#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hu8 s ASN 2 N 0.00 0.07 0.40 7.83 2.20 -1.26 -5.03 114.94 119.15 3hu8 s ASN 2 Ca 0.00 -1.03 0.08 0.00 -0.94 0.00 0.00 52.86 50.97 3hu8 s ASN 2 Cb 0.00 0.75 0.85 0.00 -2.00 0.00 0.00 41.25 40.85 3hu8 s ASN 2 CO 0.00 -1.46 2.01 -0.29 -2.94 0.00 0.00 177.10 174.42 3hu8 h ILE 3 N 2.05 1.04 -0.05 0.54 6.09 -1.97 0.89 117.51 126.10 3hu8 h ILE 3 Ca -0.27 -0.21 -0.01 0.00 -1.37 0.00 0.00 64.86 63.00 3hu8 h ILE 3 Cb 1.25 0.38 -0.00 0.00 0.47 0.00 0.00 36.82 38.92 3hu8 h ILE 3 CO 0.35 0.11 -0.01 -0.26 -3.07 0.00 0.00 178.15 175.27 3hu8 h PHE 4 N 0.60 0.12 -0.40 2.19 -1.00 -1.98 0.07 116.94 116.54 3hu8 h PHE 4 Ca 0.23 -0.02 -0.07 0.00 2.81 0.00 0.00 57.97 60.92 3hu8 h PHE 4 Cb 0.16 -0.03 -0.02 0.00 3.61 0.00 0.00 35.95 39.67 3hu8 h PHE 4 CO -0.00 0.44 -0.03 0.93 -1.61 0.00 0.00 178.31 178.03 3hu8 h GLU 5 N -0.24 0.65 0.30 1.51 5.08 -1.82 0.75 114.58 120.82 3hu8 h GLU 5 Ca 0.01 -0.17 -0.01 0.00 -1.00 0.00 0.00 59.36 58.19 3hu8 h GLU 5 Cb 0.40 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.57 3hu8 h GLU 5 CO 0.01 0.70 -0.15 1.98 -1.00 0.00 0.00 179.01 180.55 3hu8 h MET 6 N 0.61 -0.39 -0.07 2.33 4.05 -0.75 -1.99 114.93 118.73 3hu8 h MET 6 Ca 0.12 0.03 -0.07 0.00 -0.28 0.00 0.00 59.70 59.50 3hu8 h MET 6 Cb 0.44 0.09 -0.01 0.00 -0.80 0.00 0.00 31.60 31.32 3hu8 h MET 6 CO 0.02 -0.09 -0.26 -0.07 0.23 0.00 0.00 176.91 176.74 3hu8 h LEU 7 N -0.71 0.11 -0.85 3.39 3.38 -0.88 -1.97 115.31 117.79 3hu8 h LEU 7 Ca -0.04 -0.03 -0.01 0.00 0.09 0.00 0.00 57.88 57.89 3hu8 h LEU 7 Cb 0.48 -0.03 -0.04 0.00 0.09 0.00 0.00 40.66 41.16 3hu8 h LEU 7 CO 0.07 0.38 0.50 -0.09 0.09 0.00 0.00 178.44 179.38 3hu8 h ARG 8 N 0.10 1.16 -0.27 1.13 9.65 -0.74 0.14 114.38 125.56 3hu8 h ARG 8 Ca 0.02 -0.12 -0.01 0.00 -1.10 0.00 0.00 59.98 58.77 3hu8 h ARG 8 Cb 0.53 -0.24 -0.01 0.00 -1.39 0.00 0.00 29.97 28.85 3hu8 h ARG 8 CO 0.04 0.83 0.12 0.82 2.80 0.00 0.00 179.97 184.58 3hu8 h ILE 9 N 1.17 1.16 -0.04 1.20 2.04 -0.98 -0.86 117.51 121.21 3hu8 h ILE 9 Ca 0.30 -0.48 -0.13 0.00 1.00 0.00 0.00 64.86 65.55 3hu8 h ILE 9 Cb -0.02 0.98 -0.01 0.00 -0.74 0.00 0.00 36.82 37.02 3hu8 h ILE 9 CO -0.05 0.17 -0.60 0.44 0.00 0.00 0.00 178.15 178.11 3hu8 h ASP 10 N 0.30 0.13 0.00 1.72 3.32 -0.84 -3.31 116.42 117.75 3hu8 h ASP 10 Ca 0.09 -0.08 -0.09 0.00 0.02 0.00 0.00 57.03 56.98 3hu8 h ASP 10 Cb 0.15 -0.04 -0.02 0.00 0.22 0.00 0.00 39.33 39.65 3hu8 h ASP 10 CO -0.01 0.70 -1.92 -0.62 -1.72 0.00 0.00 179.24 175.66 3hu8 n GLU 11 N -3.85 0.76 -0.14 3.56 -0.58 0.45 -5.07 120.64 115.76 3hu8 n GLU 11 Ca -0.02 -0.12 0.02 0.00 -0.42 0.00 0.00 57.16 56.62 3hu8 n GLU 11 Cb 0.60 -1.43 -0.00 0.00 -0.57 0.00 0.00 31.44 30.04 3hu8 n GLU 11 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3hu8 n GLY 12 N 1.62 -1.96 2.68 0.62 0.00 -0.33 -4.29 105.19 103.53 3hu8 n GLY 12 Ca -0.10 -1.37 -0.21 0.00 0.00 0.00 0.00 46.02 44.33 3hu8 n GLY 12 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3hu8 s LEU 13 N 0.00 0.15 -0.04 0.99 2.96 -1.26 -4.24 118.68 117.24 3hu8 s LEU 13 Ca 0.00 -0.09 0.02 0.00 -0.22 0.00 0.00 54.13 53.84 3hu8 s LEU 13 Cb 0.00 -0.07 0.01 0.00 0.50 0.00 0.00 46.19 46.63 3hu8 s LEU 13 CO 0.00 -0.28 -0.09 -0.13 -1.32 0.00 0.00 176.35 174.53 3hu8 s ARG 14 N 2.19 1.08 0.01 1.98 0.52 -0.49 -5.00 118.95 119.23 3hu8 s ARG 14 Ca 0.04 -0.29 0.24 0.00 -0.52 0.00 0.00 55.73 55.20 3hu8 s ARG 14 Cb -0.13 -0.99 0.26 0.00 0.52 0.00 0.00 34.95 34.61 3hu8 s ARG 14 CO -0.06 0.06 1.24 1.28 0.02 0.00 0.00 175.30 177.84 3hu8 n LEU 15 N 3.54 0.65 -4.63 2.53 4.77 -1.26 0.04 117.00 122.63 3hu8 n LEU 15 Ca -0.21 -0.12 -0.31 0.00 -0.03 0.00 0.00 56.01 55.34 3hu8 n LEU 15 Cb 0.53 -0.17 -0.09 0.00 -2.33 0.00 0.00 43.42 41.36 3hu8 n LEU 15 CO 0.25 0.14 -0.37 -0.54 -1.33 0.00 0.00 177.39 175.54 3hu8 s LYS 16 N -3.03 2.46 0.05 3.23 1.02 -1.26 -0.90 119.74 121.32 3hu8 s LYS 16 Ca 0.09 -0.82 -0.37 0.00 0.02 0.00 0.00 55.97 54.89 3hu8 s LYS 16 Cb 0.17 -2.48 -0.16 0.00 -0.52 0.00 0.00 37.83 34.84 3hu8 s LYS 16 CO 0.76 0.56 1.43 -0.89 -0.92 0.00 0.00 175.35 176.28 3hu8 n ILE 17 N 1.02 0.05 -4.24 2.17 5.41 -0.52 -4.74 119.36 118.50 3hu8 n ILE 17 Ca -0.13 -0.01 -0.14 0.00 1.00 0.00 0.00 62.75 63.47 3hu8 n ILE 17 Cb 0.52 -0.98 -0.10 0.00 -0.71 0.00 0.00 39.64 38.37 3hu8 n ILE 17 CO 0.00 0.00 0.00 -0.72 0.00 0.00 0.00 176.55 175.83 3hu8 s TYR 18 N 0.94 1.27 -0.14 1.39 -0.85 0.23 -4.94 117.35 115.25 3hu8 s TYR 18 Ca 0.85 -1.25 -0.11 0.00 -0.52 0.00 0.00 57.07 56.04 3hu8 s TYR 18 Cb -0.92 -0.69 -0.05 0.00 0.38 0.00 0.00 41.96 40.68 3hu8 s TYR 18 CO 0.48 -0.47 0.22 0.15 -1.52 0.00 0.00 175.55 174.41 3hu8 s LYS 19 N -4.08 3.96 0.00 -3.49 1.02 -1.26 0.28 119.74 116.17 3hu8 s LYS 19 Ca 0.35 -0.01 0.00 0.00 0.02 0.00 0.00 55.97 56.33 3hu8 s LYS 19 Cb 0.07 -3.33 0.00 0.00 -0.52 0.00 0.00 37.83 34.05 3hu8 s LYS 19 CO 0.11 0.47 0.00 -0.40 -0.92 0.00 0.00 175.35 174.61 3hu8 n ASP 20 N 2.87 -0.38 0.29 2.83 5.68 0.56 -4.78 116.55 123.62 3hu8 n ASP 20 Ca -0.16 -0.75 0.17 0.00 -0.50 0.00 0.00 54.79 53.55 3hu8 n ASP 20 Cb 0.53 0.00 0.83 0.00 -1.14 0.00 0.00 41.12 41.34 3hu8 n ASP 20 CO 0.00 0.00 0.00 0.71 -1.33 0.00 0.00 177.20 176.58 3hu8 h THR 21 N -1.15 0.20 -0.14 2.12 1.35 -1.98 -1.10 112.91 112.20 3hu8 h THR 21 Ca 0.00 -0.42 0.00 0.00 -0.55 0.00 0.00 66.41 65.44 3hu8 h THR 21 Cb 0.00 1.34 0.00 0.00 -1.73 0.00 0.00 68.15 67.76 3hu8 h THR 21 CO 0.00 0.05 0.00 -0.62 -0.25 0.00 0.00 175.52 174.70 3hu8 n GLU 22 N -3.26 2.04 -0.78 4.72 -0.58 -1.26 -4.93 120.64 116.58 3hu8 n GLU 22 Ca -0.01 -1.54 0.00 0.00 -0.42 0.00 0.00 57.16 55.19 3hu8 n GLU 22 Cb 0.23 -1.46 0.00 0.00 -0.57 0.00 0.00 31.44 29.64 3hu8 n GLU 22 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3hu8 n GLY 23 N 1.28 0.57 3.82 0.62 0.00 -0.42 -5.06 105.19 106.00 3hu8 n GLY 23 Ca 0.17 -0.40 -0.37 0.00 0.00 0.00 0.00 46.02 45.42 3hu8 n GLY 23 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3hu8 s TYR 24 N -2.00 3.58 0.24 1.61 2.02 -1.26 -4.67 117.35 116.86 3hu8 s TYR 24 Ca 0.00 0.61 -0.31 0.00 -0.37 0.00 0.00 57.07 57.00 3hu8 s TYR 24 Cb 0.00 -2.12 -0.12 0.00 -0.40 0.00 0.00 41.96 39.33 3hu8 s TYR 24 CO 0.00 0.57 1.68 0.71 -1.57 0.00 0.00 175.55 176.93 3hu8 s TYR 25 N -0.57 2.85 0.09 2.71 1.51 -1.20 -0.32 117.35 122.41 3hu8 s TYR 25 Ca 0.16 0.50 -0.09 0.00 -1.01 0.00 0.00 57.07 56.62 3hu8 s TYR 25 Cb -0.13 -4.11 0.00 0.00 -0.11 0.00 0.00 41.96 37.61 3hu8 s TYR 25 CO 0.05 -4.06 0.21 0.99 -1.11 0.00 0.00 175.55 171.62 3hu8 s THR 26 N 0.78 0.13 0.17 -0.71 2.01 0.14 -0.84 115.64 117.33 3hu8 s THR 26 Ca 0.71 -1.11 -0.11 0.00 0.31 0.00 0.00 61.69 61.49 3hu8 s THR 26 Cb -0.49 -1.29 0.00 0.00 0.01 0.00 0.00 72.50 70.74 3hu8 s THR 26 CO 0.37 -0.61 0.35 -0.51 -0.69 0.00 0.00 174.62 173.53 3hu8 s ILE 27 N -3.72 0.05 0.00 1.82 2.07 -0.16 -0.60 121.20 120.65 3hu8 s ILE 27 Ca 0.04 -1.24 0.00 0.00 -1.41 0.00 0.00 60.65 58.04 3hu8 s ILE 27 Cb 0.04 -1.79 0.00 0.00 0.13 0.00 0.00 42.46 40.84 3hu8 s ILE 27 CO -0.10 -0.24 0.00 0.61 -1.91 0.00 0.00 174.94 173.29 3hu8 n GLY 28 N -0.25 1.77 3.04 1.50 0.00 0.11 -0.96 105.19 110.40 3hu8 n GLY 28 Ca -0.08 -0.44 -0.39 0.00 0.00 0.00 0.00 46.02 45.12 3hu8 n GLY 28 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 3hu8 n ILE 29 N 0.00 4.05 -3.19 -0.61 5.41 -1.26 -1.40 119.36 122.36 3hu8 n ILE 29 Ca 0.00 -5.46 -0.23 0.00 1.00 0.00 0.00 62.75 58.06 3hu8 n ILE 29 Cb 0.00 -2.29 0.04 0.00 -0.71 0.00 0.00 39.64 36.67 3hu8 n ILE 29 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 3hu8 n GLY 30 N 1.87 -0.52 3.51 7.39 0.00 -1.24 -4.85 105.19 111.35 3hu8 n GLY 30 Ca 0.25 0.15 -0.43 0.00 0.00 0.00 0.00 46.02 45.99 3hu8 n GLY 30 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 3hu8 s HIS 31 N -3.18 2.71 0.04 1.61 5.04 -0.13 -4.93 115.29 116.45 3hu8 s HIS 31 Ca 0.38 -0.09 -0.31 0.00 -1.54 0.00 0.00 55.06 53.50 3hu8 s HIS 31 Cb -0.17 -4.20 -0.07 0.00 0.04 0.00 0.00 32.58 28.18 3hu8 s HIS 31 CO 0.47 -1.49 1.50 -1.17 -2.34 0.00 0.00 174.74 171.70 3hu8 s LEU 32 N 4.20 4.34 -0.21 8.88 2.96 -1.26 -0.99 118.68 136.60 3hu8 s LEU 32 Ca 0.30 2.29 -0.14 0.00 -0.22 0.00 0.00 54.13 56.36 3hu8 s LEU 32 Cb -0.13 -3.57 -0.19 0.00 0.50 0.00 0.00 46.19 42.81 3hu8 s LEU 32 CO 0.17 -0.78 0.08 0.18 -1.32 0.00 0.00 176.35 174.68 3hu8 n LEU 33 N 5.25 2.20 -3.54 -0.68 4.77 -0.02 -4.95 117.00 120.03 3hu8 n LEU 33 Ca 0.14 0.29 -0.09 0.00 -0.03 0.00 0.00 56.01 56.32 3hu8 n LEU 33 Cb 0.42 -0.97 -0.03 0.00 -2.33 0.00 0.00 43.42 40.51 3hu8 n LEU 33 CO 0.60 0.56 0.73 0.28 -1.33 0.00 0.00 177.39 178.23 3hu8 s THR 34 N -2.46 0.00 -1.52 -5.08 -1.32 -1.17 -4.88 115.64 99.21 3hu8 s THR 34 Ca -0.30 0.00 0.27 0.00 -1.21 0.00 0.00 61.69 60.45 3hu8 s THR 34 Cb 0.08 -1.00 0.26 0.00 -1.51 0.00 0.00 72.50 70.34 3hu8 s THR 34 CO 0.61 0.00 1.64 0.29 -2.21 0.00 0.00 174.62 174.95 3hu8 n LYS 35 N 0.15 0.57 -1.84 7.08 5.02 -1.26 -3.27 118.16 124.62 3hu8 n LYS 35 Ca -0.09 -0.29 -0.42 0.00 -2.02 0.00 0.00 58.31 55.50 3hu8 n LYS 35 Cb 0.60 -1.49 -0.02 0.00 -0.02 0.00 0.00 35.03 34.09 3hu8 n LYS 35 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 3hu8 s SER 36 N -2.63 6.46 0.00 4.39 0.15 -1.26 -4.89 113.70 115.92 3hu8 s SER 36 Ca 0.22 2.84 0.14 0.00 0.70 0.00 0.00 55.95 59.85 3hu8 s SER 36 Cb 0.19 -2.62 0.72 0.00 -1.71 0.00 0.00 66.02 62.60 3hu8 s SER 36 CO 0.55 -0.86 1.35 -0.81 1.20 0.00 0.00 173.24 174.66 3hu8 n PRO 37 N 2.66 0.23 -2.95 5.44 -0.04 -1.26 -4.68 135.00 134.40 3hu8 n PRO 37 Ca 0.10 0.14 -0.43 0.00 -0.04 0.00 0.00 63.50 63.27 3hu8 n PRO 37 Cb 0.38 -1.50 -0.05 0.00 -0.04 0.00 0.00 33.50 32.29 3hu8 n PRO 37 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 3hu8 s ASP 38 N -2.50 6.49 0.41 3.54 2.15 -1.26 -4.93 116.67 120.58 3hu8 s ASP 38 Ca 0.14 0.16 0.09 0.00 0.43 0.00 0.00 52.55 53.37 3hu8 s ASP 38 Cb 0.09 -2.39 0.85 0.00 -0.30 0.00 0.00 42.92 41.17 3hu8 s ASP 38 CO 0.20 -0.82 2.00 0.25 -0.17 0.00 0.00 175.17 176.63 3hu8 h LEU 39 N 9.93 0.33 -0.96 -1.34 5.85 -2.00 -1.95 115.31 125.17 3hu8 h LEU 39 Ca -0.25 -0.03 -0.09 0.00 0.84 0.00 0.00 57.88 58.35 3hu8 h LEU 39 Cb 1.09 -0.09 -0.02 0.00 0.37 0.00 0.00 40.66 42.02 3hu8 h LEU 39 CO 0.94 0.34 -0.16 0.78 -0.34 0.00 0.00 178.44 180.00 3hu8 h ASN 40 N 0.37 0.56 -0.53 1.25 2.35 -1.97 -0.11 115.58 117.50 3hu8 h ASN 40 Ca 0.09 -0.17 -0.09 0.00 -0.55 0.00 0.00 56.30 55.59 3hu8 h ASN 40 Cb 0.14 -0.15 -0.02 0.00 0.05 0.00 0.00 38.32 38.34 3hu8 h ASN 40 CO -0.00 0.74 0.00 0.00 -1.65 0.00 0.00 177.43 176.52 3hu8 h ALA 41 N 1.31 0.94 -0.47 -0.83 0.00 -1.76 -0.24 119.26 118.21 3hu8 h ALA 41 Ca 0.09 -0.29 -0.06 0.00 0.00 0.00 0.00 54.91 54.64 3hu8 h ALA 41 Cb 0.58 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.13 3hu8 h ALA 41 CO 0.04 0.64 0.06 0.00 0.00 0.00 0.00 179.25 179.99 3hu8 h ALA 42 N 1.10 0.62 -0.67 0.00 0.00 -1.12 -1.38 119.26 117.81 3hu8 h