Cb 0.68 -0.17 -0.03 0.00 -1.06 0.00 0.00 38.32 37.73 1hgh h ASN 49 CO 0.05 0.98 0.36 1.23 -1.06 0.00 0.00 177.43 178.98 1hgh h GLY 50 N 1.05 0.98 0.93 2.83 0.00 -0.55 0.99 103.07 109.31 1hgh h GLY 50 Ca 0.03 -0.45 -0.04 0.00 0.00 0.00 0.00 47.33 46.87 1hgh h GLY 50 CO 0.09 0.43 0.10 1.70 0.00 0.00 0.00 176.54 178.85 1hgh h LYS 51 N 0.90 0.61 -0.82 4.80 3.64 -1.10 -2.54 116.57 122.06 1hgh h LYS 51 Ca 0.23 -0.15 -0.03 0.00 -1.27 0.00 0.00 60.65 59.43 1hgh h LYS 51 Cb 0.05 -0.08 -0.04 0.00 -0.41 0.00 0.00 32.23 31.75 1hgh h LYS 51 CO -0.04 0.64 0.38 1.25 -2.27 0.00 0.00 179.45 179.41 1hgh h LEU 52 N 0.47 1.09 -0.81 5.20 5.85 -0.34 -2.63 115.31 124.14 1hgh h LEU 52 Ca 0.12 -0.15 -0.11 0.00 0.84 0.00 0.00 57.88 58.58 1hgh h LEU 52 Cb 0.30 -0.28 -0.02 0.00 0.37 0.00 0.00 40.66 41.04 1hgh h LEU 52 CO 0.00 0.93 -0.53 0.78 -0.34 0.00 0.00 178.44 179.28 1hgh h ASN 53 N 1.17 0.00 0.02 1.25 2.35 -0.53 -1.77 115.58 118.07 1hgh h ASN 53 Ca 0.28 0.00 -0.16 0.00 -0.55 0.00 0.00 56.30 55.87 1hgh h ASN 53 Cb 0.14 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.51 1hgh h ASN 53 CO -0.03 0.53 -0.53 -0.09 -1.65 0.00 0.00 177.43 175.67 1hgh h ARG 54 N 0.00 0.55 0.00 0.81 9.65 -1.10 -2.63 114.38 121.66 1hgh h ARG 54 Ca -0.01 -0.34 -0.11 0.00 -1.10 0.00 0.00 59.98 58.42 1hgh h ARG 54 Cb 1.03 0.03 -0.02 0.00 -1.39 0.00 0.00 29.97 29.63 1hgh h ARG 54 CO 0.07 0.94 -0.54 0.28 2.80 0.00 0.00 179.97 183.52 1hgh h VAL 55 N 0.43 1.10 -0.16 0.20 2.07 -1.20 -2.78 116.25 115.91 1hgh h VAL 55 Ca 0.01 -2.09 0.00 0.00 0.82 0.00 0.00 66.70 65.44 1hgh h VAL 55 Cb 1.06 2.23 0.00 0.00 -1.52 0.00 0.00 31.29 33.06 1hgh h VAL 55 CO 0.10 0.53 0.00 -0.38 0.02 0.00 0.00 177.57 177.84 1hgh n ILE 56 N -3.47 0.20 -1.68 4.57 5.41 -0.71 -4.91 119.36 118.77 1hgh n ILE 56 Ca 0.00 -0.36 -0.42 0.00 1.00 0.00 0.00 62.75 62.97 1hgh n ILE 56 Cb 0.65 0.44 -0.03 0.00 -0.71 0.00 0.00 39.64 39.99 1hgh n ILE 56 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 176.55 177.76 1hgh n GLU 57 N 0.39 2.86 -0.43 0.38 2.13 -1.01 -4.65 120.64 120.31 1hgh n GLU 57 Ca 0.17 1.05 0.00 0.00 0.66 0.00 0.00 57.16 59.03 1hgh n GLU 57 Cb 0.35 -2.97 0.00 0.00 0.27 0.00 0.00 31.44 29.09 1hgh n GLU 57 CO 0.00 0.00 0.00 1.17 -0.41 0.00 0.00 177.13 177.89 1hgh n LYS 58 N 6.56 -0.03 -2.29 5.31 3.00 -1.26 -4.92 118.16 124.53 1hgh n LYS 58 Ca 0.19 0.03 -0.42 0.00 -0.00 0.00 0.00 58.31 58.10 1hgh n LYS 58 Cb 0.39 -0.11 -0.03 0.00 0.00 0.00 0.00 35.03 35.29 1hgh n LYS 58 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.40 178.35 1hgh s THR 59 N 0.00 3.89 0.54 3.15 -4.23 -1.26 -5.00 115.64 112.73 1hgh s THR 59 Ca 0.00 1.24 -0.15 0.00 -1.18 0.00 0.00 61.69 61.59 1hgh s THR 59 Cb 0.00 -3.80 -0.07 0.00 1.34 0.00 0.00 72.50 69.98 1hgh s THR 59 CO 0.00 -0.02 1.00 0.54 -0.54 0.00 0.00 174.62 175.61 1hgh s ASN 60 N 1.86 6.43 0.00 3.99 4.22 -1.26 -5.05 114.94 125.13 1hgh s ASN 60 Ca 0.61 1.58 0.02 0.00 -2.14 0.00 0.00 52.86 52.93 1hgh s ASN 60 Cb -0.29 -2.51 -0.04 0.00 1.28 0.00 0.00 41.25 39.70 1hgh s ASN 60 CO 0.24 -0.72 -0.02 -1.83 -2.04 0.00 0.00 177.10 172.73 1hgh s GLU 61 N -4.26 2.71 0.03 3.55 -1.05 -1.26 -5.11 118.70 113.31 1hgh s GLU 61 Ca 0.59 -0.65 0.04 0.00 -0.15 0.00 0.00 54.97 54.80 1hgh s GLU 61 Cb -0.11 -2.61 -0.02 0.00 -0.44 0.00 0.00 34.13 30.95 1hgh s GLU 61 CO 0.36 0.62 -0.12 0.15 0.95 0.00 0.00 175.26 177.22 1hgh s LYS 62 N -1.52 0.78 0.00 -4.83 -0.14 -1.26 -5.13 119.74 107.64 1hgh s LYS 62 Ca 0.19 -0.68 0.00 0.00 -1.36 0.00 0.00 55.97 54.12 1hgh s LYS 62 Cb -0.11 -0.73 0.00 0.00 -1.68 0.00 0.00 37.83 35.30 1hgh s LYS 62 CO 0.09 0.18 0.00 1.19 -0.76 0.00 0.00 175.35 176.05 1hgh n PHE 63 N 1.96 0.00 -1.97 3.18 3.72 -1.26 -5.01 117.46 118.09 1hgh n PHE 63 Ca -0.18 0.00 -0.42 0.00 -0.05 0.00 0.00 57.45 56.80 1hgh n PHE 63 Cb 0.55 0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 39.06 1hgh n PHE 63 CO 0.00 0.00 0.00 -1.58 -0.05 0.00 0.00 176.76 175.13 1hgh s HIS 64 N 2.01 2.79 0.00 1.38 2.46 -1.26 -4.96 115.29 117.71 1hgh s HIS 64 Ca 0.00 0.53 0.00 0.00 0.47 0.00 0.00 55.06 56.06 1hgh s HIS 64 Cb 0.00 -3.91 0.00 0.00 -0.13 0.00 0.00 32.58 28.54 1hgh s HIS 64 CO 0.00 -3.47 0.00 1.04 -2.47 0.00 0.00 174.74 169.84 1hgh n GLN 65 N 