#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3me8 n LEU 3 N 0.00 2.58 0.00 2.46 4.77 -1.26 -1.86 117.00 123.69 3me8 n LEU 3 Ca 0.00 1.11 0.00 0.00 -0.03 0.00 0.00 56.01 57.09 3me8 n LEU 3 Cb 0.00 -1.35 0.00 0.00 -2.33 0.00 0.00 43.42 39.74 3me8 n LEU 3 CO 0.00 -0.63 0.00 0.61 -1.33 0.00 0.00 177.39 176.04 3me8 n GLY 4 N 2.72 2.42 3.94 -0.72 0.00 0.01 -5.01 105.19 108.56 3me8 n GLY 4 Ca 0.16 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.93 3me8 n GLY 4 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3me8 s THR 5 N -2.30 2.98 -0.10 2.61 -4.23 -0.78 -4.72 115.64 109.10 3me8 s THR 5 Ca 0.00 -0.33 -0.02 0.00 -1.18 0.00 0.00 61.69 60.17 3me8 s THR 5 Cb 0.00 -3.19 -0.03 0.00 1.34 0.00 0.00 72.50 70.62 3me8 s THR 5 CO 0.00 -0.17 -0.02 -0.31 -0.54 0.00 0.00 174.62 173.57 3me8 s TYR 6 N -2.96 3.07 -0.01 3.99 1.51 -1.26 -0.12 117.35 121.57 3me8 s TYR 6 Ca 0.56 0.04 -0.30 0.00 -1.01 0.00 0.00 57.07 56.36 3me8 s TYR 6 Cb -0.10 -1.81 -0.03 0.00 -0.11 0.00 0.00 41.96 39.90 3me8 s TYR 6 CO 0.42 0.32 1.03 0.08 -1.11 0.00 0.00 175.55 176.29 3me8 s VAL 7 N -0.57 4.69 0.11 0.71 1.01 -0.49 -4.96 120.40 120.89 3me8 s VAL 7 Ca 0.09 1.94 -0.35 0.00 0.00 0.00 0.00 61.98 63.65 3me8 s VAL 7 Cb -0.12 -4.24 -0.15 0.00 0.00 0.00 0.00 36.38 31.87 3me8 s VAL 7 CO 0.02 0.12 1.51 -2.65 0.00 0.00 0.00 175.10 174.10 3me8 n PRO 8 N 4.13 1.75 0.19 2.72 -0.02 -1.26 -4.87 135.00 137.64 3me8 n PRO 8 Ca 0.07 0.63 0.14 0.00 -2.02 0.00 0.00 63.50 62.32 3me8 n PRO 8 Cb 0.50 -2.35 0.42 0.00 -0.02 0.00 0.00 33.50 32.04 3me8 n PRO 8 CO 0.00 0.00 0.00 0.78 1.98 0.00 0.00 175.50 178.26 3me8 h GLY 9 N 5.63 0.00 -1.47 -1.23 0.00 -1.95 -3.19 103.07 100.86 3me8 h GLY 9 Ca -0.46 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.87 3me8 h GLY 9 CO 0.85 0.00 0.00 2.09 0.00 0.00 0.00 176.54 179.48 3me8 n ASP 10 N -2.75 2.19 -4.71 0.19 5.75 -1.26 -1.30 116.55 114.68 3me8 n ASP 10 Ca 0.03 -1.97 -0.42 0.00 -0.01 0.00 0.00 54.79 52.42 3me8 n ASP 10 Cb 0.40 -0.26 -0.03 0.00 -1.03 0.00 0.00 41.12 40.20 3me8 n ASP 10 CO 0.00 0.00 0.00 -0.63 -0.11 0.00 0.00 177.20 176.46 3me8 s ILE 11 N -1.48 2.40 -0.22 2.12 1.01 -1.21 -4.83 121.20 119.00 3me8 s ILE 11 Ca 0.29 0.14 -0.13 0.00 0.00 0.00 0.00 60.65 60.94 3me8 s ILE 11 Cb 0.15 -3.09 -0.04 0.00 0.01 0.00 0.00 42.46 39.49 3me8 s ILE 11 CO 0.20 0.01 0.28 -0.89 0.00 0.00 0.00 174.94 174.53 3me8 s THR 12 N 1.91 5.28 0.19 2.92 2.01 -1.26 -0.82 115.64 125.86 3me8 s THR 12 Ca 0.76 0.44 0.10 0.00 0.31 0.00 0.00 61.69 63.30 3me8 s THR 12 Cb -0.46 -3.61 -0.04 0.00 0.01 0.00 0.00 72.50 68.39 3me8 s THR 12 CO 0.34 0.29 -0.13 -0.76 -0.69 0.00 0.00 174.62 173.67 3me8 s LEU 13 N 1.22 2.84 -0.12 4.42 1.43 0.26 -1.51 118.68 127.22 3me8 s LEU 13 Ca 0.13 -0.66 0.00 0.00 -1.03 0.00 0.00 54.13 52.58 3me8 s LEU 13 Cb -0.14 -1.53 0.02 0.00 0.03 0.00 0.00 46.19 44.57 3me8 s LEU 13 CO 0.06 0.10 -0.11 -0.69 0.23 0.00 0.00 176.35 175.94 3me8 s VAL 14 N -1.73 1.28 0.85 -1.59 1.01 0.51 -1.32 120.40 119.41 3me8 s VAL 14 Ca 0.24 -0.47 -0.13 0.00 0.00 0.00 0.00 61.98 61.62 3me8 s VAL 14 Cb -0.08 -1.23 0.12 0.00 0.00 0.00 0.00 36.38 35.18 3me8 s VAL 14 CO 0.14 0.41 1.22 1.51 0.00 0.00 0.00 175.10 178.37 3me8 s ASP 15 N 1.41 4.09 0.00 3.32 1.47 -0.25 -0.79 116.67 125.92 3me8 s ASP 15 Ca 0.01 0.61 0.15 0.00 1.18 0.00 0.00 52.55 54.50 3me8 s ASP 15 Cb -0.13 -0.97 0.78 0.00 -0.34 0.00 0.00 42.92 42.25 3me8 s ASP 15 CO -0.07 -2.15 1.43 -1.54 0.68 0.00 0.00 175.17 173.53 3me8 n SER 16 N -3.44 0.00 -0.79 2.11 3.41 -0.17 -0.78 113.62 113.96 3me8 n SER 16 Ca 0.10 0.06 0.12 0.00 -0.26 0.00 0.00 58.87 58.90 3me8 n SER 16 Cb 0.61 -0.28 0.17 0.00 -0.26 0.00 0.00 64.21 64.44 3me8 n SER 16 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 3me8 n TYR 17 N -1.28 0.00 -0.51 7.33 4.01 -1.26 -4.47 117.16 120.97 3me8 n TYR 17 Ca 0.07 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.81 3me8 n TYR 17 Cb 0.12 -0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.15 3me8 n TYR 17 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3me8 n GLY 18 N 1.33 0.75 3.69 2.72 0.00 0.04 -5.04 105.19 108.68 3me8 n GLY 18 Ca 0.14 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.74 3me8 n GLY 18 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3me8 s ASN 19 N -2.61 6.99 0.03 1.61 0.01 -1.26 -4.80 114.94 114.91 3me8 s ASN 19 Ca 0.00 1.92 -0.12 0.00 -0.71 0.00 0.00 52.86 53.94 3me8 s ASN 19 Cb 0.00 -2.56 -0.06 0.00 0.41 0.00 0.00 41.25 39.04 3me8 s ASN 19 CO 0.00 -0.62 0.40 -1.61 -1.51 0.00 0.00 177.10 173.75 3me8 s GLU 20 N 2.23 3.83 0.16 -0.60 2.02 -1.26 -1.09 118.70 123.99 3me8 s GLU 20 Ca 0.58 0.30 -0.17 0.00 0.02 0.00 0.00 54.97 55.70 3me8 s GLU 20 Cb -0.27 -3.12 0.03 0.00 0.10 0.00 0.00 34.13 30.87 3me8 s GLU 20 CO 0.24 0.64 0.45 -0.59 0.02 0.00 0.00 175.26 176.02 3me8 s PHE 21 N -1.22 -0.16 0.12 1.61 -0.71 -0.43 -5.01 117.98 112.18 3me8 s PHE 21 Ca 0.27 -0.16 -0.02 0.00 -1.04 0.00 0.00 56.93 55.98 3me8 s PHE 21 Cb -0.15 0.31 -0.05 0.00 -1.21 0.00 0.00 43.02 41.92 3me8 s PHE 21 CO 0.15 -0.79 0.31 -0.65 -1.34 0.00 0.00 175.22 172.90 3me8 s GLN 22 N -3.84 3.53 0.38 1.99 -0.21 -1.26 -0.57 119.66 119.69 3me8 s GLN 22 Ca 0.06 -0.27 0.09 0.00 0.02 0.00 0.00 55.36 55.26 3me8 s GLN 22 Cb 0.01 -2.93 0.84 0.00 1.00 0.00 0.00 33.01 31.93 3me8 s GLN 22 CO -0.08 0.52 1.95 1.25 -2.12 0.00 0.00 175.29 176.81 3me8 h LEU 23 N 2.82 0.57 -2.84 2.90 5.85 -0.76 0.95 115.31 124.81 3me8 h LEU 23 Ca -0.46 0.01 -0.00 0.00 0.84 0.00 0.00 57.88 58.27 3me8 h LEU 23 Cb 1.17 -0.11 -0.00 0.00 0.37 0.00 0.00 40.66 42.09 3me8 h LEU 23 CO 0.73 0.35 -0.00 0.07 -0.34 0.00 0.00 