ALA 42 Ca 0.16 -0.24 -0.06 0.00 0.00 0.00 0.00 54.91 54.77 3hu8 h ALA 42 Cb 0.52 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 18.10 3hu8 h ALA 42 CO 0.03 0.37 0.18 0.87 0.00 0.00 0.00 179.25 180.69 3hu8 h LYS 43 N 0.65 1.05 -0.26 0.00 1.57 -0.80 0.10 116.57 118.88 3hu8 h LYS 43 Ca 0.14 -0.23 -0.01 0.00 -1.87 0.00 0.00 60.65 58.68 3hu8 h LYS 43 Cb 0.41 -0.15 -0.01 0.00 0.08 0.00 0.00 32.23 32.56 3hu8 h LYS 43 CO 0.01 0.92 0.13 1.03 -0.57 0.00 0.00 179.45 180.97 3hu8 h SER 44 N 1.00 0.33 -0.95 0.86 0.87 -0.86 -1.44 113.55 113.36 3hu8 h SER 44 Ca 0.21 -0.10 0.03 0.00 -1.23 0.00 0.00 61.79 60.70 3hu8 h SER 44 Cb 0.33 -0.08 -0.05 0.00 -0.44 0.00 0.00 62.40 62.15 3hu8 h SER 44 CO -0.00 0.33 0.63 -0.33 -0.53 0.00 0.00 176.83 176.93 3hu8 h GLU 45 N 0.29 1.18 -0.06 2.24 4.39 -0.94 -1.02 114.58 120.67 3hu8 h GLU 45 Ca 0.09 -0.07 -0.00 0.00 0.34 0.00 0.00 59.36 59.72 3hu8 h GLU 45 Cb 0.09 -0.27 -0.00 0.00 -0.10 0.00 0.00 28.75 28.47 3hu8 h GLU 45 CO -0.01 0.78 0.03 1.25 -1.16 0.00 0.00 179.01 179.90 3hu8 h LEU 46 N 1.22 0.07 -1.00 1.33 5.85 -0.64 0.09 115.31 122.24 3hu8 h LEU 46 Ca 0.37 -0.10 -0.02 0.00 0.84 0.00 0.00 57.88 58.97 3hu8 h LEU 46 Cb -0.03 -0.02 -0.04 0.00 0.37 0.00 0.00 40.66 40.95 3hu8 h LEU 46 CO -0.11 0.15 0.43 0.44 -0.34 0.00 0.00 178.44 179.01 3hu8 h ASP 47 N -0.01 1.02 -0.69 1.25 3.32 -0.84 -1.10 116.42 119.36 3hu8 h ASP 47 Ca 0.02 -0.10 -0.07 0.00 0.02 0.00 0.00 57.03 56.91 3hu8 h ASP 47 Cb 0.10 -0.26 -0.03 0.00 0.22 0.00 0.00 39.33 39.36 3hu8 h ASP 47 CO -0.00 0.83 0.18 0.50 -1.72 0.00 0.00 179.24 179.02 3hu8 h LYS 48 N 1.14 1.11 -0.23 3.56 3.64 -0.94 0.16 116.57 125.00 3hu8 h LYS 48 Ca 0.28 -0.26 -0.15 0.00 -1.27 0.00 0.00 60.65 59.25 3hu8 h LYS 48 Cb 0.05 -0.15 -0.01 0.00 -0.41 0.00 0.00 32.23 31.72 3hu8 h LYS 48 CO -0.04 0.97 -0.49 0.00 -2.27 0.00 0.00 179.45 177.62 3hu8 h ALA 49 N 1.08 0.71 0.00 5.00 0.00 -0.19 -3.26 119.26 122.61 3hu8 h ALA 49 Ca 0.22 -0.48 -0.25 0.00 0.00 0.00 0.00 54.91 54.39 3hu8 h ALA 49 Cb 0.36 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 18.01 3hu8 h ALA 49 CO 0.00 0.67 -1.71 -0.89 0.00 0.00 0.00 179.25 177.33 3hu8 n ILE 50 N -3.99 1.41 -0.87 0.00 2.08 -0.49 -4.99 119.36 112.50 3hu8 n ILE 50 Ca -0.03 -0.76 0.00 0.00 0.56 0.00 0.00 62.75 62.52 3hu8 n ILE 50 Cb 0.57 -0.85 0.00 0.00 -0.75 0.00 0.00 39.64 38.62 3hu8 n ILE 50 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 3hu8 n GLY 51 N 1.52 0.62 3.60 7.39 0.00 0.55 -5.06 105.19 113.81 3hu8 n GLY 51 Ca -0.16 -0.75 -0.09 0.00 0.00 0.00 0.00 46.02 45.02 3hu8 n GLY 51 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 3hu8 s ARG 52 N -1.81 1.53 -0.66 1.61 1.70 -1.13 -5.05 118.95 115.15 3hu8 s ARG 52 Ca 0.00 -1.16 -0.27 0.00 -0.47 0.00 0.00 55.73 53.83 3hu8 s ARG 52 Cb 0.00 0.49 0.02 0.00 -0.57 0.00 0.00 34.95 34.89 3hu8 s ARG 52 CO 0.00 -0.64 1.39 -0.80 -1.08 0.00 0.00 175.30 174.17 3hu8 s ASN 53 N -2.98 6.05 0.19 -2.89 -0.87 -1.26 -4.34 114.94 108.84 3hu8 s ASN 53 Ca 0.19 -0.09 0.22 0.00 -1.57 0.00 0.00 52.86 51.61 3hu8 s ASN 53 Cb -0.01 -2.55 -0.02 0.00 -0.02 0.00 0.00 41.25 38.65 3hu8 s ASN 53 CO 0.06 -1.85 1.02 0.00 -2.57 0.00 0.00 177.10 173.76 3hu8 n ASN 55 N -2.67 -2.64 -0.48 0.00 3.02 -1.26 -1.99 115.26 109.24 3hu8 n ASN 55 Ca -0.00 -0.87 -0.06 0.00 -0.03 0.00 0.00 54.58 53.62 3hu8 n ASN 55 Cb 0.56 -3.62 -0.03 0.00 -0.61 0.00 0.00 39.78 36.08 3hu8 n ASN 55 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3hu8 n GLY 56 N -1.68 0.81 2.86 7.41 0.00 -1.26 -4.99 105.19 108.33 3hu8 n GLY 56 Ca -0.12 -0.32 -0.15 0.00 0.00 0.00 0.00 46.02 45.43 3hu8 n GLY 56 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3hu8 s VAL 57 N -2.02 0.14 0.31 1.61 1.01 -0.84 -1.44 120.40 119.17 3hu8 s VAL 57 Ca 0.00 -0.00 0.03 0.00 0.00 0.00 0.00 61.98 62.01 3hu8 s VAL 57 Cb 0.00 -0.18 -0.06 0.00 0.00 0.00 0.00 36.38 36.14 3hu8 s VAL 57 CO 0.00 0.08 0.07 0.27 0.00 0.00 0.00 175.10 175.52 3hu8 s ILE 58 N 0.41 1.03 0.50 2.22 -4.36 -0.08 -4.72 121.20 116.19 3hu8 s ILE 58 Ca -0.04 -2.00 0.01 0.00 -0.26 0.00 0.00 60.65 58.37 3hu8 s ILE 58 Cb -0.06 -2.74 0.02 0.00 1.25 0.00 0.00 42.46 40.92 3hu8 s ILE 58 CO -0.01 0.00 0.71 0.42 0.24 0.00 0.00 174.94 176.30 3hu8 s THR 59 N -3.39 3.26 0.23 8.37 -4.23 -1.26 -4.76 115.64 113.85 3hu8 s THR 59 Ca 0.36 -0.63 -0.08 0.00 -1.18 0.00 0.00 61.69 60.17 3hu8 s THR 59 Cb 0.08 -3.20 0.21 0.00 1.34 0.00 0.00 72.50 70.93 3hu8 s THR 59 CO 0.15 -0.14 1.89 0.50 -0.54 0.00 0.00 174.62 176.49 3hu8 h LYS 60 N 0.26 1.11 -0.54 3.99 3.64 -1.99 -0.57 116.57 122.48 3hu8 h LYS 60 Ca -0.44 -0.07 0.00 0.00 -1.27 0.00 0.00 60.65 58.88 3hu8 h LYS 60 Cb 1.28 -0.25 -0.03 0.00 -0.41 0.00 0.00 32.23 32.82 3hu8 h LYS 60 CO 0.54 0.74 0.34 -0.44 -2.27 0.00 0.00 179.45 178.35 3hu8 h ASP 61 N 1.14 0.63 -0.70 4.20 5.19 -1.99 -0.17 116.42 124.73 3hu8 h ASP 61 Ca 0.33 -0.04 -0.07 0.00 -0.62 0.00 0.00 57.03 56.64 3hu8 h ASP 61 Cb -0.08 -0.16 -0.03 0.00 0.18 0.00 0.00 39.33 39.25 3hu8 h ASP 61 CO -0.09 0.48 0.18 -0.33 -3.12 0.00 0.00 179.24 176.36 3hu8 h GLU 62 N 0.72 1.12 -0.47 3.56 5.08 -1.85 -0.04 114.58 122.71 3hu8 h GLU 62 Ca 0.19 -0.26 0.00 0.00 -1.00 0.00 0.00 59.36 58.30 3hu8 h GLU 62 Cb -0.05 -0.15 -0.02 0.00 0.50 0.00 0.00 28.75 29.02 3hu8 h GLU 62 CO -0.04 0.98 0.29 0.00 -1.00 0.00 0.00 179.01 179.24 3hu8 h ALA 63 N 1.12 0.59 -0.07 3.43 0.00 -0.57 -2.00 119.26 121.77 3hu8 h ALA 63 Ca 0.22 -0.05 -0.12 