4.75 0.00 -4.40 2.88 6.02 -1.26 -5.16 117.38 120.22 1hgh n GLN 65 Ca 0.14 0.00 -0.20 0.00 -0.01 0.00 0.00 57.00 56.93 1hgh n GLN 65 Cb 0.40 0.00 -0.10 0.00 1.02 0.00 0.00 30.24 31.56 1hgh n GLN 65 CO 0.00 0.00 0.00 0.96 -1.01 0.00 0.00 177.06 177.01 1hgh s ILE 66 N 3.20 1.63 0.35 5.09 -4.36 -1.26 -5.12 121.20 120.73 1hgh s ILE 66 Ca 0.00 -2.15 -0.27 0.00 -0.26 0.00 0.00 60.65 57.98 1hgh s ILE 66 Cb 0.00 -2.31 -0.09 0.00 1.25 0.00 0.00 42.46 41.30 1hgh s ILE 66 CO 0.00 -0.39 1.11 -1.61 0.24 0.00 0.00 174.94 174.28 1hgh s GLU 67 N -3.71 4.32 0.00 0.37 0.41 -1.26 -4.95 118.70 113.88 1hgh s GLU 67 Ca 0.27 1.73 0.00 0.00 -0.41 0.00 0.00 54.97 56.56 1hgh s GLU 67 Cb 0.02 -2.84 0.00 0.00 -1.78 0.00 0.00 34.13 29.53 1hgh s GLU 67 CO 0.10 -0.05 0.71 1.63 -0.49 0.00 0.00 175.26 177.16 1hgh n LYS 68 N 0.48 1.36 -3.81 1.61 5.02 -1.26 -4.87 118.16 116.69 1hgh n LYS 68 Ca 0.02 -0.96 -0.13 0.00 -2.02 0.00 0.00 58.31 55.22 1hgh n LYS 68 Cb 0.47 -0.82 -0.14 0.00 -0.02 0.00 0.00 35.03 34.51 1hgh n LYS 68 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 1hgh s GLU 69 N -0.50 0.04 0.04 1.97 2.02 -1.26 -5.06 118.70 115.95 1hgh s GLU 69 Ca 0.00 0.17 0.02 0.00 0.02 0.00 0.00 54.97 55.18 1hgh s GLU 69 Cb 0.00 -0.09 -0.02 0.00 0.10 0.00 0.00 34.13 34.12 1hgh s GLU 69 CO 0.00 -0.08 -0.07 -0.06 0.02 0.00 0.00 175.26 175.06 1hgh s PHE 70 N 0.54 0.63 -0.30 1.61 0.40 -1.26 -5.07 117.98 114.54 1hgh s PHE 70 Ca -0.04 -0.49 0.10 0.00 -0.60 0.00 0.00 56.93 55.90 1hgh s PHE 70 Cb -0.06 -0.38 -0.12 0.00 0.51 0.00 0.00 43.02 42.97 1hgh s PHE 70 CO -0.02 -0.09 0.34 -1.13 0.70 0.00 0.00 175.22 175.02 1hgh n SER 71 N 1.52 1.25 -4.61 1.36 3.41 -1.26 -5.03 113.62 110.27 1hgh n SER 71 Ca -0.23 -0.47 -0.25 0.00 -0.26 0.00 0.00 58.87 57.67 1hgh n SER 71 Cb 0.55 1.16 -0.09 0.00 -0.26 0.00 0.00 64.21 65.57 1hgh n SER 71 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 1hgh s GLU 72 N -2.19 2.03 -0.22 4.33 0.41 -1.26 -5.11 118.70 116.69 1hgh s GLU 72 Ca 0.01 -1.74 -0.14 0.00 -0.41 0.00 0.00 54.97 52.69 1hgh s GLU 72 Cb 0.07 -1.91 -0.04 0.00 -1.78 0.00 0.00 34.13 30.47 1hgh s GLU 72 CO 0.40 0.18 0.34 0.08 -0.49 0.00 0.00 175.26 175.77 1hgh s VAL 73 N -2.51 5.23 -0.01 2.63 1.01 -1.26 -4.94 120.40 120.55 1hgh s VAL 73 Ca 0.34 0.57 0.01 0.00 0.00 0.00 0.00 61.98 62.89 1hgh s VAL 73 Cb -0.01 -3.67 -0.02 0.00 0.00 0.00 0.00 36.38 32.68 1hgh s VAL 73 CO 0.19 0.25 0.02 -0.62 0.00 0.00 0.00 175.10 174.94 1hgh n GLU 74 N 4.60 1.79 0.00 2.72 1.02 -1.26 -5.12 120.64 124.38 1hgh n GLU 74 Ca -0.10 -0.01 0.00 0.00 -0.02 0.00 0.00 57.16 57.04 1hgh n GLU 74 Cb 0.51 -1.03 0.00 0.00 -0.02 0.00 0.00 31.44 30.90 1hgh n GLU 74 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1hgh n GLY 75 N 2.66 0.79 0.26 0.62 0.00 -1.26 -4.74 105.19 103.53 1hgh n GLY 75 Ca -0.01 -1.19 -0.07 0.00 0.00 0.00 0.00 46.02 44.75 1hgh n GLY 75 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 1hgh h ARG 76 N 0.00 -0.17 -0.20 1.61 2.43 -2.00 0.74 114.38 116.79 1hgh h ARG 76 Ca 0.00 0.01 -0.18 0.00 -0.81 0.00 0.00 59.98 59.00 1hgh h ARG 76 Cb 0.00 0.04 -0.00 0.00 -0.42 0.00 0.00 29.97 29.59 1hgh h ARG 76 CO 0.00 -0.12 -0.61 0.97 -1.51 0.00 0.00 179.97 178.70 1hgh h ILE 77 N -0.18 1.31 -0.02 1.20 6.09 -2.00 -2.73 117.51 121.17 1hgh h ILE 77 Ca 0.17 -1.85 -0.13 0.00 -1.37 0.00 0.00 64.86 61.68 1hgh h ILE 77 Cb 0.45 1.81 -0.02 0.00 0.47 0.00 0.00 36.82 39.53 1hgh h ILE 77 CO -0.45 0.58 -0.57 -0.61 -3.07 0.00 0.00 178.15 174.03 1hgh h GLN 78 N 0.50 0.08 -0.41 2.19 4.15 -1.64 -1.30 115.11 118.69 1hgh h GLN 78 Ca -0.01 -0.05 -0.06 0.00 0.77 0.00 0.00 58.65 59.30 1hgh h GLN 78 Cb 1.19 0.01 -0.02 0.00 0.21 0.00 0.00 27.48 28.87 1hgh h GLN 78 CO 0.12 0.63 -0.00 -0.44 -1.93 0.00 0.00 178.83 177.21 1hgh h ASP 79 N 0.06 0.62 -0.21 -0.69 3.32 -0.74 -1.97 116.42 116.81 1hgh h ASP 79 Ca -0.00 -0.13 -0.15 0.00 0.02 0.00 0.00 57.03 56.76 1hgh h ASP 79 Cb 1.03 -0.16 0.00 0.00 0.22 0.00 0.00 39.33 40.42 1hgh h ASP 79 CO 0.08 0.69 -0.45 0.25 -1.72 0.00 0.00 179.24 178.09 1hgh h LEU 80 N 0.62 0.76 -0.39 1.55 5.85 -1.09 0.26 115.31 122.87 1hgh h LEU 80 Ca 0.13 -0.55 0.06 0.00 0.84 0.00 0.00 57.88 58.35 1hgh h LEU 80 Cb 0.39 -0.22 -0.05 0.00 0.37 0.00 0.00 40.66 