178.44 179.25 3me8 h LYS 24 N 0.64 0.00 0.00 1.25 2.10 -1.48 -1.07 116.57 118.01 3me8 h LYS 24 Ca 0.32 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.97 3me8 h LYS 24 Cb 0.41 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.74 3me8 h LYS 24 CO -0.11 0.00 0.00 -0.91 -2.00 0.00 0.00 179.45 176.43 3me8 h ASN 25 N 0.00 0.00 -0.21 7.07 -0.26 -1.08 -2.33 115.58 118.77 3me8 h ASN 25 Ca -0.00 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.74 3me8 h ASN 25 Cb 0.04 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.30 3me8 h ASN 25 CO 0.00 0.00 0.00 0.18 -1.06 0.00 0.00 177.43 176.55 3me8 n LEU 26 N -2.89 2.30 -4.72 1.61 4.77 -0.41 -4.96 117.00 112.71 3me8 n LEU 26 Ca -0.00 -0.94 -0.36 0.00 -0.03 0.00 0.00 56.01 54.68 3me8 n LEU 26 Cb 0.20 -0.13 0.08 0.00 -2.33 0.00 0.00 43.42 41.25 3me8 n LEU 26 CO 0.22 0.47 0.86 -0.54 -1.33 0.00 0.00 177.39 177.07 3me8 s LYS 27 N -1.74 2.32 0.00 3.23 1.02 -0.88 -3.89 119.74 119.80 3me8 s LYS 27 Ca 0.34 1.94 0.00 0.00 0.02 0.00 0.00 55.97 58.27 3me8 s LYS 27 Cb 0.20 -1.83 0.00 0.00 -0.52 0.00 0.00 37.83 35.67 3me8 s LYS 27 CO 0.29 -1.74 0.00 0.41 -0.92 0.00 0.00 175.35 173.39 3me8 n GLY 28 N 0.71 2.19 3.07 -3.33 0.00 -0.26 -5.04 105.19 102.53 3me8 n GLY 28 Ca 0.15 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.06 3me8 n GLY 28 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3me8 s LYS 29 N -0.22 0.56 0.78 1.61 1.02 -1.25 -4.89 119.74 117.34 3me8 s LYS 29 Ca 0.00 -0.89 -0.14 0.00 0.02 0.00 0.00 55.97 54.96 3me8 s LYS 29 Cb 0.00 -0.15 0.06 0.00 -0.52 0.00 0.00 37.83 37.22 3me8 s LYS 29 CO 0.00 0.00 1.14 -2.30 -0.92 0.00 0.00 175.35 173.27 3me8 n PRO 30 N 1.05 0.31 -4.51 -1.68 -0.02 -1.26 -3.83 135.00 125.06 3me8 n PRO 30 Ca -0.20 0.18 -0.25 0.00 -2.02 0.00 0.00 63.50 61.21 3me8 n PRO 30 Cb 0.57 -2.38 -0.17 0.00 -0.02 0.00 0.00 33.50 31.50 3me8 n PRO 30 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 3me8 s ILE 31 N -2.01 1.13 -0.27 4.25 1.01 -0.70 -1.25 121.20 123.37 3me8 s ILE 31 Ca 0.74 -0.46 -0.08 0.00 0.00 0.00 0.00 60.65 60.84 3me8 s ILE 31 Cb -0.31 -1.04 -0.03 0.00 0.01 0.00 0.00 42.46 41.09 3me8 s ILE 31 CO 0.50 0.36 0.11 -0.63 0.00 0.00 0.00 174.94 175.28 3me8 s ILE 32 N 0.77 4.54 -0.16 2.92 1.01 0.11 -0.29 121.20 130.11 3me8 s ILE 32 Ca -0.13 -0.17 -0.03 0.00 0.00 0.00 0.00 60.65 60.32 3me8 s ILE 32 Cb -0.15 -3.18 -0.02 0.00 0.01 0.00 0.00 42.46 39.11 3me8 s ILE 32 CO 0.02 0.26 -0.05 -0.22 0.00 0.00 0.00 174.94 174.96 3me8 s LEU 33 N 1.64 3.16 -0.37 2.97 2.96 0.96 -0.35 118.68 129.65 3me8 s LEU 33 Ca 0.06 -0.18 0.02 0.00 -0.22 0.00 0.00 54.13 53.81 3me8 s LEU 33 Cb -0.16 -1.76 0.11 0.00 0.50 0.00 0.00 46.19 44.88 3me8 s LEU 33 CO 0.05 0.15 0.13 -0.55 -1.32 0.00 0.00 176.35 174.81 3me8 s SER 34 N 0.47 4.24 0.05 3.68 0.15 0.27 -0.66 113.70 121.90 3me8 s SER 34 Ca -0.04 -2.18 -0.31 0.00 0.70 0.00 0.00 55.95 54.12 3me8 s SER 34 Cb -0.14 -1.25 -0.05 0.00 -1.71 0.00 0.00 66.02 62.86 3me8 s SER 34 CO 0.03 -0.35 1.19 -2.16 1.20 0.00 0.00 173.24 173.15 3me8 s PRO 35 N 0.89 4.43 0.34 5.44 0.04 -1.26 -1.38 135.00 143.50 3me8 s PRO 35 Ca 0.13 1.76 0.02 0.00 0.04 0.00 0.00 61.00 62.95 3me8 s PRO 35 Cb -0.20 -3.36 -0.01 0.00 0.04 0.00 0.00 34.50 30.96 3me8 s PRO 35 CO -0.11 -0.26 0.38 0.96 0.04 0.00 0.00 177.00 178.01 3me8 s ILE 36 N 1.12 0.00 0.05 0.56 -5.25 -0.24 -4.80 121.20 112.64 3me8 s ILE 36 Ca 0.58 -1.79 0.05 0.00 -0.99 0.00 0.00 60.65 58.50 3me8 s ILE 36 Cb -0.29 -2.58 -0.02 0.00 2.95 0.00 0.00 42.46 42.52 3me8 s ILE 36 CO 0.29 0.00 -0.14 -0.72 -1.79 0.00 0.00 174.94 172.58 3me8 s TYR 37 N -3.23 1.23 0.18 1.37 1.13 -1.26 -1.02 117.35 115.75 3me8 s TYR 37 Ca 0.36 -0.38 0.22 0.00 -1.41 0.00 0.00 57.07 55.86 3me8 s TYR 37 Cb 0.01 -0.72 0.88 0.00 -1.10 0.00 0.00 41.96 41.03 3me8 s TYR 37 CO 0.24 0.04 1.82 1.79 -2.51 0.00 0.00 175.55 176.93 3me8 h THR 38 N 4.46 0.68 -0.11 -3.49 1.35 -1.96 -2.95 112.91 110.90 3me8 h THR 38 Ca -0.39 -1.20 0.00 0.00 -0.55 0.00 0.00 66.41 64.27 3me8 h THR 38 Cb 1.18 1.78 0.00 0.00 -1.73 0.00 0.00 68.15 69.38 3me8 h THR 38 CO 0.43 0.26 0.00 1.41 -0.25 0.00 0.00 175.52 177.37 3me8 n HIS 39 N -3.48 0.13 -2.13 4.73 8.25 -1.26 -4.89 115.22 116.57 3me8 n HIS 39 Ca -0.00 -0.06 -0.42 0.00 -0.26 0.00 0.00 57.72 56.97 3me8 n HIS 39 Cb 0.44 0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.52 3me8 n HIS 39 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3me8 n ARG 41 N 5.00 2.87 0.00 0.00 5.12 -1.26 -4.43 116.66 123.96 3me8 n ARG 41 Ca 0.13 -2.01 0.00 0.00 -1.93 0.00 0.00 57.85 54.04 3me8 n ARG 41 Cb 0.42 -1.25 0.00 0.00 -1.16 0.00 0.00 32.46 30.47 3me8 n ARG 41 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 3me8 n ALA 42 N 0.46 0.06 -0.24 7.54 0.00 -1.26 -4.84 120.51 122.22 3me8 n ALA 42 Ca 0.11 0.00 -0.07 0.00 0.00 0.00 0.00 53.44 53.48 3me8 n ALA 42 Cb 0.41 0.00 0.04 0.00 0.00 0.00 0.00 19.45 19.91 3me8 n ALA 42 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3me8 h ALA 43 N -0.42 0.87 -0.76 0.00 0.00 -2.00 -3.33 119.26 113.62 3me8 h ALA 43 Ca 0.00 -0.16 -0.05 0.00 0.00 0.00 0.00 54.91 54.70 3me8 h ALA 43 Cb 0.00 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 17.49 3me8 h ALA 43 CO 0.00 0.47 0.29 0.00 0.00 0.00 0.00 179.25 180.01 3me8 h PRO 45 N 1.11 0.68 -0.18 0.00 0.11 -1.77 -1.39 132.00 130.56 3me8 h PRO 45 Ca 0.25 -0.07 -0.02 0.00 0.11 0.00 0.00 66.00 66.27 3me8 h PRO 45 Cb 0.24 -0.14 -0.01 0.00 0.11 0.00 0.00 31.00 31.20 3me8 h PRO 45 CO -0.02 0.51 0.02 -0.07 -0.21 0.00 0.00 178.00 178.24 3me8 h LEU 46 N 0.69 0.29 -0.13 2.35 3.38 -1.38 0.54 115.31 121.04 3me8 h LEU 46 Ca 0.18 -0.27 0.03 