0.00 0.00 0.00 0.00 54.91 54.97 3hu8 h ALA 63 Cb 0.36 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 3hu8 h ALA 63 CO 0.00 0.06 -0.48 0.93 0.00 0.00 0.00 179.25 179.76 3hu8 h GLU 64 N 0.63 0.18 0.11 0.00 5.08 -0.71 -0.50 114.58 119.37 3hu8 h GLU 64 Ca 0.17 -0.10 -0.01 0.00 -1.00 0.00 0.00 59.36 58.43 3hu8 h GLU 64 Cb -0.04 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.22 3hu8 h GLU 64 CO -0.03 0.63 -0.05 -0.22 -1.00 0.00 0.00 179.01 178.33 3hu8 h LYS 65 N 0.15 -0.15 -0.93 2.33 3.64 -0.64 -0.14 116.57 120.82 3hu8 h LYS 65 Ca 0.01 0.01 0.03 0.00 -1.27 0.00 0.00 60.65 59.43 3hu8 h LYS 65 Cb 0.91 0.03 -0.05 0.00 -0.41 0.00 0.00 32.23 32.71 3hu8 h LYS 65 CO 0.07 -0.07 0.61 -0.07 -2.27 0.00 0.00 179.45 177.72 3hu8 h LEU 66 N -0.18 1.02 -0.20 5.20 3.38 -1.20 -1.74 115.31 121.59 3hu8 h LEU 66 Ca -0.02 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.94 3hu8 h LEU 66 Cb 0.14 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.65 3hu8 h LEU 66 CO 0.03 0.71 0.13 0.15 0.09 0.00 0.00 178.44 179.54 3hu8 h PHE 67 N 1.19 0.26 -0.67 1.13 3.57 -0.80 0.20 116.94 121.81 3hu8 h PHE 67 Ca 0.37 0.00 0.03 0.00 3.53 0.00 0.00 57.97 61.90 3hu8 h PHE 67 Cb -0.02 -0.09 -0.04 0.00 2.79 0.00 0.00 35.95 38.59 3hu8 h PHE 67 CO -0.01 0.19 0.42 -0.97 -2.23 0.00 0.00 178.31 175.70 3hu8 h ASN 68 N 0.26 0.68 -0.61 0.41 -0.73 -0.73 0.12 115.58 114.97 3hu8 h ASN 68 Ca 0.07 0.00 -0.00 0.00 1.87 0.00 0.00 56.30 58.24 3hu8 h ASN 68 Cb -0.00 -0.14 -0.03 0.00 0.27 0.00 0.00 38.32 38.41 3hu8 h ASN 68 CO -0.01 0.47 0.37 1.56 -0.37 0.00 0.00 177.43 179.45 3hu8 h GLN 69 N 0.81 0.83 -0.27 6.67 4.20 -0.81 -1.36 115.11 125.19 3hu8 h GLN 69 Ca 0.27 -0.08 -0.06 0.00 0.06 0.00 0.00 58.65 58.84 3hu8 h GLN 69 Cb 0.03 -0.17 -0.01 0.00 0.30 0.00 0.00 27.48 27.63 3hu8 h GLN 69 CO -0.11 0.60 -0.08 -0.44 -0.67 0.00 0.00 178.83 178.12 3hu8 h ASP 70 N 0.83 0.53 -0.07 1.46 3.32 0.06 0.62 116.42 123.17 3hu8 h ASP 70 Ca 0.22 -0.38 -0.00 0.00 0.02 0.00 0.00 57.03 56.89 3hu8 h ASP 70 Cb -0.02 -0.15 -0.00 0.00 0.22 0.00 0.00 39.33 39.38 3hu8 h ASP 70 CO -0.04 0.79 0.04 0.58 -1.72 0.00 0.00 179.24 178.89 3hu8 h VAL 71 N 0.27 1.09 -0.73 -1.35 2.07 -0.75 -0.31 116.25 116.54 3hu8 h VAL 71 Ca 0.07 -0.24 0.05 0.00 0.82 0.00 0.00 66.70 67.39 3hu8 h VAL 71 Cb 0.57 1.12 -0.05 0.00 -1.52 0.00 0.00 31.29 31.41 3hu8 h VAL 71 CO 0.03 0.07 0.44 -0.78 0.02 0.00 0.00 177.57 177.36 3hu8 h ASP 72 N 0.02 0.70 -0.44 0.57 3.58 -1.11 -1.60 116.42 118.13 3hu8 h ASP 72 Ca 0.02 0.01 -0.07 0.00 0.42 0.00 0.00 57.03 57.42 3hu8 h ASP 72 Cb 0.09 -0.13 -0.02 0.00 1.72 0.00 0.00 39.33 40.98 3hu8 h ASP 72 CO -0.00 0.47 0.03 0.00 -2.88 0.00 0.00 179.24 176.85 3hu8 h ALA 73 N 1.34 1.09 -0.16 -0.78 0.00 -0.57 0.97 119.26 121.15 3hu8 h ALA 73 Ca 0.31 -0.26 -0.00 0.00 0.00 0.00 0.00 54.91 54.96 3hu8 h ALA 73 Cb 0.11 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 3hu8 h ALA 73 CO -0.15 0.58 0.10 0.00 0.00 0.00 0.00 179.25 179.78 3hu8 h ALA 74 N 1.24 0.21 0.14 0.00 0.00 -0.45 0.46 119.26 120.86 3hu8 h ALA 74 Ca 0.16 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.03 3hu8 h ALA 74 Cb 0.43 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.16 3hu8 h ALA 74 CO 0.02 -0.28 -0.07 0.28 0.00 0.00 0.00 179.25 179.20 3hu8 h VAL 75 N 0.20 0.93 -0.60 0.00 2.07 -0.90 -1.79 116.25 116.16 3hu8 h VAL 75 Ca 0.06 -0.28 -0.00 0.00 0.82 0.00 0.00 66.70 67.30 3hu8 h VAL 75 Cb 0.02 1.11 -0.03 0.00 -1.52 0.00 0.00 31.29 30.87 3hu8 h VAL 75 CO -0.01 0.07 0.37 0.03 0.02 0.00 0.00 177.57 178.05 3hu8 h ARG 76 N -0.31 0.80 -0.17 1.57 2.47 -0.75 -1.27 114.38 116.72 3hu8 h ARG 76 Ca -0.02 -0.06 -0.00 0.00 -1.26 0.00 0.00 59.98 58.64 3hu8 h ARG 76 Cb 0.25 -0.18 -0.01 0.00 -1.65 0.00 0.00 29.97 28.39 3hu8 h ARG 76 CO 0.03 0.55 0.09 0.78 0.56 0.00 0.00 179.97 181.99 3hu8 h GLY 77 N 0.85 0.25 0.30 0.04 0.00 -0.70 -1.86 103.07 101.95 3hu8 h GLY 77 Ca 0.22 -0.11 0.06 0.00 0.00 0.00 0.00 47.33 47.50 3hu8 h GLY 77 CO -0.04 0.11 -0.12 -2.22 0.00 0.00 0.00 176.54 174.26 3hu8 h ILE 78 N 0.17 0.60 0.00 2.60 2.04 -0.71 -1.72 117.51 120.50 3hu8 h ILE 78 Ca 0.06 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.91 3hu8 h ILE 78 Cb 0.06 0.60 -0.00 0.00 -0.74 0.00 0.00 36.82 36.74 3hu8 h ILE 78 CO -0.01 0.00 -0.03 -0.07 0.00 0.00 0.00 178.15 178.04 3hu8 h LEU 79 N -0.07 0.00 0.00 1.44 3.38 -1.04 -0.99 115.31 118.03 3hu8 h LEU 79 Ca 0.15 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.12 3hu8 h LEU 79 Cb 0.30 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.05 3hu8 h LEU 79 CO -0.34 0.03 -0.29 0.54 0.09 0.00 0.00 178.44 178.47 3hu8 n ARG 80 N -4.27 0.02 -3.27 1.13 1.74 -0.72 -4.79 116.66 106.49 3hu8 n ARG 80 Ca -0.03 0.01 -0.42 0.00 -0.77 0.00 0.00 57.85 56.64 3hu8 n ARG 80 Cb 0.12 -1.51 -0.08 0.00 -1.02 0.00 0.00 32.46 29.96 3hu8 n ARG 80 CO 0.00 0.00 0.00 1.21 -1.52 0.00 0.00 177.63 177.32 3hu8 s ASN 81 N -3.08 6.28 0.60 0.55 3.84 -0.38 -4.94 114.94 117.81 3hu8 s ASN 81 Ca 0.12 -0.17 0.31 0.00 0.21 0.00 0.00 52.86 53.34 3hu8 s ASN 81 Cb 0.18 -2.25 1.88 0.00 -0.55 0.00 0.00 41.25 40.50 3hu8 s ASN 81 CO 0.63 -0.49 2.26 0.00 -2.79 0.00 0.00 177.10 176.71 3hu8 h ALA 82 N 8.52 1.45 0.07 1.71 0.00 -1.87 0.11 119.26 129.26 3hu8 h ALA 82 Ca -0.28 -0.01 -0.29 0.00 0.00 0.00 0.00 54.91 54.34 3hu8 h ALA 82 Cb 1.12 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.89 3hu8 h ALA 82 CO 0.77 0.01 -1.50 0.87 