41.15 1hgh h LEU 80 CO 0.01 1.17 0.07 -0.33 -0.34 0.00 0.00 178.44 179.03 1hgh h GLU 81 N 0.38 0.19 -0.59 1.25 5.08 -1.12 0.30 114.58 120.07 1hgh h GLU 81 Ca 0.00 -0.01 -0.06 0.00 -1.00 0.00 0.00 59.36 58.29 1hgh h GLU 81 Cb 1.05 -0.04 -0.02 0.00 0.50 0.00 0.00 28.75 30.24 1hgh h GLU 81 CO 0.10 0.12 0.12 0.87 -1.00 0.00 0.00 179.01 179.23 1hgh h LYS 82 N 0.19 0.95 -0.22 2.33 1.57 -1.30 -2.73 116.57 117.38 1hgh h LYS 82 Ca 0.19 -0.24 -0.11 0.00 -1.87 0.00 0.00 60.65 58.61 1hgh h LYS 82 Cb 0.23 -0.12 -0.01 0.00 0.08 0.00 0.00 32.23 32.40 1hgh h LYS 82 CO -0.25 0.89 -0.35 -0.92 -0.57 0.00 0.00 179.45 178.25 1hgh h TYR 83 N 0.86 0.54 -0.52 -1.35 3.20 -0.24 -0.75 116.97 118.70 1hgh h TYR 83 Ca 0.18 -0.14 -0.01 0.00 3.14 0.00 0.00 58.73 61.91 1hgh h TYR 83 Cb 0.38 -0.12 -0.02 0.00 1.54 0.00 0.00 36.73 38.50 1hgh h TYR 83 CO 0.03 0.75 0.30 0.28 -1.64 0.00 0.00 178.16 177.88 1hgh h VAL 84 N 0.39 1.17 -0.26 1.81 2.07 -0.28 -1.86 116.25 119.29 1hgh h VAL 84 Ca 0.04 -0.39 -0.18 0.00 0.82 0.00 0.00 66.70 66.99 1hgh h VAL 84 Cb 0.80 0.48 0.00 0.00 -1.52 0.00 0.00 31.29 31.05 1hgh h VAL 84 CO 0.06 0.17 -0.54 -0.08 0.02 0.00 0.00 177.57 177.20 1hgh h GLU 85 N 0.70 0.83 -0.28 1.57 4.57 -1.25 -1.54 114.58 119.18 1hgh h GLU 85 Ca 0.19 -0.54 -0.12 0.00 -1.18 0.00 0.00 59.36 57.70 1hgh h GLU 85 Cb 0.01 0.07 -0.01 0.00 -0.16 0.00 0.00 28.75 28.66 1hgh h GLU 85 CO -0.03 1.17 -0.32 0.22 -1.18 0.00 0.00 179.01 178.87 1hgh h ASP 86 N 0.60 0.61 0.87 1.04 3.58 -1.05 0.30 116.42 122.38 1hgh h ASP 86 Ca 0.01 -0.24 -0.11 0.00 0.42 0.00 0.00 57.03 57.11 1hgh h ASP 86 Cb 1.15 -0.17 -0.02 0.00 1.72 0.00 0.00 39.33 42.02 1hgh h ASP 86 CO 0.12 0.89 -0.51 0.71 -2.88 0.00 0.00 179.24 177.57 1hgh h THR 87 N 0.51 1.11 -0.13 2.25 1.35 -1.24 -1.68 112.91 115.08 1hgh h THR 87 Ca 0.06 -1.94 -0.01 0.00 -0.55 0.00 0.00 66.41 63.97 1hgh h THR 87 Cb 0.80 2.13 -0.01 0.00 -1.73 0.00 0.00 68.15 69.34 1hgh h THR 87 CO 0.07 0.50 0.03 0.50 -0.25 0.00 0.00 175.52 176.37 1hgh h LYS 88 N 0.00 0.21 -0.78 4.72 3.64 -0.22 -2.10 116.57 122.05 1hgh h LYS 88 Ca -0.01 -0.05 -0.00 0.00 -1.27 0.00 0.00 60.65 59.32 1hgh h LYS 88 Cb 1.09 -0.03 -0.04 0.00 -0.41 0.00 0.00 32.23 32.84 1hgh h LYS 88 CO 0.07 0.38 0.47 0.82 -2.27 0.00 0.00 179.45 178.92 1hgh h ILE 89 N 0.01 1.22 -0.37 2.00 2.04 -0.83 -0.77 117.51 120.80 1hgh h ILE 89 Ca 0.04 -0.47 -0.11 0.00 1.00 0.00 0.00 64.86 65.33 1hgh h ILE 89 Cb 0.27 0.13 -0.02 0.00 -0.74 0.00 0.00 36.82 36.46 1hgh h ILE 89 CO 0.00 0.22 -0.20 0.44 0.00 0.00 0.00 178.15 178.61 1hgh h ASP 90 N 1.06 0.71 -0.26 1.72 3.32 -1.20 0.12 116.42 121.90 1hgh h ASP 90 Ca 0.28 -0.24 -0.04 0.00 0.02 0.00 0.00 57.03 57.05 1hgh h ASP 90 Cb -0.05 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 39.30 1hgh h ASP 90 CO -0.05 0.91 0.00 -0.07 -1.72 0.00 0.00 179.24 178.31 1hgh h LEU 91 N 0.63 0.44 -1.15 1.55 3.38 -0.90 0.54 115.31 119.80 1hgh h LEU 91 Ca 0.09 -0.31 -0.08 0.00 0.09 0.00 0.00 57.88 57.68 1hgh h LEU 91 Cb 0.68 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.30 1hgh h LEU 91 CO 0.05 0.64 -0.25 -0.50 0.09 0.00 0.00 178.44 178.47 1hgh h TRP 92 N 0.23 0.31 -0.47 1.13 4.06 -0.99 -1.35 115.95 118.88 1hgh h TRP 92 Ca 0.07 -0.06 -0.12 0.00 2.06 0.00 0.00 58.89 60.85 1hgh h TRP 92 Cb 0.41 -0.08 -0.02 0.00 -1.00 0.00 0.00 29.16 28.48 1hgh h TRP 92 CO 0.03 0.52 -0.18 0.77 -3.56 0.00 0.00 178.44 176.02 1hgh h SER 93 N 0.26 0.93 -0.29 -3.49 0.02 -0.64 -1.21 113.55 109.12 1hgh h SER 93 Ca 0.04 -0.33 -0.00 0.00 -0.84 0.00 0.00 61.79 60.66 1hgh h SER 93 Cb 0.59 -0.25 -0.01 0.00 0.14 0.00 0.00 62.40 62.86 1hgh h SER 93 CO 0.04 1.09 0.17 0.22 -1.14 0.00 0.00 176.83 177.21 1hgh h TYR 94 N 0.80 0.39 -0.60 3.45 3.20 -0.46 -1.88 116.97 121.87 1hgh h TYR 94 Ca 0.11 -0.00 0.06 0.00 3.14 0.00 0.00 58.73 62.04 1hgh h TYR 94 Cb 0.73 -0.13 -0.06 0.00 1.54 0.00 0.00 36.73 38.82 1hgh h TYR 94 CO 0.04 0.30 0.29 -0.91 -1.64 0.00 0.00 178.16 176.25 1hgh h ASN 95 N 0.36 0.40 -0.58 -2.11 4.21 -0.87 -0.82 115.58 116.18 1hgh h ASN 95 Ca 0.10 0.04 -0.10 0.00 1.21 0.00 0.00 56.30 57.56 1hgh h ASN 95 Cb 0.03 -0.03 -0.02 0.00 -1.12 0.00 0.00 38.32 37.18 1hgh h ASN 95 CO -0.02 0.26 -0.02 0.00 -1.29 0.00 0.00 177.43 176.36 1hgh h ALA 