0.00 0.09 0.00 0.00 57.88 57.91 3me8 h LEU 46 Cb 0.03 -0.08 -0.03 0.00 0.09 0.00 0.00 40.66 40.68 3me8 h LEU 46 CO -0.03 0.48 -0.06 0.40 0.09 0.00 0.00 178.44 179.33 3me8 h ILE 47 N 0.08 0.81 -0.43 1.22 2.04 -1.18 -0.05 117.51 120.00 3me8 h ILE 47 Ca 0.05 0.00 -0.14 0.00 1.00 0.00 0.00 64.86 65.77 3me8 h ILE 47 Cb 0.32 0.81 -0.01 0.00 -0.74 0.00 0.00 36.82 37.20 3me8 h ILE 47 CO 0.00 0.00 -0.30 0.74 0.00 0.00 0.00 178.15 178.59 3me8 h THR 48 N -0.04 1.27 -0.33 -0.27 2.02 -1.10 -0.50 112.91 113.96 3me8 h THR 48 Ca 0.07 -1.47 -0.09 0.00 0.77 0.00 0.00 66.41 65.70 3me8 h THR 48 Cb 0.15 1.26 -0.02 0.00 -1.74 0.00 0.00 68.15 67.80 3me8 h THR 48 CO -0.16 0.50 -0.16 0.11 0.37 0.00 0.00 175.52 176.17 3me8 h LYS 49 N 0.79 0.60 -0.38 6.66 1.57 -0.73 0.06 116.57 125.13 3me8 h LYS 49 Ca 0.09 -0.20 -0.08 0.00 -1.87 0.00 0.00 60.65 58.58 3me8 h LYS 49 Cb 0.88 -0.05 -0.01 0.00 0.08 0.00 0.00 32.23 33.13 3me8 h LYS 49 CO 0.08 0.74 -0.07 1.03 -0.57 0.00 0.00 179.45 180.66 3me8 h SER 50 N 0.54 0.72 -0.73 0.86 0.87 -0.63 -2.64 113.55 112.55 3me8 h SER 50 Ca 0.09 -0.35 0.05 0.00 -1.23 0.00 0.00 61.79 60.35 3me8 h SER 50 Cb 0.59 -0.20 -0.05 0.00 -0.44 0.00 0.00 62.40 62.30 3me8 h SER 50 CO 0.04 0.90 0.43 -0.07 -0.53 0.00 0.00 176.83 177.60 3me8 h LEU 51 N 0.53 0.67 -2.32 2.23 3.38 -0.81 -1.70 115.31 117.29 3me8 h LEU 51 Ca 0.10 0.02 0.01 0.00 0.09 0.00 0.00 57.88 58.09 3me8 h LEU 51 Cb 0.57 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 41.20 3me8 h LEU 51 CO 0.03 0.44 0.02 -0.07 0.09 0.00 0.00 178.44 178.95 3me8 h LEU 52 N 0.80 0.00 0.00 1.67 3.38 -0.65 0.32 115.31 120.83 3me8 h LEU 52 Ca 0.31 0.00 -0.19 0.00 0.09 0.00 0.00 57.88 58.09 3me8 h LEU 52 Cb 0.14 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.86 3me8 h LEU 52 CO -0.16 0.00 -1.39 0.11 0.09 0.00 0.00 178.44 177.09 3me8 h LYS 53 N 0.00 0.00 0.05 1.13 1.57 -1.05 -3.40 116.57 114.87 3me8 h LYS 53 Ca 0.01 0.00 -0.36 0.00 -1.87 0.00 0.00 60.65 58.43 3me8 h LYS 53 Cb 0.05 0.00 -0.05 0.00 0.08 0.00 0.00 32.23 32.31 3me8 h LYS 53 CO -0.00 0.37 -2.14 1.55 -0.57 0.00 0.00 179.45 178.66 3me8 n VAL 54 N -2.96 1.61 -0.13 0.50 3.14 -0.70 -4.53 118.33 115.26 3me8 n VAL 54 Ca -0.10 -0.68 -0.04 0.00 -2.96 0.00 0.00 64.34 60.56 3me8 n VAL 54 Cb 0.88 -1.34 0.04 0.00 -1.06 0.00 0.00 33.84 32.36 3me8 n VAL 54 CO 0.00 0.00 0.00 0.40 -6.46 0.00 0.00 176.83 170.77 3me8 h ILE 55 N 0.03 0.72 0.00 1.55 1.08 -1.15 -1.59 117.51 118.14 3me8 h ILE 55 Ca -0.46 -0.06 0.00 0.00 -0.39 0.00 0.00 64.86 63.95 3me8 h ILE 55 Cb 2.02 0.54 0.00 0.00 -3.07 0.00 0.00 36.82 36.31 3me8 h ILE 55 CO 0.03 0.03 0.02 -0.65 -0.69 0.00 0.00 178.15 176.89 3me8 h PRO 56 N 0.17 0.00 0.00 2.37 0.11 -1.79 0.31 132.00 133.17 3me8 h PRO 56 Ca 0.21 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 66.30 3me8 h PRO 56 Cb 0.29 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.40 3me8 h PRO 56 CO -0.32 0.00 -0.14 0.87 -0.21 0.00 0.00 178.00 178.21 3me8 h LYS 57 N 0.00 0.00 0.00 1.05 1.57 -1.53 -3.36 116.57 114.30 3me8 h LYS 57 Ca 0.00 0.00 -0.35 0.00 -1.87 0.00 0.00 60.65 58.43 3me8 h LYS 57 Cb 0.04 0.00 -0.06 0.00 0.08 0.00 0.00 32.23 32.29 3me8 h LYS 57 CO 0.00 0.14 -2.20 1.28 -0.57 0.00 0.00 179.45 178.10 3me8 n LEU 58 N -3.22 0.48 0.00 2.94 4.77 0.09 -5.09 117.00 116.97 3me8 n LEU 58 Ca 0.01 0.11 0.00 0.00 -0.03 0.00 0.00 56.01 56.10 3me8 n LEU 58 Cb 0.45 0.29 0.00 0.00 -2.33 0.00 0.00 43.42 41.82 3me8 n LEU 58 CO 0.32 0.50 0.00 0.61 -1.33 0.00 0.00 177.39 177.50 3me8 n GLY 59 N 1.73 -0.93 3.33 -0.72 0.00 -1.16 -5.08 105.19 102.37 3me8 n GLY 59 Ca -0.29 -1.25 -0.36 0.00 0.00 0.00 0.00 46.02 44.12 3me8 n GLY 59 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3me8 s THR 60 N -2.95 3.75 0.30 2.61 2.01 -1.26 -4.51 115.64 115.60 3me8 s THR 60 Ca 0.00 -0.65 -0.30 0.00 0.31 0.00 0.00 61.69 61.06 3me8 s THR 60 Cb 0.00 -2.87 -0.12 0.00 0.01 0.00 0.00 72.50 69.51 3me8 s THR 60 CO 0.00 0.18 1.44 -2.65 -0.69 0.00 0.00 174.62 172.91 3me8 n PRO 61 N 4.83 2.34 0.00 4.92 -0.02 -1.26 -1.30 135.00 144.51 3me8 n PRO 61 Ca -0.16 0.83 0.00 0.00 -2.02 0.00 0.00 63.50 62.15 3me8 n PRO 61 Cb 0.49 -2.51 0.00 0.00 -0.02 0.00 0.00 33.50 31.46 3me8 n PRO 61 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3me8 n GLY 62 N 1.59 1.46 1.00 -1.23 0.00 0.62 -4.41 105.19 104.22 3me8 n GLY 62 Ca 0.08 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.09 3me8 n GLY 62 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3me8 n LYS 63 N -2.00 0.02 0.08 1.61 5.02 -0.57 -4.87 118.16 117.44 3me8 n LYS 63 Ca 0.00 0.01 -0.02 0.00 -2.02 0.00 0.00 58.31 56.28 3me8 n LYS 63 Cb 0.00 -0.43 -0.05 0.00 -0.02 0.00 0.00 35.03 34.53 3me8 n LYS 63 CO 0.00 0.00 0.00 -0.44 -0.52 0.00 0.00 177.40 176.44 3me8 h ASP 64 N -0.03 0.00 -4.99 4.39 3.32 -1.51 -3.48 116.42 114.12 3me8 h ASP 64 Ca 0.00 0.00 0.14 0.00 0.02 0.00 0.00 57.03 57.19 3me8 h ASP 64 Cb 0.03 0.00 -0.12 0.00 0.22 0.00 0.00 39.33 39.47 3me8 h ASP 64 CO 0.00 0.69 0.48 0.72 -1.72 0.00 0.00 179.24 179.41 3me8 s PHE 65 N -2.85 -0.25 -0.04 4.55 -0.12 -1.25 -4.36 117.98 113.66 3me8 s PHE 65 Ca 0.01 0.03 -0.06 0.00 -0.05 0.00 0.00 56.93 56.86 3me8 s PHE 65 Cb 0.08 0.59 -0.04 0.00 -0.63 0.00 0.00 43.02 43.02 3me8 s PHE 65 CO 0.79 -0.69 0.21 -1.58 -0.05 0.00 0.00 175.22 173.90 3me8 s TRP 66 N -3.21 3.58 -0.11 3.49 0.52 -0.38 -0.27 118.94 122.55 3me8 s TRP 66 Ca 0.08 0.50 0.00 0.00 0.02 0.00 0.00 56.10 56.71 3me8 s TRP 66 Cb -0.01 -1.93 -0.02 0.00 -1.15 0.00 0.00 33.47 30.36 3me8 s TRP 66 CO -0.04 0.66 -0.12 0.08 0.02 0.00 0.00 176.95 177.55 3me8 s VAL 67 N -1.22 3.17 -0.28 4.03 1.01 -0.69 -0.71 