0.00 0.00 0.00 179.25 179.40 3hu8 h LYS 83 N 0.00 0.15 0.10 0.00 1.57 -1.92 -3.40 116.57 113.08 3hu8 h LYS 83 Ca -0.00 -0.26 -0.33 0.00 -1.87 0.00 0.00 60.65 58.19 3hu8 h LYS 83 Cb 0.02 0.10 -0.02 0.00 0.08 0.00 0.00 32.23 32.41 3hu8 h LYS 83 CO 0.00 0.96 -1.79 -0.07 -0.57 0.00 0.00 179.45 177.99 3hu8 h LEU 84 N 0.04 0.35 -0.27 2.94 3.38 -1.56 -3.40 115.31 116.79 3hu8 h LEU 84 Ca -0.22 -0.64 0.04 0.00 0.09 0.00 0.00 57.88 57.15 3hu8 h LEU 84 Cb 1.97 -0.11 -0.04 0.00 0.09 0.00 0.00 40.66 42.57 3hu8 h LEU 84 CO 0.13 1.56 0.02 0.50 0.09 0.00 0.00 178.44 180.74 3hu8 h LYS 85 N 0.06 0.10 -0.35 1.13 3.64 -0.75 0.20 116.57 120.60 3hu8 h LYS 85 Ca -0.34 -0.01 -0.04 0.00 -1.27 0.00 0.00 60.65 58.99 3hu8 h LYS 85 Cb 2.03 -0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 33.81 3hu8 h LYS 85 CO 0.12 0.07 0.03 -1.00 -2.27 0.00 0.00 179.45 176.40 3hu8 h PRO 86 N 0.10 0.53 -0.09 1.90 0.13 -1.79 0.21 132.00 133.00 3hu8 h PRO 86 Ca 0.13 -0.10 -0.03 0.00 -0.87 0.00 0.00 66.00 65.13 3hu8 h PRO 86 Cb 0.15 -0.08 -0.00 0.00 0.13 0.00 0.00 31.00 31.20 3hu8 h PRO 86 CO -0.20 0.53 -0.04 0.28 -0.23 0.00 0.00 178.00 178.34 3hu8 h VAL 87 N 0.52 1.32 -0.48 1.56 2.07 -1.64 -1.91 116.25 117.69 3hu8 h VAL 87 Ca 0.12 -1.06 0.07 0.00 0.82 0.00 0.00 66.70 66.64 3hu8 h VAL 87 Cb 0.28 1.84 -0.06 0.00 -1.52 0.00 0.00 31.29 31.83 3hu8 h VAL 87 CO 0.00 0.30 0.17 0.22 0.02 0.00 0.00 177.57 178.28 3hu8 h TYR 88 N -0.18 0.30 0.00 1.57 3.20 -0.67 -1.64 116.97 119.55 3hu8 h TYR 88 Ca 0.02 0.02 -0.01 0.00 3.14 0.00 0.00 58.73 61.91 3hu8 h TYR 88 Cb 0.49 -0.06 -0.00 0.00 1.54 0.00 0.00 36.73 38.70 3hu8 h TYR 88 CO 0.07 0.10 -0.04 -0.44 -1.64 0.00 0.00 178.16 176.20 3hu8 h ASP 89 N 0.34 0.00 1.52 -2.11 3.32 -0.51 -2.13 116.42 116.85 3hu8 h ASP 89 Ca 0.23 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 57.26 3hu8 h ASP 89 Cb 0.24 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.79 3hu8 h ASP 89 CO -0.24 0.04 -0.10 0.77 -1.72 0.00 0.00 179.24 177.99 3hu8 h SER 90 N 0.00 0.00 -3.96 6.45 4.64 -0.46 -3.46 113.55 116.76 3hu8 h SER 90 Ca -0.00 0.00 -0.48 0.00 -0.47 0.00 0.00 61.79 60.84 3hu8 h SER 90 Cb 0.50 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.60 3hu8 h SER 90 CO 0.01 0.10 0.25 -0.76 -0.87 0.00 0.00 176.83 175.56 3hu8 s LEU 91 N -6.32 3.71 0.92 5.97 1.43 -0.80 -5.08 118.68 118.52 3hu8 s LEU 91 Ca 0.04 1.35 -0.12 0.00 -1.03 0.00 0.00 54.13 54.37 3hu8 s LEU 91 Cb 0.07 -4.27 0.14 0.00 0.03 0.00 0.00 46.19 42.17 3hu8 s LEU 91 CO 0.64 -0.51 1.11 1.51 0.23 0.00 0.00 176.35 179.34 3hu8 s ASP 92 N -3.16 3.34 0.36 2.29 1.47 -1.26 -4.81 116.67 114.90 3hu8 s ASP 92 Ca 0.55 1.12 0.04 0.00 1.18 0.00 0.00 52.55 55.44 3hu8 s ASP 92 Cb -0.10 -1.75 0.67 0.00 -0.34 0.00 0.00 42.92 41.39 3hu8 s ASP 92 CO 0.32 -2.67 1.95 0.00 0.68 0.00 0.00 175.17 175.45 3hu8 h ALA 93 N -1.58 1.49 -0.13 2.11 0.00 -1.97 -0.43 119.26 118.76 3hu8 h ALA 93 Ca -0.51 -0.12 -0.11 0.00 0.00 0.00 0.00 54.91 54.17 3hu8 h ALA 93 Cb 1.32 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.93 3hu8 h ALA 93 CO 0.60 0.40 -0.33 0.28 0.00 0.00 0.00 179.25 180.19 3hu8 h VAL 94 N 0.61 1.37 -0.27 0.00 2.07 -1.94 -2.62 116.25 115.48 3hu8 h VAL 94 Ca 0.15 -1.63 -0.08 0.00 0.82 0.00 0.00 66.70 65.96 3hu8 h VAL 94 Cb 0.13 2.08 -0.01 0.00 -1.52 0.00 0.00 31.29 31.97 3hu8 h VAL 94 CO -0.01 0.48 -0.18 0.03 0.02 0.00 0.00 177.57 177.91 3hu8 h ARG 95 N 0.04 0.48 -0.86 1.57 3.08 -1.72 -1.00 114.38 115.96 3hu8 h ARG 95 Ca -0.01 -0.15 0.14 0.00 0.07 0.00 0.00 59.98 60.03 3hu8 h ARG 95 Cb 0.94 -0.04 -0.07 0.00 0.08 0.00 0.00 29.97 30.88 3hu8 h ARG 95 CO 0.07 0.64 0.56 0.00 -1.07 0.00 0.00 179.97 180.17 3hu8 h ARG 96 N 0.43 0.63 -0.58 0.04 3.08 -0.99 -1.30 114.38 115.69 3hu8 h ARG 96 Ca 0.07 -0.04 -0.07 0.00 0.07 0.00 0.00 59.98 60.02 3hu8 h ARG 96 Cb 0.57 -0.14 -0.02 0.00 0.08 0.00 0.00 29.97 30.45 3hu8 h ARG 96 CO 0.04 0.42 0.09 0.00 -1.07 0.00 0.00 179.97 179.44 3hu8 h ALA 98 N 1.21 0.98 -0.48 0.00 0.00 -1.04 -0.33 119.26 119.61 3hu8 h ALA 98 Ca 0.18 -0.12 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 3hu8 h ALA 98 Cb 0.39 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.85 3hu8 h ALA 98 CO 0.01 0.50 0.26 0.00 0.00 0.00 0.00 179.25 180.02 3hu8 h ALA 99 N 1.22 0.62 -0.50 0.00 0.00 -0.80 -0.73 119.26 119.06 3hu8 h ALA 99 Ca 0.27 -0.10 -0.05 0.00 0.00 0.00 0.00 54.91 55.03 3hu8 h ALA 99 Cb 0.04 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.62 3hu8 h ALA 99 CO -0.04 0.16 0.10 0.82 0.00 0.00 0.00 179.25 180.28 3hu8 h ILE 100 N 0.64 1.25 -0.13 0.00 2.04 -0.84 -1.70 117.51 118.77 3hu8 h ILE 100 Ca 0.17 -0.89 0.03 0.00 1.00 0.00 0.00 64.86 65.17 3hu8 h ILE 100 Cb 0.07 0.86 -0.03 0.00 -0.74 0.00 0.00 36.82 36.98 3hu8 h ILE 100 CO -0.03 0.32 -0.08 -1.13 0.00 0.00 0.00 178.15 177.24 3hu8 h ASN 101 N 0.69 -0.25 -0.63 1.72 -0.73 -0.84 0.16 115.58 115.71 3hu8 h ASN 101 Ca 0.15 0.06 -0.01 0.00 1.87 0.00 0.00 56.30 58.37 3hu8 h ASN 101 Cb 0.37 0.13 -0.03 0.00 0.27 0.00 0.00 38.32 39.06 3hu8 h ASN 101 CO 0.01 -0.10 0.36 -0.61 -0.37 0.00 0.00 177.43 176.71 3hu8 h GLN 102 N -0.07 0.87 -0.55 6.67 4.15 -0.93 -0.86 115.11 124.38 3hu8 h GLN 102 Ca 0.08 -0.10 -0.07 0.00 0.77 0.00 0.00 58.65 59.33 3hu8 h GLN 102 Cb 0.19 -0.17 -0.02 0.00 0.21 0.00 0.00 27.48 27.68 3hu8 h GLN 102 CO -0.18 0.65 0.07 0.28 -1.93 0.00 0.00 178.83 177.72 3hu8 h VAL 103 N 0.86 1.26 -0.43 2.39 2.07 -1.02 0.32 116.25 