96 N 1.34 0.78 -0.44 -0.83 0.00 -0.95 -0.92 119.26 118.24 1hgh h ALA 96 Ca 0.28 -0.32 -0.11 0.00 0.00 0.00 0.00 54.91 54.76 1hgh h ALA 96 Cb 0.23 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 1hgh h ALA 96 CO -0.21 0.63 -0.16 1.49 0.00 0.00 0.00 179.25 181.00 1hgh h GLU 97 N 0.92 0.89 -0.16 0.00 4.57 -0.84 -1.84 114.58 118.12 1hgh h GLU 97 Ca 0.16 -0.36 -0.16 0.00 -1.18 0.00 0.00 59.36 57.82 1hgh h GLU 97 Cb 0.58 -0.04 -0.01 0.00 -0.16 0.00 0.00 28.75 29.12 1hgh h GLU 97 CO 0.03 1.01 -0.55 1.25 -1.18 0.00 0.00 179.01 179.57 1hgh h LEU 98 N 0.72 0.54 0.06 1.64 5.85 -1.08 -2.66 115.31 120.37 1hgh h LEU 98 Ca 0.11 -0.29 -0.00 0.00 0.84 0.00 0.00 57.88 58.53 1hgh h LEU 98 Cb 0.71 -0.15 0.00 0.00 0.37 0.00 0.00 40.66 41.59 1hgh h LEU 98 CO 0.05 0.98 -0.03 0.25 -0.34 0.00 0.00 178.44 179.35 1hgh h LEU 99 N 0.37 -0.07 -1.04 2.25 5.85 -0.88 -1.37 115.31 120.42 1hgh h LEU 99 Ca 0.01 -0.11 -0.09 0.00 0.84 0.00 0.00 57.88 58.53 1hgh h LEU 99 Cb 1.08 0.02 -0.01 0.00 0.37 0.00 0.00 40.66 42.12 1hgh h LEU 99 CO 0.10 0.06 -0.42 -0.37 -0.34 0.00 0.00 178.44 177.47 1hgh h VAL 100 N -0.21 1.10 0.31 1.05 -1.51 -1.36 -1.52 116.25 114.12 1hgh h VAL 100 Ca -0.01 -1.55 -0.02 0.00 -1.23 0.00 0.00 66.70 63.89 1hgh h VAL 100 Cb 0.18 1.89 0.00 0.00 -2.13 0.00 0.00 31.29 31.23 1hgh h VAL 100 CO 0.01 0.41 -0.15 0.00 -1.23 0.00 0.00 177.57 176.62 1hgh h ALA 101 N 1.58 -0.41 0.09 5.19 0.00 -1.14 -0.17 119.26 124.40 1hgh h ALA 101 Ca -0.00 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.81 1hgh h ALA 101 Cb 0.85 0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.79 1hgh h ALA 101 CO 0.05 -0.71 -0.10 -0.07 0.00 0.00 0.00 179.25 178.42 1hgh h LEU 102 N -0.45 -0.26 -0.35 0.00 3.38 -1.09 -1.75 115.31 114.79 1hgh h LEU 102 Ca -0.04 0.03 0.07 0.00 0.09 0.00 0.00 57.88 58.03 1hgh h LEU 102 Cb 0.34 0.09 -0.07 0.00 0.09 0.00 0.00 40.66 41.12 1hgh h LEU 102 CO 0.07 -0.15 -0.08 -0.33 0.09 0.00 0.00 178.44 178.03 1hgh h GLU 103 N -0.21 0.00 -0.45 1.13 4.39 -1.21 -0.92 114.58 117.31 1hgh h GLU 103 Ca 0.01 -0.00 -0.11 0.00 0.34 0.00 0.00 59.36 59.60 1hgh h GLU 103 Cb 0.21 -0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 28.84 1hgh h GLU 103 CO -0.03 0.00 -0.17 -0.91 -1.16 0.00 0.00 179.01 176.74 1hgh h ASN 104 N 0.00 0.87 -0.61 1.42 2.35 -0.83 0.31 115.58 119.09 1hgh h ASN 104 Ca 0.17 -0.30 -0.02 0.00 -0.55 0.00 0.00 56.30 55.61 1hgh h ASN 104 Cb 0.26 -0.24 -0.03 0.00 0.05 0.00 0.00 38.32 38.36 1hgh h ASN 104 CO -0.36 1.03 0.32 -0.61 -1.65 0.00 0.00 177.43 176.16 1hgh h GLN 105 N 0.76 0.86 -0.36 0.81 5.75 -0.72 -1.83 115.11 120.38 1hgh h GLN 105 Ca 0.11 -0.11 -0.07 0.00 -0.15 0.00 0.00 58.65 58.44 1hgh h GLN 105 Cb 0.69 -0.16 -0.01 0.00 1.07 0.00 0.00 27.48 29.07 1hgh h GLN 105 CO 0.05 0.66 -0.04 1.25 -2.65 0.00 0.00 178.83 178.10 1hgh h HIS 106 N 0.83 0.73 -0.79 3.99 2.76 -0.62 -2.39 115.15 119.66 1hgh h HIS 106 Ca 0.21 -0.14 0.01 0.00 -2.20 0.00 0.00 60.37 58.25 1hgh h HIS 106 Cb 0.07 -0.18 -0.04 0.00 1.55 0.00 0.00 27.41 28.80 1hgh h HIS 106 CO -0.01 0.79 0.52 1.15 -1.30 0.00 0.00 177.93 179.09 1hgh h THR 107 N 0.46 1.19 -0.36 6.26 2.02 -0.54 0.12 112.91 122.07 1hgh h THR 107 Ca 0.10 -0.36 -0.09 0.00 0.77 0.00 0.00 66.41 66.83 1hgh h THR 107 Cb 0.53 0.05 -0.01 0.00 -1.74 0.00 0.00 68.15 66.97 1hgh h THR 107 CO 0.03 0.19 -0.11 0.40 0.37 0.00 0.00 175.52 176.40 1hgh h ILE 108 N 1.05 1.28 -0.18 3.11 2.04 -1.19 -1.78 117.51 121.84 1hgh h ILE 108 Ca 0.29 -1.20 -0.14 0.00 1.00 0.00 0.00 64.86 64.82 1hgh h ILE 108 Cb -0.09 1.32 -0.01 0.00 -0.74 0.00 0.00 36.82 37.30 1hgh h ILE 108 CO -0.07 0.39 -0.46 0.44 0.00 0.00 0.00 178.15 178.45 1hgh h ASP 109 N 0.49 0.50 0.03 1.72 3.32 -0.84 -1.69 116.42 119.95 1hgh h ASP 109 Ca 0.09 -0.24 -0.00 0.00 0.02 0.00 0.00 57.03 56.90 1hgh h ASP 109 Cb 0.63 -0.14 0.00 0.00 0.22 0.00 0.00 39.33 40.04 1hgh h ASP 109 CO 0.04 0.89 -0.02 0.25 -1.72 0.00 0.00 179.24 178.68 1hgh h LEU 110 N 0.37 -0.04 -1.10 1.55 6.46 -0.73 0.19 115.31 122.01 1hgh h LEU 110 Ca 0.02 -0.05 -0.09 0.00 -0.12 0.00 0.00 57.88 57.64 1hgh h LEU 110 Cb 0.96 0.01 -0.01 0.00 -0.73 0.00 0.00 40.66 40.88 1hgh h LEU 110 CO 0.08 0.03 -0.40 0.71 -0.62 0.00 0.00 178.44 178.24 1hgh h THR 111 N -0.10 