120.40 125.71 3me8 s VAL 67 Ca 0.24 -0.63 -0.00 0.00 0.00 0.00 0.00 61.98 61.58 3me8 s VAL 67 Cb -0.13 -2.32 0.09 0.00 0.00 0.00 0.00 36.38 34.02 3me8 s VAL 67 CO 0.13 0.54 0.05 -0.63 0.00 0.00 0.00 175.10 175.19 3me8 s ILE 68 N 0.10 1.11 -0.13 2.22 -1.09 0.52 -0.39 121.20 123.54 3me8 s ILE 68 Ca -0.05 -1.34 -0.25 0.00 -2.23 0.00 0.00 60.65 56.77 3me8 s ILE 68 Cb -0.15 -1.71 -0.02 0.00 -1.58 0.00 0.00 42.46 39.00 3me8 s ILE 68 CO 0.04 -0.48 0.81 -0.89 -1.23 0.00 0.00 174.94 173.20 3me8 s THR 69 N 1.53 4.92 -0.05 2.92 2.01 -0.20 -0.57 115.64 126.20 3me8 s THR 69 Ca 0.05 1.63 0.04 0.00 0.31 0.00 0.00 61.69 63.73 3me8 s THR 69 Cb -0.18 -4.13 -0.00 0.00 0.01 0.00 0.00 72.50 68.20 3me8 s THR 69 CO -0.17 0.10 -0.19 0.12 -0.69 0.00 0.00 174.62 173.79 3me8 s PHE 70 N 1.69 1.93 -0.03 4.92 5.36 -0.48 -0.77 117.98 130.60 3me8 s PHE 70 Ca 0.40 -0.60 -0.21 0.00 -0.96 0.00 0.00 56.93 55.55 3me8 s PHE 70 Cb -0.17 -1.29 -0.05 0.00 -0.34 0.00 0.00 43.02 41.16 3me8 s PHE 70 CO 0.15 -0.21 0.62 -0.08 -1.46 0.00 0.00 175.22 174.25 3me8 s THR 71 N 0.08 4.96 -2.41 0.12 -1.32 -0.77 -1.07 115.64 115.23 3me8 s THR 71 Ca -0.06 1.30 0.22 0.00 -1.21 0.00 0.00 61.69 61.94 3me8 s THR 71 Cb -0.13 -3.96 0.44 0.00 -1.51 0.00 0.00 72.50 67.34 3me8 s THR 71 CO 0.03 0.36 1.43 2.22 -2.21 0.00 0.00 174.62 176.46 3me8 n PHE 72 N 3.10 0.48 -3.04 9.09 1.16 -0.19 -4.49 117.46 123.57 3me8 n PHE 72 Ca -0.05 -0.24 -0.43 0.00 -1.87 0.00 0.00 57.45 54.87 3me8 n PHE 72 Cb 0.51 0.00 -0.06 0.00 -1.61 0.00 0.00 39.48 38.32 3me8 n PHE 72 CO 0.00 0.00 0.00 0.34 -1.87 0.00 0.00 176.76 175.23 3me8 s ASP 73 N -1.46 6.41 0.00 5.98 -1.08 -1.26 -4.92 116.67 120.34 3me8 s ASP 73 Ca 0.38 -0.04 0.14 0.00 -0.52 0.00 0.00 52.55 52.52 3me8 s ASP 73 Cb 0.22 -2.36 0.86 0.00 -1.46 0.00 0.00 42.92 40.18 3me8 s ASP 73 CO 0.30 -0.77 1.39 -0.81 0.52 0.00 0.00 175.17 175.80 3me8 n PRO 74 N 6.39 0.76 0.03 4.34 -0.04 -1.26 -1.22 135.00 144.00 3me8 n PRO 74 Ca 0.01 0.00 0.11 0.00 -0.04 0.00 0.00 63.50 63.58 3me8 n PRO 74 Cb 0.48 -1.30 0.09 0.00 -0.04 0.00 0.00 33.50 32.73 3me8 n PRO 74 CO 0.00 0.00 0.00 1.17 -0.04 0.00 0.00 175.50 176.63 3me8 n LYS 75 N -0.80 0.23 -2.16 0.54 0.00 -1.26 -4.91 118.16 109.80 3me8 n LYS 75 Ca 0.11 0.02 -0.42 0.00 0.00 0.00 0.00 58.31 58.02 3me8 n LYS 75 Cb 0.05 -1.59 -0.03 0.00 0.00 0.00 0.00 35.03 33.46 3me8 n LYS 75 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.40 176.89 3me8 s ASP 76 N -3.80 6.82 0.53 3.14 1.01 -0.36 -5.01 116.67 119.00 3me8 s ASP 76 Ca 0.06 2.39 0.06 0.00 0.71 0.00 0.00 52.55 55.76 3me8 s ASP 76 Cb 0.15 -2.60 0.03 0.00 1.01 0.00 0.00 42.92 41.51 3me8 s ASP 76 CO 0.77 -0.63 0.40 0.42 0.21 0.00 0.00 175.17 176.35 3me8 s THR 77 N 0.72 1.79 0.28 -1.27 -4.23 -1.26 -4.97 115.64 106.70 3me8 s THR 77 Ca 0.62 -1.47 0.01 0.00 -1.18 0.00 0.00 61.69 59.66 3me8 s THR 77 Cb -0.37 -2.26 0.27 0.00 1.34 0.00 0.00 72.50 71.47 3me8 s THR 77 CO 0.34 0.00 1.81 0.25 -0.54 0.00 0.00 174.62 176.48 3me8 h LEU 78 N 0.79 0.81 -0.91 4.79 5.85 -1.95 -1.00 115.31 123.69 3me8 h LEU 78 Ca -0.37 0.06 0.01 0.00 0.84 0.00 0.00 57.88 58.42 3me8 h LEU 78 Cb 1.30 -0.10 -0.05 0.00 0.37 0.00 0.00 40.66 42.18 3me8 h LEU 78 CO 0.57 0.41 0.60 -0.08 -0.34 0.00 0.00 178.44 179.60 3me8 h GLU 79 N 0.88 1.18 -0.12 1.25 4.81 -1.95 -0.47 114.58 120.16 3me8 h GLU 79 Ca 0.49 -0.07 -0.01 0.00 -0.13 0.00 0.00 59.36 59.64 3me8 h GLU 79 Cb 0.55 -0.27 -0.01 0.00 0.63 0.00 0.00 28.75 29.66 3me8 h GLU 79 CO -0.29 0.78 0.04 -0.44 -0.73 0.00 0.00 179.01 178.37 3me8 h ASP 80 N 1.22 0.17 0.25 1.04 3.32 -1.59 -1.49 116.42 119.35 3me8 h ASP 80 Ca 0.34 -0.19 -0.11 0.00 0.02 0.00 0.00 57.03 57.09 3me8 h ASP 80 Cb -0.11 -0.05 -0.01 0.00 0.22 0.00 0.00 39.33 39.38 3me8 h ASP 80 CO -0.08 0.32 -0.42 0.16 -1.72 0.00 0.00 179.24 177.50 3me8 h ILE 81 N 0.02 1.31 -0.59 0.35 3.07 -1.16 -1.52 117.51 118.99 3me8 h ILE 81 Ca 0.04 -1.55 -0.05 0.00 1.55 0.00 0.00 64.86 64.85 3me8 h ILE 81 Cb 0.21 1.71 -0.02 0.00 -0.27 0.00 0.00 36.82 38.44 3me8 h ILE 81 CO -0.00 0.46 0.17 0.50 -1.05 0.00 0.00 178.15 178.23 3me8 h LYS 82 N 0.19 0.92 -0.70 0.16 1.63 -1.02 -1.01 116.57 116.74 3me8 h LYS 82 Ca 0.02 -0.21 0.00 0.00 -0.85 0.00 0.00 60.65 59.61 3me8 h LYS 82 Cb 0.83 -0.13 -0.03 0.00 -0.60 0.00 0.00 32.23 32.30 3me8 h LYS 82 CO 0.06 0.84 0.46 -0.09 -3.45 0.00 0.00 179.45 177.27 3me8 h ARG 83 N 0.84 0.93 -0.13 1.90 2.43 -1.02 -1.69 114.38 117.64 3me8 h ARG 83 Ca 0.19 -0.06 -0.01 0.00 -0.81 0.00 0.00 59.98 59.29 3me8 h ARG 83 Cb 0.31 -0.21 -0.01 0.00 -0.42 0.00 0.00 29.97 29.65 3me8 h ARG 83 CO -0.00 0.63 0.06 0.35 -1.51 0.00 0.00 179.97 179.49 3me8 h PHE 84 N 0.95 0.19 -0.38 2.20 3.04 -1.09 -1.26 116.94 120.59 3me8 h PHE 84 Ca 0.26 -0.01 0.08 0.00 3.98 0.00 0.00 57.97 62.27 3me8 h PHE 84 Cb -0.10 -0.06 -0.07 0.00 2.56 0.00 0.00 35.95 38.28 3me8 h PHE 84 CO -0.02 0.25 -0.10 0.37 -2.02 0.00 0.00 178.31 176.78 3me8 h GLN 85 N 0.08 -0.01 -0.58 1.11 4.15 -0.97 -2.13 115.11 116.75 3me8 h GLN 85 Ca 0.04 0.00 -0.06 0.00 0.77 0.00 0.00 58.65 59.40 3me8 h GLN 85 Cb 0.13 0.00 -0.03 0.00 0.21 0.00 0.00 27.48 27.80 3me8 h GLN 85 CO -0.01 -0.01 0.11 0.87 -1.93 0.00 0.00 178.83 177.87 3me8 h LYS 86 N -0.01 0.92 -0.89 1.69 1.57 -1.18 -1.77 116.57 116.90 3me8 h LYS 86 Ca 0.18 -0.22 0.04 0.00 -1.87 0.00 0.00 60.65 58.79 3me8 h LYS 86 Cb 0.29 -0.13 -0.05 0.00 0.08 0.00 0.00 32.23 32.42 3me8 h LYS 86 CO -0.40 0.85 0.57 1.49 -0.57 0.00 0.00 179.45 181.39 3me8 h GLU 87 N 0.88 1.07 -0.13 3.15 4.81 -0.57 -2.58 114.58 121.21 3me8 h GLU 87 Ca 0.18 -0.06 0.00 0.00 -0.13 0.00 0.00 59.36 59.35 3me8 h GLU 87 Cb 0.36 -0.24 0.00 0.00 0.63 