121.69 3hu8 h VAL 103 Ca 0.22 -1.00 0.08 0.00 0.82 0.00 0.00 66.70 66.82 3hu8 h VAL 103 Cb 0.02 0.83 -0.07 0.00 -1.52 0.00 0.00 31.29 30.55 3hu8 h VAL 103 CO -0.04 0.36 0.02 0.15 0.02 0.00 0.00 177.57 178.09 3hu8 h PHE 104 N 0.82 0.02 -0.05 1.57 3.57 -0.35 0.60 116.94 123.11 3hu8 h PHE 104 Ca 0.17 0.03 -0.02 0.00 3.53 0.00 0.00 57.97 61.67 3hu8 h PHE 104 Cb 0.44 0.06 -0.00 0.00 2.79 0.00 0.00 35.95 39.24 3hu8 h PHE 104 CO 0.03 -0.07 -0.06 0.37 -2.23 0.00 0.00 178.31 176.35 3hu8 h GLN 105 N 0.13 0.13 0.00 1.11 4.15 -0.88 -3.38 115.11 116.38 3hu8 h GLN 105 Ca 0.21 -0.08 0.00 0.00 0.77 0.00 0.00 58.65 59.56 3hu8 h GLN 105 Cb 0.30 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.00 3hu8 h GLN 105 CO -0.34 0.61 -1.74 -1.33 -1.93 0.00 0.00 178.83 174.10 3hu8 n MET 106 N -4.73 0.62 -0.10 1.69 2.81 0.08 -5.11 117.12 112.38 3hu8 n MET 106 Ca -0.08 -0.15 0.01 0.00 -1.81 0.00 0.00 57.70 55.67 3hu8 n MET 106 Cb 0.31 -1.44 -0.01 0.00 -0.71 0.00 0.00 33.22 31.37 3hu8 n MET 106 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3hu8 n GLY 107 N 1.43 -2.32 0.35 3.03 0.00 0.21 -2.62 105.19 105.27 3hu8 n GLY 107 Ca -0.03 -1.45 0.01 0.00 0.00 0.00 0.00 46.02 44.55 3hu8 n GLY 107 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3hu8 h GLU 108 N -0.09 1.09 -0.47 1.61 5.08 -1.91 -1.54 114.58 118.35 3hu8 h GLU 108 Ca -0.01 -0.07 0.01 0.00 -1.00 0.00 0.00 59.36 58.30 3hu8 h GLU 108 Cb 0.09 -0.25 -0.03 0.00 0.50 0.00 0.00 28.75 29.07 3hu8 h GLU 108 CO 0.00 0.72 0.29 1.15 -1.00 0.00 0.00 179.01 180.17 3hu8 h THR 109 N 1.12 1.08 -0.30 1.13 2.02 -1.97 -2.60 112.91 113.39 3hu8 h THR 109 Ca 0.40 -0.20 0.07 0.00 0.77 0.00 0.00 66.41 67.44 3hu8 h THR 109 Cb 0.11 0.44 -0.07 0.00 -1.74 0.00 0.00 68.15 66.89 3hu8 h THR 109 CO -0.16 0.11 -0.14 1.23 0.37 0.00 0.00 175.52 176.93 3hu8 h GLY 110 N 0.59 0.11 -0.04 2.16 0.00 -1.16 -3.38 103.07 101.35 3hu8 h GLY 110 Ca 0.18 0.18 -0.02 0.00 0.00 0.00 0.00 47.33 47.67 3hu8 h GLY 110 CO -0.07 -0.16 0.00 -0.62 0.00 0.00 0.00 176.54 175.70 3hu8 n VAL 111 N -5.32 0.00 0.00 4.60 0.31 -0.63 -3.74 118.33 113.55 3hu8 n VAL 111 Ca 0.00 -0.02 0.00 0.00 -0.01 0.00 0.00 64.34 64.31 3hu8 n VAL 111 Cb 0.23 -0.88 0.00 0.00 -0.91 0.00 0.00 33.84 32.28 3hu8 n VAL 111 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3hu8 n ALA 112 N -3.09 0.00 0.40 3.52 0.00 -1.25 -4.49 120.51 115.61 3hu8 n ALA 112 Ca -0.01 0.00 0.08 0.00 0.00 0.00 0.00 53.44 53.51 3hu8 n ALA 112 Cb 0.03 0.00 0.35 0.00 0.00 0.00 0.00 19.45 19.83 3hu8 n ALA 112 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3hu8 n GLY 113 N 0.00 -1.03 2.17 0.00 0.00 -1.25 -3.76 105.19 101.32 3hu8 n GLY 113 Ca 0.00 0.01 -0.22 0.00 0.00 0.00 0.00 46.02 45.81 3hu8 n GLY 113 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3hu8 n PHE 114 N -1.77 2.93 -0.24 1.61 3.01 -1.26 -4.68 117.46 117.06 3hu8 n PHE 114 Ca 0.02 -1.76 0.05 0.00 1.01 0.00 0.00 57.45 56.77 3hu8 n PHE 114 Cb 0.16 -0.91 0.17 0.00 -0.01 0.00 0.00 39.48 38.90 3hu8 n PHE 114 CO 0.00 0.00 0.00 1.15 1.01 0.00 0.00 176.76 178.92 3hu8 h THR 115 N 1.08 0.60 -0.31 4.37 2.02 -1.96 0.64 112.91 119.34 3hu8 h THR 115 Ca 0.59 -0.12 -0.17 0.00 0.77 0.00 0.00 66.41 67.48 3hu8 h THR 115 Cb 2.78 0.22 -0.00 0.00 -1.74 0.00 0.00 68.15 69.41 3hu8 h THR 115 CO 1.05 0.06 -0.49 0.78 0.37 0.00 0.00 175.52 177.29 3hu8 h ASN 116 N 0.35 0.97 -0.46 4.18 2.35 -1.94 -1.77 115.58 119.26 3hu8 h ASN 116 Ca 0.40 -0.51 -0.01 0.00 -0.55 0.00 0.00 56.30 55.62 3hu8 h ASN 116 Cb 0.63 -0.28 -0.02 0.00 0.05 0.00 0.00 38.32 38.70 3hu8 h ASN 116 CO -0.44 1.30 0.23 0.28 -1.65 0.00 0.00 177.43 177.15 3hu8 h SER 117 N 0.68 0.59 -0.56 5.81 0.02 -1.69 -2.11 113.55 116.29 3hu8 h SER 117 Ca 0.03 -0.12 0.04 0.00 -0.84 0.00 0.00 61.79 60.90 3hu8 h SER 117 Cb 1.09 -0.15 -0.04 0.00 0.14 0.00 0.00 62.40 63.44 3hu8 h SER 117 CO 0.11 0.55 0.31 -0.07 -1.14 0.00 0.00 176.83 176.59 3hu8 h LEU 118 N 0.60 0.48 -0.47 5.07 3.38 -0.78 0.84 115.31 124.43 3hu8 h LEU 118 Ca 0.16 0.02 -0.00 0.00 0.09 0.00 0.00 57.88 58.14 3hu8 h LEU 118 Cb 0.10 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 40.75 3hu8 h LEU 118 CO -0.02 0.33 0.28 -0.09 0.09 0.00 0.00 178.44 179.03 3hu8 h ARG 119 N 0.61 0.65 -0.60 1.13 2.43 -1.18 0.61 114.38 118.03 3hu8 h ARG 119 Ca 0.24 -0.06 -0.07 0.00 -0.81 0.00 0.00 59.98 59.27 3hu8 h ARG 119 Cb 0.10 -0.13 -0.02 0.00 -0.42 0.00 0.00 29.97 29.49 3hu8 h ARG 119 CO -0.14 0.49 0.08 0.52 -1.51 0.00 0.00 179.97 179.41 3hu8 h MET 120 N 0.63 0.98 -0.50 0.20 2.86 -0.93 -0.77 114.93 117.40 3hu8 h MET 120 Ca 0.17 -0.25 -0.05 0.00 -2.06 0.00 0.00 59.70 57.51 3hu8 h MET 120 Cb 0.01 -0.12 -0.02 0.00 0.06 0.00 0.00 31.60 31.53 3hu8 h MET 120 CO -0.03 0.91 0.14 -0.07 1.06 0.00 0.00 176.91 178.92 3hu8 h LEU 121 N 0.92 0.75 -1.25 1.22 3.38 -0.59 -0.90 115.31 118.83 3hu8 h LEU 121 Ca 0.18 -0.22 -0.05 0.00 0.09 0.00 0.00 57.88 57.88 3hu8 h LEU 121 Cb 0.42 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.96 3hu8 h LEU 121 CO 0.01 0.77 -0.07 -0.61 0.09 0.00 0.00 178.44 178.64 3hu8 h GLN 122 N 0.69 0.43 0.00 1.13 4.15 -0.51 -0.88 115.11 120.12 3hu8 h GLN 122 Ca 0.16 -0.10 0.00 0.00 0.77 0.00 0.00 58.65 59.48 3hu8 h GLN 122 Cb 0.31 -0.06 0.00 0.00 0.21 0.00 0.00 27.48 27.94 3hu8 h GLN 122 CO -0.00 0.51 0.00 1.04 -1.93 0.00 0.00 178.83 178.45 3hu8 n GLN 123 N -4.26 0.01 -2.26 1.69 6.02 -0.33 -4.90 117.38 113.35 3hu8 n GLN 123 Ca 0.01 0.11 -0.20 0.00 -0.01 0.00 0.00 57.00 56.91 3hu8 n GLN 123 Cb 0.27 -1.50 -0.02 0.00 1.02 0.00 0.00 30.24 30.01 3hu8 n GLN 123 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.06 177.68 3hu8 n LYS 124 N -1.50 -1.56 -2.72 -1.09 5.02 -0.33 -4.92 118.16 111.06 3hu8 n LYS 124 Ca 0.06 1.00 -0.43 0.00 -2.02 0.00 0.00 58.31 56.91 3hu8 n LYS 124 Cb 0.26 -5.57 0.00 0.00 -0.02 0.00 0.00 35.03 29.70 3hu8 n LYS 124 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 3hu8 n ARG 125 N -2.84 3.31 -0.13 1.97 1.74 -0.46 -4.86 116.66 115.39 3hu8 n ARG 125 Ca -0.23 -3.59 -0.11 0.00 -0.77 0.00 0.00 57.85 53.15 3hu8 n ARG 125 Cb 0.68 -3.19 -0.02 0.00 -1.02 0.00 0.00 32.46 28.91 3hu8 n ARG 125 CO 0.00 0.00 0.00 -1.49 -1.52 0.00 0.00 177.63 174.62 3hu8 h TRP 126 N 7.09 0.85 -0.46 -1.55 -0.00 -1.88 0.42 115.95 120.41 3hu8 h TRP 126 Ca 0.38 -0.18 -0.12 0.00 -0.00 0.00 0.00 58.89 58.97 3hu8 h TRP 126 Cb 0.84 -0.21 -0.01 0.00 -0.00 0.00 0.00 29.16 29.78 3hu8 h TRP 126 CO 1.23 0.88 -0.18 -0.44 -0.00 0.00 0.00 178.44 179.94 3hu8 h ASP 127 N 0.56 0.96 -0.54 -3.49 5.19 -1.89 -0.21 116.42 117.00 3hu8 h ASP 127 Ca 0.10 -0.39 -0.03 0.00 -0.62 0.00 0.00 57.03 56.09 3hu8 h ASP 127 Cb 0.61 -0.26 -0.02 0.00 0.18 0.00 0.00 39.33 39.83 3hu8 h ASP 127 CO 0.04 1.13 0.22 -0.33 -3.12 0.00 0.00 179.24 177.17 3hu8 h GLU 128 N 0.78 0.81 -0.25 3.56 5.08 -1.92 -0.84 114.58 121.80 3hu8 h GLU 128 Ca 0.11 -0.15 0.05 0.00 -1.00 0.00 0.00 59.36 58.37 3hu8 h GLU 128 Cb 0.74 -0.13 -0.04 0.00 0.50 0.00 0.00 28.75 29.82 3hu8 h GLU 128 CO 0.06 0.71 -0.04 0.00 -1.00 0.00 0.00 179.01 178.73 3hu8 h ALA 129 N 1.06 0.18 -0.77 3.43 0.00 -0.72 -0.74 119.26 121.71 3hu8 h ALA 129 Ca 0.18 0.09 -0.03 0.00 0.00 0.00 0.00 54.91 55.15 3hu8 h ALA 129 Cb 0.20 0.17 -0.04 0.00 0.00 0.00 0.00 17.79 18.12 3hu8 h ALA 129 CO -0.01 -0.46 0.37 0.00 0.00 0.00 0.00 179.25 179.15 3hu8 h ALA 130 N 1.24 1.00 -0.30 0.00 0.00 -0.68 0.85 119.26 121.36 3hu8 h ALA 130 Ca 0.12 -0.16 0.01 0.00 0.00 0.00 0.00 54.91 54.88 3hu8 h ALA 130 Cb 0.17 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.64 3hu8 h ALA 130 CO -0.24 0.57 0.20 0.28 0.00 0.00 0.00 179.25 180.06 3hu8 h VAL 131 N 1.09 1.07 -0.64 0.00 2.07 -0.83 -2.84 116.25 116.17 3hu8 h VAL 131 Ca 0.27 -0.14 -0.07 0.00 0.82 0.00 0.00 66.70 67.57 3hu8 h VAL 131 Cb 0.13 0.63 -0.03 0.00 -1.52 0.00 0.00 31.29 30.50 3hu8 h VAL 131 CO -0.03 0.07 0.11 -1.13 0.02 0.00 0.00 177.57 176.61 3hu8 h ASN 132 N 0.40 0.99 -0.52 0.57 -0.73 -0.44 -2.88 115.58 112.96 3hu8 h ASN 132 Ca 0.11 -0.22 -0.00 0.00 1.87 0.00 0.00 56.30 58.06 3hu8 h ASN 132 Cb -0.04 -0.26 -0.03 0.00 0.27 0.00 0.00 38.32 38.27 3hu8 h ASN 132 CO -0.03 0.98 0.32 -0.07 -0.37 0.00 0.00 177.43 178.26 3hu8 h LEU 133 N 0.97 0.63 -0.69 0.34 3.38 -0.68 -2.28 115.31 116.98 3hu8 h LEU 133 Ca 0.20 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.14 3hu8 h LEU 133 Cb 0.41 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 41.00 3hu8 h LEU 133 CO 0.01 0.49 0.00 0.00 0.09 0.00 0.00 178.44 179.03 3hu8 h ALA 134 N 1.62 1.00 -0.21 1.53 0.00 -1.28 -3.36 119.26 118.56 3hu8 h ALA 134 Ca 0.19 0.00 -0.71 0.00 0.00 0.00 0.00 54.91 54.39 3hu8 h ALA 134 Cb -0.03 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 17.70 3hu8 h ALA 134 CO -0.04 0.00 2.99 1.63 0.00 0.00 0.00 179.25 183.84 3hu8 n LYS 135 N -2.72 3.23 -3.59 0.00 5.02 -0.86 -4.65 118.16 114.58 3hu8 n LYS 135 Ca 0.03 -2.77 -0.15 0.00 -2.02 0.00 0.00 58.31 53.40 3hu8 n LYS 135 Cb 0.36 -3.11 -0.06 0.00 -0.02 0.00 0.00 35.03 32.20 3hu8 n LYS 135 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 3hu8 s SER 136 N 2.42 -0.48 0.21 4.39 1.04 -1.26 -5.01 113.70 115.01 3hu8 s SER 136 Ca 0.49 0.38 -0.10 0.00 0.48 0.00 0.00 55.95 57.20 3hu8 s SER 136 Cb 0.14 0.48 0.25 0.00 0.10 0.00 0.00 66.02 66.99 3hu8 s SER 136 CO -0.07 -0.62 1.78 -0.09 0.98 0.00 0.00 173.24 175.22 3hu8 h ARG 137 N 3.08 0.53 -0.61 4.02 2.43 -1.93 -1.97 114.38 119.93 3hu8 h ARG 137 Ca -0.29 -0.03 0.10 0.00 -0.81 0.00 0.00 59.98 58.94 3hu8 h ARG 137 Cb 1.18 -0.12 -0.11 0.00 -0.42 0.00 0.00 29.97 30.50 3hu8 h ARG 137 CO 0.40 0.35 -0.41 2.35 -1.51 0.00 0.00 179.97 181.15 3hu8 h TRP 138 N 0.54 -1.18 -0.34 2.20 7.01 -1.95 0.13 115.95 122.37 3hu8 h TRP 138 Ca 0.30 0.08 -0.02 0.00 2.11 0.00 0.00 58.89 61.36 3hu8 h TRP 138 Cb 0.27 0.60 -0.02 0.00 -2.10 0.00 0.00 29.16 27.92 3hu8 h TRP 138 CO -0.12 -0.41 0.15 -0.92 -2.79 0.00 0.00 178.44 174.36 3hu8 h TYR 139 N -0.19 0.50 -0.09 2.65 3.20 -1.74 -0.86 116.97 120.43 3hu8 h TYR 139 Ca 0.20 -0.03 -0.08 0.00 3.14 0.00 0.00 58.73 61.96 3hu8 h TYR 139 Cb 0.56 -0.15 -0.01 0.00 1.54 0.00 0.00 36.73 38.67 3hu8 h TYR 139 CO -0.70 0.45 -0.32 -0.91 -1.64 0.00 0.00 178.16 175.04 3hu8 h ASN 140 N 0.41 0.16 0.40 -2.11 4.21 -0.54 -0.70 115.58 117.41 3hu8 h ASN 140 Ca 0.12 -0.05 -0.31 0.00 1.21 0.00 0.00 56.30 57.26 3hu8 h ASN 140 Cb 0.15 -0.04 -0.01 0.00 -1.12 0.00 0.00 38.32 37.29 3hu8 h ASN 140 CO -0.01 0.48 -1.61 1.56 -1.29 0.00 0.00 177.43 176.56 3hu8 h GLN 141 N 0.15 0.24 -2.13 0.81 1.08 -0.68 -3.39 115.11 111.19 3hu8 h GLN 141 Ca 0.02 -0.41 -0.58 0.00 -1.45 0.00 0.00 58.65 56.23 3hu8 h GLN 141 Cb 0.64 0.15 -0.41 0.00 -0.05 0.00 0.00 27.48 27.82 3hu8 h GLN 141 CO 0.05 1.09 -0.84 0.25 -0.95 0.00 0.00 178.83 178.43 3hu8 n THR 142 N -3.43 0.85 -0.04 -0.54 -2.24 -0.34 -4.98 114.28 103.56 3hu8 n THR 142 Ca -0.19 -4.62 -0.05 0.00 -2.27 0.00 0.00 64.05 56.93 