1.30 -0.21 1.05 1.35 -1.17 -1.35 112.91 113.77 1hgh h THR 111 Ca -0.00 -1.42 -0.01 0.00 -0.55 0.00 0.00 66.41 64.42 1hgh h THR 111 Cb 0.09 1.70 -0.01 0.00 -1.73 0.00 0.00 68.15 68.20 1hgh h THR 111 CO 0.01 0.42 0.09 -0.78 -0.25 0.00 0.00 175.52 175.00 1hgh h ASP 112 N 0.09 0.29 -0.30 5.36 3.58 -1.04 -2.26 116.42 122.14 1hgh h ASP 112 Ca 0.01 -0.15 0.07 0.00 0.42 0.00 0.00 57.03 57.37 1hgh h ASP 112 Cb 0.74 -0.07 -0.07 0.00 1.72 0.00 0.00 39.33 41.65 1hgh h ASP 112 CO 0.06 0.36 -0.20 -1.28 -2.88 0.00 0.00 179.24 175.29 1hgh h SER 113 N 0.20 -0.66 -0.96 2.28 0.87 -0.07 -0.97 113.55 114.23 1hgh h SER 113 Ca 0.07 0.14 0.03 0.00 -1.23 0.00 0.00 61.79 60.80 1hgh h SER 113 Cb 0.16 0.34 -0.05 0.00 -0.44 0.00 0.00 62.40 62.40 1hgh h SER 113 CO -0.01 -0.24 0.63 -0.33 -0.53 0.00 0.00 176.83 176.35 1hgh h GLU 114 N -0.18 1.18 0.12 2.24 4.39 -1.10 0.32 114.58 121.56 1hgh h GLU 114 Ca 0.16 -0.07 -0.01 0.00 0.34 0.00 0.00 59.36 59.78 1hgh h GLU 114 Cb 0.42 -0.27 0.00 0.00 -0.10 0.00 0.00 28.75 28.80 1hgh h GLU 114 CO -0.40 0.78 -0.06 1.98 -1.16 0.00 0.00 179.01 180.15 1hgh h MET 115 N 1.22 -0.16 -0.31 2.33 4.05 -0.77 -1.16 114.93 120.13 1hgh h MET 115 Ca 0.37 0.01 -0.04 0.00 -0.28 0.00 0.00 59.70 59.76 1hgh h MET 115 Cb -0.02 0.04 -0.02 0.00 -0.80 0.00 0.00 31.60 30.80 1hgh h MET 115 CO -0.11 -0.10 0.00 -0.97 0.23 0.00 0.00 176.91 175.96 1hgh h ASN 116 N -0.17 0.45 -0.44 1.39 -1.24 -0.38 -1.92 115.58 113.27 1hgh h ASN 116 Ca -0.02 -0.08 -0.10 0.00 0.71 0.00 0.00 56.30 56.82 1hgh h ASN 116 Cb 0.13 -0.12 -0.01 0.00 0.73 0.00 0.00 38.32 39.06 1hgh h ASN 116 CO 0.03 0.51 -0.12 0.11 -1.29 0.00 0.00 177.43 176.67 1hgh h LYS 117 N 0.46 0.85 -0.76 6.67 1.57 0.28 -0.29 116.57 125.35 1hgh h LYS 117 Ca 0.10 -0.33 -0.03 0.00 -1.87 0.00 0.00 60.65 58.53 1hgh h LYS 117 Cb 0.30 -0.05 -0.04 0.00 0.08 0.00 0.00 32.23 32.53 1hgh h LYS 117 CO 0.01 0.96 0.37 1.25 -0.57 0.00 0.00 179.45 181.47 1hgh h LEU 118 N 0.68 0.98 0.25 2.94 5.85 -0.96 0.19 115.31 125.23 1hgh h LEU 118 Ca 0.11 -0.11 -0.01 0.00 0.84 0.00 0.00 57.88 58.71 1hgh h LEU 118 Cb 0.66 -0.25 0.00 0.00 0.37 0.00 0.00 40.66 41.44 1hgh h LEU 118 CO 0.05 0.82 -0.12 0.15 -0.34 0.00 0.00 178.44 179.00 1hgh h PHE 119 N 1.07 -0.31 -0.85 1.25 3.57 -0.83 -1.41 116.94 119.44 1hgh h PHE 119 Ca 0.26 -0.01 0.06 0.00 3.53 0.00 0.00 57.97 61.82 1hgh h PHE 119 Cb 0.10 0.10 -0.05 0.00 2.79 0.00 0.00 35.95 38.89 1hgh h PHE 119 CO 0.01 -0.11 0.55 0.93 -2.23 0.00 0.00 178.31 177.46 1hgh h GLU 120 N -0.44 0.92 -0.23 1.11 4.39 -0.64 0.03 114.58 119.72 1hgh h GLU 120 Ca -0.03 -0.06 -0.04 0.00 0.34 0.00 0.00 59.36 59.57 1hgh h GLU 120 Cb 0.33 -0.21 -0.01 0.00 -0.10 0.00 0.00 28.75 28.77 1hgh h GLU 120 CO 0.06 0.61 -0.02 -0.22 -1.16 0.00 0.00 179.01 178.27 1hgh h LYS 121 N 0.95 0.42 -0.64 2.33 3.64 -0.82 -1.15 116.57 121.31 1hgh h LYS 121 Ca 0.36 -0.14 -0.07 0.00 -1.27 0.00 0.00 60.65 59.53 1hgh h LYS 121 Cb 0.21 -0.03 -0.03 0.00 -0.41 0.00 0.00 32.23 31.97 1hgh h LYS 121 CO -0.13 0.62 0.10 1.15 -2.27 0.00 0.00 179.45 178.92 1hgh h THR 122 N 0.17 1.26 0.11 1.00 2.02 -0.66 -2.57 112.91 114.24 1hgh h THR 122 Ca 0.06 -1.01 0.02 0.00 0.77 0.00 0.00 66.41 66.25 1hgh h THR 122 Cb 0.45 0.66 -0.04 0.00 -1.74 0.00 0.00 68.15 67.47 1hgh h THR 122 CO 0.02 0.38 -0.35 -0.09 0.37 0.00 0.00 175.52 175.84 1hgh h ARG 123 N 0.98 -0.56 -0.91 6.66 2.43 -0.82 -2.29 114.38 119.88 1hgh h ARG 123 Ca 0.20 0.04 0.11 0.00 -0.81 0.00 0.00 59.98 59.52 1hgh h ARG 123 Cb 0.42 0.13 -0.07 0.00 -0.42 0.00 0.00 29.97 30.03 1hgh h ARG 123 CO 0.01 -0.37 0.58 0.00 -1.51 0.00 0.00 179.97 178.68 1hgh h ARG 124 N -0.58 0.82 -0.33 0.20 3.08 -1.07 -2.43 114.38 114.07 1hgh h ARG 124 Ca 0.03 -0.05 -0.16 0.00 0.07 0.00 0.00 59.98 59.87 1hgh h ARG 124 Cb 0.61 -0.18 -0.00 0.00 0.08 0.00 0.00 29.97 30.47 1hgh h ARG 124 CO -0.21 0.54 -0.42 0.37 -1.07 0.00 0.00 179.97 179.18 1hgh h GLN 125 N 0.84 0.87 0.00 0.04 4.15 -1.10 -2.90 115.11 117.01 1hgh h GLN 125 Ca 0.44 -0.49 0.00 0.00 0.77 0.00 0.00 58.65 59.37 1hgh h GLN 125 Cb 0.52 0.03 0.00 0.00 0.21 0.00 0.00 27.48 28.24 1hgh h GLN 125 CO -0.20 1.13 0.00 1.28 -1.93 0.00 0.00 178.83 179.11 1hgh n LEU 126 N -4.09 0.15 0.00 -2.39 4.77 -0.89 -4.59 117.00 109.95 1hgh n