0.00 0.00 28.75 29.50 3me8 h GLU 87 CO 0.01 0.71 0.00 0.66 -0.73 0.00 0.00 179.01 179.65 3me8 n TYR 88 N -4.54 0.15 -1.60 0.92 4.01 -1.02 -4.95 117.16 110.14 3me8 n TYR 88 Ca 0.12 -0.07 -0.11 0.00 -0.16 0.00 0.00 57.90 57.67 3me8 n TYR 88 Cb 0.10 0.00 -0.04 0.00 -0.31 0.00 0.00 39.34 39.10 3me8 n TYR 88 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3me8 n GLY 89 N 1.36 0.85 3.74 2.72 0.00 -0.94 -4.98 105.19 107.93 3me8 n GLY 89 Ca 0.16 -0.47 -0.41 0.00 0.00 0.00 0.00 46.02 45.30 3me8 n GLY 89 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3me8 s ILE 90 N -2.47 3.15 0.34 -0.61 1.01 -0.71 -4.92 121.20 116.99 3me8 s ILE 90 Ca 0.00 0.94 0.04 0.00 0.00 0.00 0.00 60.65 61.63 3me8 s ILE 90 Cb 0.00 -3.60 0.18 0.00 0.01 0.00 0.00 42.46 39.04 3me8 s ILE 90 CO 0.00 0.14 1.90 -2.24 0.00 0.00 0.00 174.94 174.74 3me8 h ASP 91 N 5.39 0.54 0.00 3.58 3.04 -1.89 -3.44 116.42 123.64 3me8 h ASP 91 Ca -0.45 -0.09 0.00 0.00 -3.24 0.00 0.00 57.03 53.26 3me8 h ASP 91 Cb 1.21 -0.14 0.00 0.00 -1.04 0.00 0.00 39.33 39.36 3me8 h ASP 91 CO 0.78 0.56 0.00 0.61 -2.04 0.00 0.00 179.24 179.15 3me8 n GLY 92 N -0.97 1.04 0.64 7.15 0.00 0.17 -4.87 105.19 108.36 3me8 n GLY 92 Ca 0.02 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.01 3me8 n GLY 92 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 3me8 n LYS 93 N -2.00 0.21 0.07 1.61 2.85 -1.26 -4.42 118.16 115.23 3me8 n LYS 93 Ca 0.00 0.08 -0.17 0.00 -1.05 0.00 0.00 58.31 57.17 3me8 n LYS 93 Cb 0.00 -0.86 -0.09 0.00 -0.65 0.00 0.00 35.03 33.43 3me8 n LYS 93 CO 0.00 0.00 0.00 0.78 -0.05 0.00 0.00 177.40 178.13 3me8 h GLY 94 N -0.40 0.58 -7.49 2.58 0.00 -1.90 -3.39 103.07 93.05 3me8 h GLY 94 Ca 0.00 -1.11 -0.68 0.00 0.00 0.00 0.00 47.33 45.54 3me8 h GLY 94 CO 0.00 0.97 -0.66 0.86 0.00 0.00 0.00 176.54 177.71 3me8 s TRP 95 N -3.15 3.18 0.11 5.60 -0.11 -1.26 -1.70 118.94 121.61 3me8 s TRP 95 Ca -0.07 -1.43 0.02 0.00 1.22 0.00 0.00 56.10 55.84 3me8 s TRP 95 Cb 0.07 -2.18 -0.04 0.00 -1.50 0.00 0.00 33.47 29.82 3me8 s TRP 95 CO 0.90 -0.70 0.19 0.15 -4.62 0.00 0.00 176.95 172.86 3me8 s LYS 96 N 1.38 3.21 -0.17 5.86 1.02 0.47 -0.65 119.74 130.85 3me8 s LYS 96 Ca -0.01 -0.63 -0.00 0.00 0.02 0.00 0.00 55.97 55.35 3me8 s LYS 96 Cb -0.18 -2.87 0.00 0.00 -0.52 0.00 0.00 37.83 34.26 3me8 s LYS 96 CO 0.00 0.55 -0.15 0.08 -0.92 0.00 0.00 175.35 174.91 3me8 s VAL 97 N -1.60 2.57 0.13 3.17 1.01 -1.26 -1.03 120.40 123.39 3me8 s VAL 97 Ca 0.33 -0.78 0.02 0.00 0.00 0.00 0.00 61.98 61.54 3me8 s VAL 97 Cb -0.12 -2.10 -0.04 0.00 0.00 0.00 0.00 36.38 34.12 3me8 s VAL 97 CO 0.26 0.51 -0.05 0.68 0.00 0.00 0.00 175.10 176.50 3me8 s VAL 98 N 1.08 0.72 0.23 2.92 -7.23 0.05 -1.00 120.40 117.17 3me8 s VAL 98 Ca -0.00 -1.96 0.08 0.00 -1.81 0.00 0.00 61.98 58.29 3me8 s VAL 98 Cb -0.14 -1.84 -0.05 0.00 0.56 0.00 0.00 36.38 34.91 3me8 s VAL 98 CO -0.05 -0.73 -0.15 -1.59 -0.31 0.00 0.00 175.10 172.27 3me8 s LYS 99 N -3.86 1.43 0.29 4.82 -2.85 0.03 -1.84 119.74 117.76 3me8 s LYS 99 Ca 0.16 -1.65 -0.28 0.00 -1.00 0.00 0.00 55.97 53.20 3me8 s LYS 99 Cb 0.05 -1.26 -0.09 0.00 -2.06 0.00 0.00 37.83 34.47 3me8 s LYS 99 CO -0.02 0.20 1.04 0.00 0.10 0.00 0.00 175.35 176.67 3me8 s ALA 100 N -2.88 3.32 0.07 0.59 0.00 -1.26 -0.37 121.76 121.23 3me8 s ALA 100 Ca 0.25 0.77 -0.25 0.00 0.00 0.00 0.00 51.96 52.72 3me8 s ALA 100 Cb -0.01 -3.28 -0.16 0.00 0.00 0.00 0.00 23.12 19.67 3me8 s ALA 100 CO 0.09 -0.05 1.63 -0.22 0.00 0.00 0.00 175.76 177.21 3me8 h LYS 101 N 3.63 -0.20 -5.05 0.00 1.63 -1.59 -3.46 116.57 111.53 3me8 h LYS 101 Ca -0.47 0.01 -0.49 0.00 -0.85 0.00 0.00 60.65 58.86 3me8 h LYS 101 Cb 1.21 0.05 -0.14 0.00 -0.60 0.00 0.00 32.23 32.75 3me8 h LYS 101 CO 0.66 -0.08 -0.56 0.95 -3.45 0.00 0.00 179.45 176.98 3me8 s THR 102 N -5.86 0.71 0.50 1.00 -4.23 -1.26 -5.03 115.64 101.47 3me8 s THR 102 Ca -0.14 -2.00 0.16 0.00 -1.18 0.00 0.00 61.69 58.52 3me8 s THR 102 Cb 0.05 -2.53 0.24 0.00 1.34 0.00 0.00 72.50 71.59 3me8 s THR 102 CO 0.64 0.00 2.10 0.77 -0.54 0.00 0.00 174.62 177.59 3me8 h SER 103 N 2.02 0.00 -0.58 3.99 4.64 -1.98 -1.71 113.55 119.93 3me8 h SER 103 Ca -0.37 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 60.89 3me8 h SER 103 Cb 1.26 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.32 3me8 h SER 103 CO 0.60 0.06 0.14 -0.08 -0.87 0.00 0.00 176.83 176.68 3me8 h GLU 104 N 0.00 0.94 -0.56 4.77 4.81 -1.99 0.07 114.58 122.62 3me8 h GLU 104 Ca -0.00 -0.23 -0.02 0.00 -0.13 0.00 0.00 59.36 58.98 3me8 h GLU 104 Cb 0.11 -0.12 -0.03 0.00 0.63 0.00 0.00 28.75 29.34 3me8 h GLU 104 CO 0.01 0.87 0.28 -0.44 -0.73 0.00 0.00 179.01 178.99 3me8 h ASP 105 N 0.85 0.72 0.28 1.04 3.32 -1.69 -1.70 116.42 119.23 3me8 h ASP 105 Ca 0.18 -0.12 -0.01 0.00 0.02 0.00 0.00 57.03 57.10 3me8 h ASP 105 Cb 0.35 -0.19 0.00 0.00 0.22 0.00 0.00 39.33 39.72 3me8 h ASP 105 CO 0.00 0.64 -0.13 0.25 -1.72 0.00 0.00 179.24 178.28 3me8 h LEU 106 N 0.75 -0.31 -0.88 1.55 5.85 -1.09 -2.01 115.31 119.18 3me8 h LEU 106 Ca 0.19 -0.07 -0.10 0.00 0.84 0.00 0.00 57.88 58.74 3me8 h LEU 106 Cb 0.11 0.08 -0.01 0.00 0.37 0.00 0.00 40.66 41.20 3me8 h LEU 106 CO -0.03 -0.13 -0.49 -0.26 -0.34 0.00 0.00 178.44 177.19 3me8 h PHE 107 N -0.48 0.00 -0.56 1.25 0.04 -0.95 -1.23 116.94 115.01 3me8 h PHE 107 Ca -0.04 0.00 -0.02 0.00 2.80 0.00 0.00 57.97 60.71 3me8 h PHE 107 Cb 0.36 0.00 -0.03 0.00 2.20 0.00 0.00 35.95 38.49 3me8 h PHE 107 CO -0.03 0.49 0.26 0.87 -0.60 0.00 0.00 178.31 179.30 3me8 h LYS 108 N 0.00 0.81 0.28 1.51 1.57 -1.27 0.37 116.57 119.84 3me8 h LYS 108 Ca -0.00 -0.13 -0.01 0.00 -1.87 0.00 0.00 60.65 58.64 3me8 h LYS 108 Cb 0.98 -0.14 0.00 0.00 