3hu8 n THR 142 Cb 1.05 -2.03 0.15 0.00 -2.10 0.00 0.00 70.33 67.40 3hu8 n THR 142 CO 0.00 0.00 0.00 1.55 -0.57 0.00 0.00 175.07 176.05 3hu8 h PRO 143 N 4.16 0.64 -0.42 -0.78 0.13 -1.33 0.48 132.00 134.88 3hu8 h PRO 143 Ca 0.14 -0.24 -0.12 0.00 -0.87 0.00 0.00 66.00 64.90 3hu8 h PRO 143 Cb 0.77 -0.04 -0.01 0.00 0.13 0.00 0.00 31.00 31.85 3hu8 h PRO 143 CO 0.65 0.81 -0.22 -0.44 -0.23 0.00 0.00 178.00 178.57 3hu8 h ASP 144 N 0.57 0.92 -0.16 1.44 3.32 -1.94 0.16 116.42 120.72 3hu8 h ASP 144 Ca 0.08 -0.41 -0.06 0.00 0.02 0.00 0.00 57.03 56.67 3hu8 h ASP 144 Cb 0.68 -0.25 -0.00 0.00 0.22 0.00 0.00 39.33 39.97 3hu8 h ASP 144 CO 0.05 1.13 -0.11 -0.09 -1.72 0.00 0.00 179.24 178.49 3hu8 h ARG 145 N 0.71 0.37 -0.82 3.56 2.43 -1.94 -2.85 114.38 115.83 3hu8 h ARG 145 Ca 0.09 -0.17 -0.02 0.00 -0.81 0.00 0.00 59.98 59.07 3hu8 h ARG 145 Cb 0.79 -0.00 -0.04 0.00 -0.42 0.00 0.00 29.97 30.30 3hu8 h ARG 145 CO 0.06 0.71 0.45 0.00 -1.51 0.00 0.00 179.97 179.68 3hu8 h ALA 146 N 0.65 1.24 -0.81 2.80 0.00 -0.72 -1.39 119.26 121.03 3hu8 h ALA 146 Ca 0.03 -0.12 0.06 0.00 0.00 0.00 0.00 54.91 54.88 3hu8 h ALA 146 Cb 0.62 -0.33 -0.06 0.00 0.00 0.00 0.00 17.79 18.02 3hu8 h ALA 146 CO 0.03 0.61 0.49 0.87 0.00 0.00 0.00 179.25 181.26 3hu8 h LYS 147 N 1.15 0.88 -0.16 0.00 1.57 -0.65 0.29 116.57 119.65 3hu8 h LYS 147 Ca 0.29 -0.05 -0.01 0.00 -1.87 0.00 0.00 60.65 59.00 3hu8 h LYS 147 Cb 0.03 -0.20 -0.01 0.00 0.08 0.00 0.00 32.23 32.13 3hu8 h LYS 147 CO -0.05 0.58 0.05 0.00 -0.57 0.00 0.00 179.45 179.47 3hu8 h ARG 148 N 0.90 0.25 -0.38 3.15 3.08 -1.05 -0.30 114.38 120.04 3hu8 h ARG 148 Ca 0.36 -0.05 -0.06 0.00 0.07 0.00 0.00 59.98 60.30 3hu8 h ARG 148 Cb 0.17 -0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.17 3hu8 h ARG 148 CO -0.17 0.37 0.02 0.28 -1.07 0.00 0.00 179.97 179.39 3hu8 h VAL 149 N 0.09 1.25 -0.63 2.04 2.07 -0.83 -1.61 116.25 118.64 3hu8 h VAL 149 Ca 0.05 -0.95 0.01 0.00 0.82 0.00 0.00 66.70 66.63 3hu8 h VAL 149 Cb 0.22 1.13 -0.03 0.00 -1.52 0.00 0.00 31.29 31.09 3hu8 h VAL 149 CO -0.00 0.32 0.42 0.40 0.02 0.00 0.00 177.57 178.72 3hu8 h ILE 150 N 0.48 1.16 -0.78 4.57 2.04 -0.40 -0.19 117.51 124.39 3hu8 h ILE 150 Ca 0.11 -0.29 0.02 0.00 1.00 0.00 0.00 64.86 65.70 3hu8 h ILE 150 Cb 0.44 0.24 -0.04 0.00 -0.74 0.00 0.00 36.82 36.71 3hu8 h ILE 150 CO 0.02 0.15 0.52 0.74 0.00 0.00 0.00 178.15 179.58 3hu8 h THR 151 N 0.85 1.17 -0.19 -0.27 2.02 -0.77 0.27 112.91 116.00 3hu8 h THR 151 Ca 0.23 -0.35 -0.02 0.00 0.77 0.00 0.00 66.41 67.04 3hu8 h THR 151 Cb -0.10 0.06 -0.01 0.00 -1.74 0.00 0.00 68.15 66.36 3hu8 h THR 151 CO -0.05 0.19 0.04 0.74 0.37 0.00 0.00 175.52 176.80 3hu8 h THR 152 N 1.02 1.22 -1.00 3.16 2.02 -0.67 -0.75 112.91 117.91 3hu8 h THR 152 Ca 0.30 -0.70 0.04 0.00 0.77 0.00 0.00 66.41 66.81 3hu8 h THR 152 Cb -0.06 1.32 -0.06 0.00 -1.74 0.00 0.00 68.15 67.61 3hu8 h THR 152 CO -0.07 0.22 0.65 -0.26 0.37 0.00 0.00 175.52 176.43 3hu8 h PHE 153 N 0.10 1.23 -0.20 3.16 0.05 -0.53 -0.19 116.94 120.57 3hu8 h PHE 153 Ca 0.06 0.03 -0.15 0.00 3.82 0.00 0.00 57.97 61.73 3hu8 h PHE 153 Cb 0.29 -0.41 -0.01 0.00 2.00 0.00 0.00 35.95 37.83 3hu8 h PHE 153 CO 0.02 0.71 -0.50 -0.09 -0.18 0.00 0.00 178.31 178.27 3hu8 h ARG 154 N 1.27 0.53 0.00 1.51 2.43 -0.22 -3.38 114.38 116.53 3hu8 h ARG 154 Ca 0.40 -0.31 -0.04 0.00 -0.81 0.00 0.00 59.98 59.22 3hu8 h ARG 154 Cb -0.01 0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 29.56 3hu8 h ARG 154 CO -0.12 0.91 -1.47 0.25 -1.51 0.00 0.00 179.97 178.03 3hu8 n THR 155 N -3.98 0.13 -2.26 0.20 -2.24 -0.31 -4.76 114.28 101.06 3hu8 n THR 155 Ca -0.03 -0.25 -0.19 0.00 -2.27 0.00 0.00 64.05 61.32 3hu8 n THR 155 Cb 0.57 0.05 -0.02 0.00 -2.10 0.00 0.00 70.33 68.83 3hu8 n THR 155 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3hu8 n GLY 156 N 2.07 -0.11 3.59 3.38 0.00 -0.09 -4.99 105.19 109.04 3hu8 n GLY 156 Ca -0.04 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.70 3hu8 n GLY 156 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3hu8 s THR 157 N -2.88 1.67 -0.25 2.61 -4.23 -1.26 -4.76 115.64 106.54 3hu8 s THR 157 Ca 0.00 -2.00 0.14 0.00 -1.18 0.00 0.00 61.69 58.65 3hu8 s THR 157 Cb 0.00 -2.83 0.82 0.00 1.34 0.00 0.00 72.50 71.83 3hu8 s THR 157 CO 0.00 0.00 1.76 0.79 -0.54 0.00 0.00 174.62 176.63 3hu8 n TRP 158 N -0.94 2.14 -0.31 3.99 7.02 -1.26 -4.52 117.44 123.56 3hu8 n TRP 158 Ca -0.06 -0.77 0.17 0.00 -1.02 0.00 0.00 57.50 55.82 3hu8 n TRP 158 Cb 0.67 -0.53 0.42 0.00 -2.42 0.00 0.00 31.31 29.44 3hu8 n TRP 158 CO 0.00 0.00 0.00 -0.44 -2.02 0.00 0.00 177.69 175.23 3hu8 h ASP 159 N 3.91 0.60 0.73 -0.99 3.32 -1.96 0.32 116.42 122.36 3hu8 h ASP 159 Ca 0.02 0.08 0.00 0.00 0.02 0.00 0.00 57.03 57.15 3hu8 h ASP 159 Cb 2.03 -0.03 0.00 0.00 0.22 0.00 0.00 39.33 41.54 3hu8 h ASP 159 CO 0.52 0.21 0.00 0.00 -1.72 0.00 0.00 179.24 178.25 3hu8 n ALA 160 N -2.42 1.93 0.24 3.45 0.00 -1.26 -3.42 120.51 119.03 3hu8 n ALA 160 Ca 0.22 -0.06 0.03 0.00 0.00 0.00 0.00 53.44 53.63 3hu8 n ALA 160 Cb 0.66 -1.34 -0.01 0.00 0.00 0.00 0.00 19.45 18.77 3hu8 n ALA 160 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 3hu8 n TYR 161 N -1.57 0.00 -0.22 0.00 4.02 0.07 -4.94 117.16 114.53 3hu8 n TYR 161 Ca 0.05 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.94 3hu8 n TYR 161 Cb 0.25 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.57 3hu8 n TYR 161 CO 0.00 0.00 0.00 1.17 -1.01 0.00 0.00 176.86 177.02