LEU 126 Ca -0.03 0.53 0.00 0.00 -0.03 0.00 0.00 56.01 56.48 1hgh n LEU 126 Cb 0.56 -0.51 0.00 0.00 -2.33 0.00 0.00 43.42 41.14 1hgh n LEU 126 CO 0.48 -0.30 0.00 0.54 -1.33 0.00 0.00 177.39 176.79 1hgh n ARG 127 N -1.66 0.00 -0.06 3.23 5.12 -1.10 -1.36 116.66 120.83 1hgh n ARG 127 Ca 0.03 0.00 0.02 0.00 -1.93 0.00 0.00 57.85 55.97 1hgh n ARG 127 Cb 0.20 0.00 0.05 0.00 -1.16 0.00 0.00 32.46 31.54 1hgh n ARG 127 CO 0.00 0.00 0.00 -1.91 -1.93 0.00 0.00 177.63 173.79 1hgh n GLU 128 N 14.00 1.25 0.00 5.56 4.07 -1.26 -4.08 120.64 140.18 1hgh n GLU 128 Ca 0.00 -0.38 0.11 0.00 -0.06 0.00 0.00 57.16 56.83 1hgh n GLU 128 Cb 0.00 -1.10 0.05 0.00 -0.06 0.00 0.00 31.44 30.33 1hgh n GLU 128 CO 0.00 0.00 0.00 0.09 -0.06 0.00 0.00 177.13 177.16 1hgh n ASN 129 N -0.19 2.04 -3.94 4.31 4.13 -0.47 -4.65 115.26 116.50 1hgh n ASN 129 Ca 0.04 -1.51 -0.09 0.00 1.68 0.00 0.00 54.58 54.69 1hgh n ASN 129 Cb 0.10 0.39 -0.09 0.00 -1.54 0.00 0.00 39.78 38.64 1hgh n ASN 129 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1hgh s ALA 130 N -2.42 -0.02 0.09 5.41 0.00 -1.26 -0.76 121.76 122.80 1hgh s ALA 130 Ca 0.20 -0.65 0.08 0.00 0.00 0.00 0.00 51.96 51.60 1hgh s ALA 130 Cb 0.18 0.29 -0.03 0.00 0.00 0.00 0.00 23.12 23.57 1hgh s ALA 130 CO 0.54 -0.36 -0.22 -1.21 0.00 0.00 0.00 175.76 174.51 1hgh s GLU 131 N -3.01 1.23 -0.24 0.00 2.02 -0.40 -4.93 118.70 113.36 1hgh s GLU 131 Ca -0.02 -1.14 -0.27 0.00 0.02 0.00 0.00 54.97 53.56 1hgh s GLU 131 Cb 0.01 -1.49 0.01 0.00 0.10 0.00 0.00 34.13 32.76 1hgh s GLU 131 CO -0.06 0.36 0.97 -2.00 0.02 0.00 0.00 175.26 174.54 1hgh s GLU 132 N -1.76 4.21 0.00 1.61 2.12 -1.26 -0.57 118.70 123.04 1hgh s GLU 132 Ca 0.08 1.18 0.23 0.00 0.36 0.00 0.00 54.97 56.83 1hgh s GLU 132 Cb -0.10 -3.65 1.26 0.00 0.26 0.00 0.00 34.13 31.90 1hgh s GLU 132 CO 0.04 -0.62 1.77 -1.33 -0.54 0.00 0.00 175.26 174.58 1hgh n MET 133 N 6.27 0.49 -0.73 4.30 2.81 0.05 -4.88 117.12 125.42 1hgh n MET 133 Ca 0.10 0.04 0.00 0.00 -1.81 0.00 0.00 57.70 56.03 1hgh n MET 133 Cb 0.47 -1.50 0.00 0.00 -0.71 0.00 0.00 33.22 31.48 1hgh n MET 133 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1hgh n GLY 134 N 0.60 0.95 0.89 3.03 0.00 -1.26 -4.85 105.19 104.55 1hgh n GLY 134 Ca 0.14 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.18 1hgh n GLY 134 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1hgh n ASN 135 N 0.00 2.01 0.00 1.61 6.94 -1.26 -4.90 115.26 119.66 1hgh n ASN 135 Ca 0.00 -3.67 0.00 0.00 -0.02 0.00 0.00 54.58 50.89 1hgh n ASN 135 Cb 0.00 -0.48 0.00 0.00 -2.36 0.00 0.00 39.78 36.94 1hgh n ASN 135 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1hgh n GLY 136 N -0.90 0.68 3.58 4.83 0.00 -1.26 -4.65 105.19 107.47 1hgh n GLY 136 Ca 0.20 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.89 1hgh n GLY 136 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1hgh s PHE 138 N -0.83 3.42 -0.40 0.00 0.08 -1.26 -0.77 117.98 118.21 1hgh s PHE 138 Ca 0.13 0.28 -0.17 0.00 0.12 0.00 0.00 56.93 57.29 1hgh s PHE 138 Cb -0.11 -1.78 0.01 0.00 -0.57 0.00 0.00 43.02 40.58 1hgh s PHE 138 CO 0.02 0.60 0.41 0.21 -0.10 0.00 0.00 175.22 176.36 1hgh s LYS 139 N -1.90 3.19 -0.35 0.44 2.47 0.26 -4.91 119.74 118.94 1hgh s LYS 139 Ca 0.26 -0.70 -0.24 0.00 -1.56 0.00 0.00 55.97 53.74 1hgh s LYS 139 Cb -0.12 -3.93 0.01 0.00 -1.46 0.00 0.00 37.83 32.32 1hgh s LYS 139 CO 0.17 -0.78 0.81 0.42 0.16 0.00 0.00 175.35 176.13 1hgh s ILE 140 N 2.09 4.72 -0.06 5.43 1.01 -1.26 -1.28 121.20 131.85 1hgh s ILE 140 Ca 0.12 0.98 -0.02 0.00 0.00 0.00 0.00 60.65 61.72 1hgh s ILE 140 Cb -0.17 -4.22 -0.07 0.00 0.01 0.00 0.00 42.46 38.01 1hgh s ILE 140 CO 0.13 -0.42 2.60 -1.22 0.00 0.00 0.00 174.94 176.04 1hgh n TYR 141 N 6.44 0.23 -3.56 3.97 4.01 0.06 -4.84 117.16 123.47 1hgh n TYR 141 Ca 0.04 -1.32 -0.11 0.00 -0.16 0.00 0.00 57.90 56.36 1hgh n TYR 141 Cb 0.48 -0.97 -0.02 0.00 -0.31 0.00 0.00 39.34 38.52 1hgh n TYR 141 CO 0.00 0.00 0.00 -3.38 -0.46 0.00 0.00 176.86 173.02 1hgh s HIS 142 N 0.08 -0.41 -0.15 -0.72 -3.43 -1.26 -3.59 115.29 105.81 1hgh s HIS 142 Ca 0.29 0.12 -0.29 0.00 -0.80 0.00 0.00 55.06 54.38 1hgh s HIS 142 Cb 0.15 0.57 -0.04 0.00 -1.43 0.00 0.00 32.58 31.83 1hgh s HIS 142 CO -0.01 -0.94 1.74 0.21 -2.00 