0.08 0.00 0.00 32.23 33.15 3me8 h LYS 108 CO 0.06 0.67 -0.13 1.25 -0.57 0.00 0.00 179.45 180.73 3me8 h LEU 109 N 0.76 -0.31 -0.99 2.94 5.85 -1.07 -1.74 115.31 120.73 3me8 h LEU 109 Ca 0.19 -0.09 -0.04 0.00 0.84 0.00 0.00 57.88 58.78 3me8 h LEU 109 Cb 0.14 0.08 -0.03 0.00 0.37 0.00 0.00 40.66 41.22 3me8 h LEU 109 CO -0.02 -0.11 0.21 -0.07 -0.34 0.00 0.00 178.44 178.12 3me8 h LEU 110 N -0.51 0.87 -0.80 2.25 3.38 -1.06 -2.51 115.31 116.93 3me8 h LEU 110 Ca -0.04 -0.14 -0.02 0.00 0.09 0.00 0.00 57.88 57.78 3me8 h LEU 110 Cb 0.38 -0.23 -0.04 0.00 0.09 0.00 0.00 40.66 40.87 3me8 h LEU 110 CO 0.06 0.80 0.43 -0.78 0.09 0.00 0.00 178.44 179.05 3me8 h ASP 111 N 0.92 1.01 -0.60 -0.43 3.58 -0.21 -0.47 116.42 120.22 3me8 h ASP 111 Ca 0.21 -0.10 -0.08 0.00 0.42 0.00 0.00 57.03 57.47 3me8 h ASP 111 Cb 0.24 -0.26 -0.02 0.00 1.72 0.00 0.00 39.33 41.00 3me8 h ASP 111 CO -0.01 0.83 0.07 0.00 -2.88 0.00 0.00 179.24 177.25 3me8 h ALA 112 N 1.23 0.95 -0.46 -0.78 0.00 -0.89 -2.63 119.26 116.67 3me8 h ALA 112 Ca 0.28 -0.27 0.00 0.00 0.00 0.00 0.00 54.91 54.92 3me8 h ALA 112 Cb 0.05 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 17.60 3me8 h ALA 112 CO -0.04 0.65 0.00 0.44 0.00 0.00 0.00 179.25 180.29 3me8 n ILE 113 N -4.21 1.20 -3.73 0.00 -5.35 -1.01 -2.23 119.36 104.02 3me8 n ILE 113 Ca 0.04 -0.80 -0.27 0.00 -0.27 0.00 0.00 62.75 61.44 3me8 n ILE 113 Cb 0.30 0.05 0.04 0.00 -1.74 0.00 0.00 39.64 38.30 3me8 n ILE 113 CO 0.00 0.00 0.00 0.47 -1.76 0.00 0.00 176.55 175.26 3me8 n ASP 114 N 0.76 -5.41 -4.60 7.28 8.00 -0.67 -4.56 116.55 117.35 3me8 n ASP 114 Ca 0.18 -0.65 -0.34 0.00 0.71 0.00 0.00 54.79 54.69 3me8 n ASP 114 Cb 0.63 -4.30 -0.10 0.00 -0.02 0.00 0.00 41.12 37.33 3me8 n ASP 114 CO 0.00 0.00 0.00 0.12 -0.39 0.00 0.00 177.20 176.93 3me8 s PHE 115 N -3.28 3.21 0.05 1.24 2.19 -0.27 -5.02 117.98 116.09 3me8 s PHE 115 Ca 0.61 -0.01 0.04 0.00 0.33 0.00 0.00 56.93 57.90 3me8 s PHE 115 Cb -0.29 -2.07 -0.02 0.00 -1.31 0.00 0.00 43.02 39.32 3me8 s PHE 115 CO 0.75 0.10 -0.12 -0.98 1.83 0.00 0.00 175.22 176.80 3me8 s ARG 116 N 0.44 0.76 0.18 10.12 1.70 -1.26 -4.58 118.95 126.31 3me8 s ARG 116 Ca 0.02 -0.80 0.03 0.00 -0.47 0.00 0.00 55.73 54.51 3me8 s ARG 116 Cb -0.13 -0.71 -0.05 0.00 -0.57 0.00 0.00 34.95 33.49 3me8 s ARG 116 CO 0.01 0.16 -0.04 -0.59 -1.08 0.00 0.00 175.30 173.76 3me8 s PHE 117 N -1.10 1.35 -0.01 5.89 -0.71 -1.26 -4.32 117.98 117.82 3me8 s PHE 117 Ca -0.03 -0.89 -0.09 0.00 -1.04 0.00 0.00 56.93 54.88 3me8 s PHE 117 Cb -0.09 -0.75 0.01 0.00 -1.21 0.00 0.00 43.02 40.98 3me8 s PHE 117 CO 0.01 -0.04 0.20 0.00 -1.34 0.00 0.00 175.22 174.05 3me8 s MET 118 N -3.83 0.50 0.31 1.99 0.23 -0.27 -4.98 119.30 113.26 3me8 s MET 118 Ca 0.23 -0.24 -0.29 0.00 -1.03 0.00 0.00 55.69 54.36 3me8 s MET 118 Cb 0.05 0.22 -0.10 0.00 -1.53 0.00 0.00 34.83 33.46 3me8 s MET 118 CO 0.04 -0.12 1.27 0.95 -2.03 0.00 0.00 175.02 175.13 3me8 s THR 119 N -1.15 2.87 -0.31 3.16 -4.23 -1.26 0.04 115.64 114.75 3me8 s THR 119 Ca -0.12 0.87 -0.02 0.00 -1.18 0.00 0.00 61.69 61.23 3me8 s THR 119 Cb -0.06 -3.55 0.11 0.00 1.34 0.00 0.00 72.50 70.34 3me8 s THR 119 CO 0.02 0.20 0.15 0.00 -0.54 0.00 0.00 174.62 174.45 3me8 s ALA 120 N -1.06 0.90 0.00 3.99 0.00 0.08 -4.72 121.76 120.94 3me8 s ALA 120 Ca 0.49 -1.40 0.00 0.00 0.00 0.00 0.00 51.96 51.04 3me8 s ALA 120 Cb -0.38 -1.49 0.00 0.00 0.00 0.00 0.00 23.12 21.25 3me8 s ALA 120 CO 0.50 -1.76 0.00 0.41 0.00 0.00 0.00 175.76 174.91 3me8 n GLY 121 N 4.87 2.15 0.51 0.00 0.00 -1.26 -0.29 105.19 111.17 3me8 n GLY 121 Ca -0.01 0.41 0.12 0.00 0.00 0.00 0.00 46.02 46.55 3me8 n GLY 121 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 3me8 n ASN 122 N 7.37 1.83 -4.83 1.61 5.15 -1.26 -4.93 115.26 120.21 3me8 n ASN 122 Ca 0.00 -1.43 -0.25 0.00 -0.60 0.00 0.00 54.58 52.30 3me8 n ASN 122 Cb 0.00 0.20 0.01 0.00 -0.53 0.00 0.00 39.78 39.46 3me8 n ASN 122 CO 0.00 0.00 0.00 0.47 1.40 0.00 0.00 177.26 179.13 3me8 n ASP 123 N 0.10 2.69 -4.35 1.20 8.00 0.60 -5.09 116.55 119.69 3me8 n ASP 123 Ca 0.13 -2.85 -0.31 0.00 0.71 0.00 0.00 54.79 52.47 3me8 n ASP 123 Cb 0.44 -0.08 -0.15 0.00 -0.02 0.00 0.00 41.12 41.31 3me8 n ASP 123 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 3me8 s PHE 124 N -2.70 2.39 -0.06 1.24 0.08 -1.26 -0.74 117.98 116.92 3me8 s PHE 124 Ca 0.34 -0.39 -0.15 0.00 0.12 0.00 0.00 56.93 56.86 3me8 s PHE 124 Cb -0.03 -1.48 -0.05 0.00 -0.57 0.00 0.00 43.02 40.89 3me8 s PHE 124 CO 0.21 0.05 0.38 0.42 -0.10 0.00 0.00 175.22 176.19 3me8 s ILE 125 N -0.70 5.15 0.04 0.64 1.01 0.11 -4.85 121.20 122.60 3me8 s ILE 125 Ca 0.11 0.75 -0.28 0.00 0.00 0.00 0.00 60.65 61.24 3me8 s ILE 125 Cb -0.10 -3.69 0.09 0.00 0.01 0.00 0.00 42.46 38.77 3me8 s ILE 125 CO 0.01 0.49 0.90 -1.38 0.00 0.00 0.00 174.94 174.96 3me8 s HIS 126 N -0.43 -0.29 0.59 3.97 -3.43 -1.26 -1.11 115.29 113.33 3me8 s HIS 126 Ca 0.22 0.12 -0.13 0.00 -0.80 0.00 0.00 55.06 54.47 3me8 s HIS 126 Cb -0.15 0.56 -0.05 0.00 -1.43 0.00 0.00 32.58 31.51 3me8 s HIS 126 CO 0.10 -0.62 1.02 -1.25 -2.00 0.00 0.00 174.74 171.99 3me8 s PRO 127 N -3.17 3.65 -0.41 -0.38 0.04 -1.26 -5.04 135.00 128.43 3me8 s PRO 127 Ca 0.07 0.83 -0.14 0.00 0.04 0.00 0.00 61.00 61.79 3me8 s PRO 127 Cb -0.01 -2.09 0.03 0.00 0.04 0.00 0.00 34.50 32.47 3me8 s PRO 127 CO -0.06 -0.52 0.29 -0.80 0.04 0.00 0.00 177.00 175.94 3me8 s ASN 128 N -3.82 6.03 -0.05 6.66 0.01 -1.26 -5.05 114.94 117.46 3me8 s ASN 128 Ca 0.56 -0.96 -0.13 0.00 -0.71 0.00 0.00 52.86 51.63 3me8 s ASN 128 Cb -0.11 -2.13 0.02 0.00 0.41 0.00 0.00 41.25 39.44 3me8 s ASN 128 CO 0.47 -0.45 0.30 0.54 -1.51 0.00 0.00 177.10 176.46 3me8 s VAL 129 N 1.65 0.04 -0.05 1.60 0.11 -1.26 -1.19 120.40 121.29 3me8 s VAL 129 Ca 0.04 -0.33 0.05 0.00 -2.93 0.00 0.00 61.98 58.81 3me8 s VAL 129 Cb -0.19 -0.55 -0.00 0.00 -1.53 0.00 0.00 36.38 34.10 3me8 s VAL 129 CO 0.09 -0.18 -0.20 -0.69 -3.33 0.00 0.00 175.10 170.79 3me8 s VAL 130 N -0.82 1.64 -0.08 2.04 1.01 0.09 -4.10 120.40 120.19 3me8 s VAL 130 Ca -0.09 -0.83 0.01 0.00 0.00 0.00 0.00 61.98 61.07 3me8 s VAL 130 Cb -0.04 -1.41 -0.03 0.00 0.00 0.00 0.00 36.38 34.90 3me8 s VAL 130 CO 0.03 0.47 -0.09 -0.69 0.00 0.00 0.00 175.10 174.82 3me8 s VAL 131 N 0.05 3.51 -0.18 2.92 1.01 0.16 -0.61 120.40 127.27 3me8 s VAL 131 Ca -0.06 -0.54 -0.01 0.00 0.00 0.00 0.00 61.98 61.37 3me8 s VAL 131 Cb -0.13 -2.44 -0.00 0.00 0.00 0.00 0.00 36.38 33.81 3me8 s VAL 131 CO 0.03 0.58 -0.11 -0.69 0.00 0.00 0.00 175.10 174.91 3me8 s VAL 132 N -0.57 2.92 0.08 2.92 1.01 0.13 -0.02 120.40 126.86 3me8 s VAL 132 Ca 0.08 -0.67 0.03 0.00 0.00 0.00 0.00 61.98 61.43 3me8 s VAL 132 Cb -0.12 -2.27 -0.04 0.00 0.00 0.00 0.00 36.38 33.95 3me8 s VAL 132 CO 0.02 0.49 0.06 -0.76 0.00 0.00 0.00 175.10 174.90 3me8 s LEU 133 N 1.02 3.71 1.00 3.92 1.43 0.60 -0.88 118.68 129.48 3me8 s LEU 133 Ca -0.01 -0.05 -0.12 0.00 -1.03 0.00 0.00 54.13 52.91 3me8 s LEU 133 Cb -0.15 -2.39 0.19 0.00 0.03 0.00 0.00 46.19 43.87 3me8 s LEU 133 CO -0.02 0.18 1.09 -0.94 0.23 0.00 0.00 176.35 176.89 3me8 s SER 134 N -2.34 2.59 0.11 2.29 1.04 0.43 -1.72 113.70 116.09 3me8 s SER 134 Ca 0.28 1.23 0.08 0.00 0.48 0.00 0.00 55.95 58.02 3me8 s SER 134 Cb -0.12 -1.90 0.41 0.00 0.10 0.00 0.00 66.02 64.51 3me8 s SER 134 CO 0.21 -3.16 1.24 -2.65 0.98 0.00 0.00 173.24 169.86 3me8 n PRO 135 N -4.20 0.05 -0.39 4.02 -0.02 -1.25 -1.09 135.00 132.12 3me8 n PRO 135 Ca 0.05 0.54 0.08 0.00 -2.02 0.00 0.00 63.50 62.15 3me8 n PRO 135 Cb 0.57 -1.65 0.25 0.00 -0.02 0.00 0.00 33.50 32.64 3me8 n PRO 135 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 3me8 n GLU 136 N -1.76 3.15 -1.10 -0.52 -0.58 -1.26 -1.11 120.64 117.46 3me8 n GLU 136 Ca -0.00 -2.54 -0.03 0.00 -0.42 0.00 0.00 57.16 54.16 3me8 n GLU 136 Cb 0.02 -1.62 -0.01 0.00 -0.57 0.00 0.00 31.44 29.25 3me8 n GLU 136 CO 0.00 0.00 0.00 1.28 -0.48 0.00 0.00 177.13 177.93 3me8 n LEU 137 N 0.48 -0.18 -4.73 -4.62 4.77 -0.25 -4.91 117.00 107.56 3me8 n LEU 137 Ca 0.19 0.08 -0.41 0.00 -0.03 0.00 0.00 56.01 55.85 3me8 n LEU 137 Cb 0.70 -1.01 -0.05 0.00 -2.33 0.00 0.00 43.42 40.73 3me8 n LEU 137 CO 0.15 -0.24 0.63 -1.58 -1.33 0.00 0.00 177.39 175.02 3me8 s GLN 138 N -1.84 4.67 -0.21 3.23 0.74 -1.26 -1.40 119.66 123.60 3me8 s GLN 138 Ca 0.00 1.38 -0.29 0.00 0.05 0.00 0.00 55.36 56.50 3me8 s GLN 138 Cb 0.00 -3.37 -0.02 0.00 1.10 0.00 0.00 33.01 30.72 3me8 s GLN 138 CO 0.00 0.25 1.47 0.42 -0.55 0.00 0.00 175.29 176.87 3me8 s ILE 139 N -0.10 3.92 -0.05 -2.34 1.01 0.83 -0.43 121.20 124.04 3me8 s ILE 139 Ca 0.45 1.06 0.10 0.00 0.00 0.00 0.00 60.65 62.27 3me8 s ILE 139 Cb -0.23 -3.85 -0.15 0.00 0.01 0.00 0.00 42.46 38.24 3me8 s ILE 139 CO 0.29 -0.27 0.17 0.29 0.00 0.00 0.00 174.94 175.41 3me8 n LYS 140 N 7.27 1.05 -3.51 2.79 4.76 -0.06 -0.81 118.16 129.66 3me8 n LYS 140 Ca 0.16 -0.07 -0.16 0.00 -2.87 0.00 0.00 58.31 55.38 3me8 n LYS 140 Cb 0.45 -1.26 -0.05 0.00 -1.84 0.00 0.00 35.03 32.33 3me8 n LYS 140 CO 0.00 0.00 0.00 0.34 -1.37 0.00 0.00 177.40 176.37 3me8 s ASP 141 N -3.61 -0.60 -0.09 4.39 -1.08 -1.04 -4.88 116.67 109.75 3me8 s ASP 141 Ca -0.04 0.57 0.04 0.00 -0.52 0.00 0.00 52.55 52.59 3me8 s ASP 141 Cb 0.06 0.51 0.00 0.00 -1.46 0.00 0.00 42.92 42.03 3me8 s ASP 141 CO 0.44 -0.62 -0.22 -0.31 0.52 0.00 0.00 175.17 174.98 3me8 s TYR 142 N -1.56 2.35 -0.22 -5.34 2.02 -1.26 -0.69 117.35 112.65 3me8 s TYR 142 Ca -0.08 -0.91 -0.01 0.00 -0.37 0.00 0.00 57.07 55.70 3me8 s TYR 142 Cb -0.00 -1.58 0.01 0.00 -0.40 0.00 0.00 41.96 39.99 3me8 s TYR 142 CO 0.05 -0.36 -0.09 0.42 -1.57 0.00 0.00 175.55 174.00 3me8 s ILE 143 N 0.31 2.79 0.19 2.71 1.01 0.22 -4.99 121.20 123.43 3me8 s ILE 143 Ca -0.16 -0.85 0.06 0.00 0.00 0.00 0.00 60.65 59.70 3me8 s ILE 143 Cb -0.17 -2.31 -0.04 0.00 0.01 0.00 0.00 42.46 39.95 3me8 s ILE 143 CO 0.07 0.35 0.16 -0.31 0.00 0.00 0.00 174.94 175.22 3me8 s TYR 144 N 1.36 3.16 0.00 3.97 2.02 -1.26 -0.73 117.35 125.86 3me8 s TYR 144 Ca 0.03 -0.04 0.00 0.00 -0.37 0.00 0.00 57.07 56.69 3me8 s TYR 144 Cb -0.15 -1.49 0.00 0.00 -0.40 0.00 0.00 41.96 39.92 3me8 s TYR 144 CO -0.06 0.52 0.00 0.41 -1.57 0.00 0.00 175.55 174.84 3me8 n GLY 145 N -0.62 -1.83 0.00 0.71 0.00 -0.33 -4.80 105.19 98.32 3me8 n GLY 145 Ca -0.08 -2.02 0.00 0.00 0.00 0.00 0.00 46.02 43.91 3me8 n GLY 145 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 3me8 n VAL 146 N 0.00 0.06 -3.69 1.61 0.24 -1.26 -4.46 118.33 110.82 3me8 n VAL 146 Ca 0.00 -0.23 -0.29 0.00 -2.04 0.00 0.00 64.34 61.79 3me8 n VAL 146 Cb 0.00 1.48 -0.12 0.00 -1.47 0.00 0.00 33.84 33.73 3me8 n VAL 146 CO 0.00 0.00 0.00 0.21 -2.14 0.00 0.00 176.83 174.90 3me8 s ASN 147 N -0.06 3.46 0.26 -1.34 3.04 -1.26 -4.41 114.94 114.63 3me8 s ASN 147 Ca 0.00 -3.04 -0.27 0.00 0.04 0.00 0.00 52.86 49.59 3me8 s ASN 147 Cb 0.00 -1.06 -0.09 0.00 -1.54 0.00 0.00 41.25 38.56 3me8 s ASN 147 CO 0.00 -0.20 0.90 -0.31 -3.04 0.00 0.00 177.10 174.45 3me8 s TYR 148 N -0.18 3.83 0.12 0.43 2.02 -1.26 -5.07 117.35 117.24 3me8 s TYR 148 Ca 0.23 1.77 0.05 0.00 -0.37 0.00 0.00 57.07 58.75 3me8 s TYR 148 Cb -0.13 -2.89 -0.04 0.00 -0.40 0.00 0.00 41.96 38.50 3me8 s TYR 148 CO -0.09 0.36 0.05 0.54 -1.57 0.00 0.00 175.55 174.85 3me8 s ASN 149 N -1.39 5.25 0.14 2.29 2.20 -1.26 -4.96 114.94 117.21 3me8 s ASN 149 Ca 0.44 -0.15 -0.19 0.00 -0.94 