0.00 0.00 174.74 173.73 1hgh s LYS 143 N -3.80 3.85 -0.31 -0.38 2.20 -1.26 -4.95 119.74 115.09 1hgh s LYS 143 Ca 0.04 1.95 0.01 0.00 -0.36 0.00 0.00 55.97 57.62 1hgh s LYS 143 Cb -0.02 -4.08 0.10 0.00 -1.51 0.00 0.00 37.83 32.32 1hgh s LYS 143 CO -0.07 -1.24 0.07 0.00 -0.36 0.00 0.00 175.35 173.74 1hgh n ASP 145 N 4.59 -0.78 0.26 0.00 5.68 -1.26 -4.64 116.55 120.41 1hgh n ASP 145 Ca -0.00 -1.22 0.10 0.00 -0.50 0.00 0.00 54.79 53.17 1hgh n ASP 145 Cb 0.42 -0.80 0.70 0.00 -1.14 0.00 0.00 41.12 40.31 1hgh n ASP 145 CO 0.00 0.00 0.00 0.78 -1.33 0.00 0.00 177.20 176.65 1hgh h ASN 146 N -1.81 0.00 0.51 -1.12 2.35 -1.99 0.11 115.58 113.63 1hgh h ASN 146 Ca -0.33 0.00 -0.21 0.00 -0.55 0.00 0.00 56.30 55.21 1hgh h ASN 146 Cb 0.96 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 39.32 1hgh h ASN 146 CO 0.23 0.08 -0.92 0.00 -1.65 0.00 0.00 177.43 175.17 1hgh h ALA 147 N 1.92 0.44 0.33 -0.83 0.00 -1.98 -0.61 119.26 118.52 1hgh h ALA 147 Ca -0.00 -0.73 -0.02 0.00 0.00 0.00 0.00 54.91 54.16 1hgh h ALA 147 Cb 0.17 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.91 1hgh h ALA 147 CO 0.01 0.89 -0.16 0.00 0.00 0.00 0.00 179.25 179.99 1hgh h ILE 149 N -0.54 0.98 -0.49 0.00 1.08 -0.92 0.19 117.51 117.81 1hgh h ILE 149 Ca -0.05 -0.31 -0.03 0.00 -0.39 0.00 0.00 64.86 64.08 1hgh h ILE 149 Cb 0.40 -0.01 -0.02 0.00 -3.07 0.00 0.00 36.82 34.12 1hgh h ILE 149 CO 0.07 0.17 0.16 -0.08 -0.69 0.00 0.00 178.15 177.78 1hgh h GLU 150 N 0.91 0.71 -0.04 2.37 4.22 -0.84 -2.02 114.58 119.90 1hgh h GLU 150 Ca 0.41 -0.12 -0.13 0.00 0.08 0.00 0.00 59.36 59.60 1hgh h GLU 150 Cb 0.37 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 29.49 1hgh h GLU 150 CO -0.17 0.62 -0.59 0.66 -2.18 0.00 0.00 179.01 177.35 1hgh h SER 151 N 0.70 0.16 -0.28 1.04 4.64 0.80 0.15 113.55 120.75 1hgh h SER 151 Ca 0.16 -0.09 -0.04 0.00 -0.47 0.00 0.00 61.79 61.35 1hgh h SER 151 Cb 0.20 -0.05 -0.01 0.00 -0.31 0.00 0.00 62.40 62.23 1hgh h SER 151 CO -0.01 0.71 0.02 0.40 -0.87 0.00 0.00 176.83 177.08 1hgh h ILE 152 N 0.11 1.25 0.02 0.95 2.04 -1.05 0.17 117.51 121.00 1hgh h ILE 152 Ca -0.00 -0.88 -0.00 0.00 1.00 0.00 0.00 64.86 64.97 1hgh h ILE 152 Cb 1.07 1.27 0.00 0.00 -0.74 0.00 0.00 36.82 38.42 1hgh h ILE 152 CO 0.09 0.28 -0.01 0.03 0.00 0.00 0.00 178.15 178.54 1hgh h ARG 153 N 0.29 -0.02 -0.26 2.37 3.08 -0.99 -2.25 114.38 116.59 1hgh h ARG 153 Ca 0.08 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.13 1hgh h ARG 153 Cb 0.40 0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.45 1hgh h ARG 153 CO 0.01 0.12 0.00 0.27 -1.07 0.00 0.00 179.97 179.30 1hgh n ASN 154 N -5.03 0.97 -0.21 7.04 0.23 0.49 -4.90 115.26 113.85 1hgh n ASN 154 Ca -0.08 -2.03 -0.03 0.00 -0.53 0.00 0.00 54.58 51.92 1hgh n ASN 154 Cb 0.10 -0.17 -0.01 0.00 -2.08 0.00 0.00 39.78 37.62 1hgh n ASN 154 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1hgh n GLY 155 N 0.65 0.60 0.75 4.83 0.00 -0.42 -4.90 105.19 106.70 1hgh n GLY 155 Ca 0.05 -0.67 0.06 0.00 0.00 0.00 0.00 46.02 45.46 1hgh n GLY 155 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1hgh n THR 156 N -2.87 1.24 -1.76 2.61 -2.24 0.48 -5.00 114.28 106.73 1hgh n THR 156 Ca -0.03 -1.15 -0.42 0.00 -2.27 0.00 0.00 64.05 60.18 1hgh n THR 156 Cb 0.11 0.37 -0.03 0.00 -2.10 0.00 0.00 70.33 68.68 1hgh n THR 156 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 1hgh s TYR 157 N -1.32 2.91 -0.37 4.78 5.04 -0.76 -4.93 117.35 122.70 1hgh s TYR 157 Ca 0.29 0.43 -0.12 0.00 -2.44 0.00 0.00 57.07 55.22 1hgh s TYR 157 Cb 0.17 -4.10 0.01 0.00 0.35 0.00 0.00 41.96 38.39 1hgh s TYR 157 CO 0.16 -4.11 0.23 0.34 -1.34 0.00 0.00 175.55 170.84 1hgh s ASP 158 N 1.09 5.88 0.31 4.32 -1.08 -1.26 -4.95 116.67 120.98 1hgh s ASP 158 Ca 0.73 -0.81 0.07 0.00 -0.52 0.00 0.00 52.55 52.02 1hgh s ASP 158 Cb -0.49 -2.08 0.52 0.00 -1.46 0.00 0.00 42.92 39.41 1hgh s ASP 158 CO 0.34 -0.36 1.74 1.12 0.52 0.00 0.00 175.17 178.53 1hgh h HIS 159 N 8.50 0.25 -0.61 -5.34 2.07 -1.93 -2.99 115.15 115.09 1hgh h HIS 159 Ca -0.28 -0.06 0.00 0.00 -2.85 0.00 0.00 60.37 57.18 1hgh h HIS 159 Cb 1.12 -0.06 -0.03 0.00 2.57 0.00 0.00 27.41 31.02 1hgh h HIS 159 CO 0.59 0.56 0.38 -0.44 -3.07 0.00 0.00 177.93 175.96 1hgh h ASP 160 N 0.19 