0.00 0.00 52.86 52.03 3me8 s ASN 149 Cb -0.22 -1.31 -0.01 0.00 -2.00 0.00 0.00 41.25 37.71 3me8 s ASN 149 CO 0.27 0.14 1.74 0.22 -2.94 0.00 0.00 177.10 176.53 3me8 h TYR 150 N 3.06 0.10 -0.71 1.54 3.20 -1.97 -3.04 116.97 119.15 3me8 h TYR 150 Ca -0.47 0.01 -0.00 0.00 3.14 0.00 0.00 58.73 61.41 3me8 h TYR 150 Cb 1.18 -0.01 -0.03 0.00 1.54 0.00 0.00 36.73 39.40 3me8 h TYR 150 CO 0.60 0.04 0.43 1.25 -1.64 0.00 0.00 178.16 178.84 3me8 h LEU 151 N 0.16 0.85 -1.31 2.82 5.85 -1.99 -0.44 115.31 121.24 3me8 h LEU 151 Ca 0.11 -0.06 -0.01 0.00 0.84 0.00 0.00 57.88 58.77 3me8 h LEU 151 Cb 0.10 -0.21 -0.03 0.00 0.37 0.00 0.00 40.66 40.89 3me8 h LEU 151 CO -0.14 0.65 0.34 1.05 -0.34 0.00 0.00 178.44 180.00 3me8 h GLU 152 N 0.97 0.81 -0.16 1.25 4.11 -1.97 0.14 114.58 119.72 3me8 h GLU 152 Ca 0.26 -0.07 -0.18 0.00 0.07 0.00 0.00 59.36 59.43 3me8 h GLU 152 Cb -0.04 -0.17 0.01 0.00 0.50 0.00 0.00 28.75 29.04 3me8 h GLU 152 CO -0.05 0.58 -0.62 0.74 0.07 0.00 0.00 179.01 179.73 3me8 h PHE 153 N 0.82 0.93 -0.31 2.06 -1.00 -1.31 -1.43 116.94 116.69 3me8 h PHE 153 Ca 0.21 -0.39 0.03 0.00 2.81 0.00 0.00 57.97 60.63 3me8 h PHE 153 Cb -0.00 -0.15 -0.03 0.00 3.61 0.00 0.00 35.95 39.37 3me8 h PHE 153 CO 0.00 1.20 0.11 0.28 -1.61 0.00 0.00 178.31 178.29 3me8 h VAL 154 N 0.40 0.92 -0.89 -0.55 2.07 -0.71 -0.85 116.25 116.63 3me8 h VAL 154 Ca -0.03 -0.08 -0.01 0.00 0.82 0.00 0.00 66.70 67.40 3me8 h VAL 154 Cb 1.25 0.65 -0.04 0.00 -1.52 0.00 0.00 31.29 31.62 3me8 h VAL 154 CO 0.13 0.05 0.54 0.78 0.02 0.00 0.00 177.57 179.08 3me8 h ASN 155 N 0.25 1.08 -0.52 0.57 2.35 -0.97 -1.13 115.58 117.20 3me8 h ASN 155 Ca 0.14 -0.07 -0.06 0.00 -0.55 0.00 0.00 56.30 55.76 3me8 h ASN 155 Cb 0.11 -0.27 -0.02 0.00 0.05 0.00 0.00 38.32 38.18 3me8 h ASN 155 CO -0.14 0.83 0.10 0.00 -1.65 0.00 0.00 177.43 176.56 3me8 h ALA 156 N 1.29 0.69 -0.45 -0.83 0.00 -0.84 -1.60 119.26 117.53 3me8 h ALA 156 Ca 0.32 -0.23 -0.11 0.00 0.00 0.00 0.00 54.91 54.89 3me8 h ALA 156 Cb -0.05 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.53 3me8 h ALA 156 CO -0.06 0.42 -0.16 -0.07 0.00 0.00 0.00 179.25 179.38 3me8 h LEU 157 N 0.75 0.86 -0.34 0.00 3.38 -0.85 -0.12 115.31 118.98 3me8 h LEU 157 Ca 0.16 -0.29 0.02 0.00 0.09 0.00 0.00 57.88 57.86 3me8 h LEU 157 Cb 0.38 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.88 3me8 h LEU 157 CO 0.01 1.02 0.19 0.03 0.09 0.00 0.00 178.44 179.78 3me8 h ARG 158 N 0.76 0.38 -0.78 1.13 3.08 -1.03 -1.77 114.38 116.16 3me8 h ARG 158 Ca 0.11 -0.02 0.05 0.00 0.07 0.00 0.00 59.98 60.19 3me8 h ARG 158 Cb 0.68 -0.09 -0.06 0.00 0.08 0.00 0.00 29.97 30.59 3me8 h ARG 158 CO 0.05 0.25 0.47 -0.07 -1.07 0.00 0.00 179.97 179.61 3me8 h LEU 159 N 0.40 0.74 -1.40 3.04 3.38 -1.00 0.28 115.31 120.75 3me8 h LEU 159 Ca 0.13 0.02 0.05 0.00 0.09 0.00 0.00 57.88 58.17 3me8 h LEU 159 Cb 0.01 -0.14 -0.04 0.00 0.09 0.00 0.00 40.66 40.58 3me8 h LEU 159 CO -0.07 0.49 0.45 0.00 0.09 0.00 0.00 178.44 179.40 3me8 h ALA 160 N 1.37 1.69 -0.15 1.53 0.00 -0.67 -1.41 119.26 121.61 3me8 h ALA 160 Ca 0.33 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.22 3me8 h ALA 160 Cb 0.13 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 17.73 3me8 h ALA 160 CO -0.16 0.21 0.00 0.54 0.00 0.00 0.00 179.25 179.84 3me8 n ARG 161 N -4.47 1.63 -2.41 0.00 1.74 -0.70 -4.19 116.66 108.26 3me8 n ARG 161 Ca 0.09 -0.95 -0.11 0.00 -0.77 0.00 0.00 57.85 56.12 3me8 n ARG 161 Cb 0.19 -1.37 0.01 0.00 -1.02 0.00 0.00 32.46 30.27 3me8 n ARG 161 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3me8 n GLY 162 N 1.07 0.01 3.77 -0.13 0.00 -0.53 -5.03 105.19 104.35 3me8 n GLY 162 Ca 0.15 -0.39 -0.30 0.00 0.00 0.00 0.00 46.02 45.48 3me8 n GLY 162 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3me8 s GLU 163 N -4.80 2.18 -1.09 1.61 2.02 0.90 -4.81 118.70 114.71 3me8 s GLU 163 Ca 0.07 -2.23 -0.01 0.00 0.02 0.00 0.00 54.97 52.82 3me8 s GLU 163 Cb -0.03 -1.71 0.00 0.00 0.10 0.00 0.00 34.13 32.49 3me8 s GLU 163 CO 0.09 -0.35 0.15 0.41 0.02 0.00 0.00 175.26 175.58 3me8 n GLY 164 N -1.33 -0.15 0.03 -1.39 0.00 -1.26 -3.79 105.19 97.30 3me8 n GLY 164 Ca -0.12 -0.28 0.01 0.00 0.00 0.00 0.00 46.02 45.64 3me8 n GLY 164 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 3me8 n HIS 165 N -4.03 0.00 1.63 1.61 1.44 -1.26 -4.75 115.22 109.86 3me8 n HIS 165 Ca -0.13 0.00 0.15 0.00 -2.01 0.00 0.00 57.72 55.73 3me8 n HIS 165 Cb 0.60 0.00 0.81 0.00 0.12 0.00 0.00 29.99 31.53 3me8 n HIS 165 CO 0.00 0.00 0.00 0.72 -2.81 0.00 0.00 176.34 174.25 3me8 n HIS 166 N -0.72 0.00 0.59 -1.40 8.25 -1.26 -2.44 115.22 118.25 3me8 n HIS 166 Ca 0.01 0.00 0.10 0.00 -0.26 0.00 0.00 57.72 57.57 3me8 n HIS 166 Cb 0.05 -0.17 0.41 0.00 1.12 0.00 0.00 29.99 31.40 3me8 n HIS 166 CO 0.00 0.00 0.00 -2.39 0.64 0.00 0.00 176.34 174.59 3me8 n HIS 167 N -1.13 0.22 -4.05 4.41 1.44 -1.26 -4.80 115.22 110.05 3me8 n HIS 167 Ca 0.18 0.08 -0.12 0.00 -2.01 0.00 0.00 57.72 55.85 3me8 n HIS 167 Cb 0.20 -0.63 -0.12 0.00 0.12 0.00 0.00 29.99 29.56 3me8 n HIS 167 CO 0.00 0.00 0.00 -1.58 -2.81 0.00 0.00 176.34 171.95 3me8 s HIS 168 N -3.07 0.55 -1.24 -1.40 5.65 -1.02 -5.06 115.29 109.70 3me8 s HIS 168 Ca 0.08 -0.47 0.19 0.00 0.25 0.00 0.00 55.06 55.12 3me8 s HIS 168 Cb 0.12 -0.34 0.91 0.00 -1.18 0.00 0.00 32.58 32.09 3me8 s HIS 168 CO 0.37 -0.10 1.61 -2.39 -0.65 0.00 0.00 174.74 173.58 3me8 n HIS 169 N 1.63 0.00 0.44 3.88 1.44 -1.26 -5.00 115.22 116.36 3me8 n HIS 169 Ca -0.22 0.00 0.05 0.00 -2.01 0.00 0.00 57.72 55.54 3me8 n HIS 169 Cb 0.55 -0.38 0.04 0.00 0.12 0.00 0.00 29.99 30.33 3me8 n HIS 169 CO 0.00 0.00 0.00 0.72 -2.81 0.00 0.00 176.34 174.25