0.71 -0.92 3.10 3.32 -1.96 -0.71 116.42 120.15 1hgh h ASP 160 Ca 0.02 -0.03 0.19 0.00 0.02 0.00 0.00 57.03 57.24 1hgh h ASP 160 Cb 0.75 -0.18 -0.07 0.00 0.22 0.00 0.00 39.33 40.04 1hgh h ASP 160 CO 0.06 0.53 0.60 0.58 -1.72 0.00 0.00 179.24 179.29 1hgh h VAL 161 N 0.83 0.70 -0.10 -1.35 2.07 -1.96 -2.36 116.25 114.09 1hgh h VAL 161 Ca 0.22 -0.17 0.00 0.00 0.82 0.00 0.00 66.70 67.57 1hgh h VAL 161 Cb -0.06 0.15 0.00 0.00 -1.52 0.00 0.00 31.29 29.86 1hgh h VAL 161 CO -0.04 0.09 0.00 -1.22 0.02 0.00 0.00 177.57 176.42 1hgh n TYR 162 N -4.56 0.13 -0.18 1.57 4.02 -0.37 -4.78 117.16 112.99 1hgh n TYR 162 Ca 0.20 -0.31 -0.05 0.00 -0.01 0.00 0.00 57.90 57.72 1hgh n TYR 162 Cb 0.65 -0.02 0.04 0.00 -0.02 0.00 0.00 39.34 39.98 1hgh n TYR 162 CO 0.00 0.00 0.00 -0.09 -1.01 0.00 0.00 176.86 175.76 1hgh h ARG 163 N 0.94 0.61 -0.39 -0.72 2.43 -0.73 -0.79 114.38 115.73 1hgh h ARG 163 Ca 0.00 -0.04 -0.15 0.00 -0.81 0.00 0.00 59.98 58.98 1hgh h ARG 163 Cb 0.46 -0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 29.86 1hgh h ARG 163 CO 0.00 0.40 -0.35 -0.44 -1.51 0.00 0.00 179.97 178.07 1hgh h ASP 164 N 0.62 0.95 -0.03 -3.80 3.32 -1.86 0.92 116.42 116.54 1hgh h ASP 164 Ca 0.21 -0.42 0.02 0.00 0.02 0.00 0.00 57.03 56.86 1hgh h ASP 164 Cb 0.02 -0.27 -0.02 0.00 0.22 0.00 0.00 39.33 39.29 1hgh h ASP 164 CO -0.10 1.20 -0.06 -0.08 -1.72 0.00 0.00 179.24 178.48 1hgh h GLU 165 N 0.74 -0.09 0.19 3.56 4.81 -1.83 -1.44 114.58 120.52 1hgh h GLU 165 Ca 0.07 0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 59.30 1hgh h GLU 165 Cb 0.93 0.02 0.00 0.00 0.63 0.00 0.00 28.75 30.33 1hgh h GLU 165 CO 0.09 -0.06 -0.09 0.00 -0.73 0.00 0.00 179.01 178.22 1hgh h ALA 166 N 0.93 -0.26 -0.36 2.92 0.00 -1.02 -2.24 119.26 119.23 1hgh h ALA 166 Ca 0.04 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.84 1hgh h ALA 166 Cb 0.14 0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.01 1hgh h ALA 166 CO -0.09 -0.57 0.23 -0.07 0.00 0.00 0.00 179.25 178.75 1hgh h LEU 167 N -0.39 0.42 0.46 0.00 3.38 -0.67 0.78 115.31 119.28 1hgh h LEU 167 Ca -0.03 -0.01 -0.02 0.00 0.09 0.00 0.00 57.88 57.91 1hgh h LEU 167 Cb 0.30 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 40.95 1hgh h LEU 167 CO 0.04 0.31 -0.22 -1.13 0.09 0.00 0.00 178.44 177.54 1hgh h ASN 168 N 0.50 -0.52 -0.89 -0.43 -0.73 -1.15 -1.11 115.58 111.26 1hgh h ASN 168 Ca 0.13 -0.07 0.11 0.00 1.87 0.00 0.00 56.30 58.34 1hgh h ASN 168 Cb -0.04 0.13 -0.07 0.00 0.27 0.00 0.00 38.32 38.62 1hgh h ASN 168 CO -0.03 -0.22 0.57 0.78 -0.37 0.00 0.00 177.43 178.17 1hgh h ASN 169 N -0.83 0.76 0.13 1.15 2.35 -0.81 -2.69 115.58 115.64 1hgh h ASN 169 Ca -0.06 0.03 -0.23 0.00 -0.55 0.00 0.00 56.30 55.48 1hgh h ASN 169 Cb 0.56 -0.13 0.01 0.00 0.05 0.00 0.00 38.32 38.81 1hgh h ASN 169 CO 0.10 0.44 -1.09 -0.09 -1.65 0.00 0.00 177.43 175.13 1hgh h ARG 170 N 0.84 0.28 0.00 0.81 2.43 -0.81 -3.44 114.38 114.49 1hgh h ARG 170 Ca 0.42 -0.48 0.00 0.00 -0.81 0.00 0.00 59.98 59.11 1hgh h ARG 170 Cb 0.48 0.18 0.00 0.00 -0.42 0.00 0.00 29.97 30.21 1hgh h ARG 170 CO -0.18 1.23 0.00 1.19 -1.51 0.00 0.00 179.97 180.70 1hgh n PHE 171 N -4.03 0.00 -0.00 2.20 3.72 -0.43 -4.85 117.46 114.07 1hgh n PHE 171 Ca -0.19 0.00 -0.00 0.00 -0.05 0.00 0.00 57.45 57.21 1hgh n PHE 171 Cb 0.87 0.00 -0.00 0.00 -0.94 0.00 0.00 39.48 39.41 1hgh n PHE 171 CO 0.00 0.00 0.00 1.04 -0.05 0.00 0.00 176.76 177.75 1hgh n GLN 172 N -1.43 -0.00 0.00 -1.08 6.02 -1.02 -4.47 117.38 115.40 1hgh n GLN 172 Ca 0.00 0.03 0.00 0.00 -0.01 0.00 0.00 57.00 57.02 1hgh n GLN 172 Cb 0.00 -0.04 0.00 0.00 1.02 0.00 0.00 30.24 31.22 1hgh n GLN 172 CO 0.00 0.00 0.00 -0.89 -1.01 0.00 0.00 177.06 175.16 1hgh n ILE 173 N -2.32 0.00 -1.74 5.09 2.08 -1.25 -2.91 119.36 118.30 1hgh n ILE 173 Ca 0.00 0.00 -0.03 0.00 0.56 0.00 0.00 62.75 63.28 1hgh n ILE 173 Cb 0.00 0.00 -0.03 0.00 -0.75 0.00 0.00 39.64 38.86 1hgh n ILE 173 CO 0.00 0.00 0.00 2.29 0.56 0.00 0.00 176.55 179.40 1hgh n LYS 174 N 0.00 0.00 0.00 0.38 2.85 -1.26 -5.19 118.16 114.94 1hgh n LYS 174 Ca 0.00 -0.38 0.00 0.00 -1.05 0.00 0.00 58.31 56.88 1hgh n LYS 174 Cb 0.00 0.31 0.00 0.00 -0.65 0.00 0.00 35.03 34.69 1hgh n LYS 174 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76