#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hh8 n ASP 31 N 0.00 0.76 -4.77 -3.46 8.00 -1.26 -4.92 116.55 110.91 3hh8 n ASP 31 Ca 0.00 -0.75 -0.38 0.00 0.71 0.00 0.00 54.79 54.36 3hh8 n ASP 31 Cb 0.00 1.22 -0.01 0.00 -0.02 0.00 0.00 41.12 42.31 3hh8 n ASP 31 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 3hh8 s LYS 32 N -3.12 3.92 0.27 -1.24 1.02 -1.26 -4.97 119.74 114.36 3hh8 s LYS 32 Ca 0.04 1.97 -0.30 0.00 0.02 0.00 0.00 55.97 57.70 3hh8 s LYS 32 Cb 0.16 -2.64 -0.11 0.00 -0.52 0.00 0.00 37.83 34.72 3hh8 s LYS 32 CO 0.88 -0.47 1.58 -1.17 -0.92 0.00 0.00 175.35 175.24 3hh8 s LEU 33 N -2.62 4.35 -0.26 3.17 2.96 -1.26 -4.70 118.68 120.33 3hh8 s LEU 33 Ca 0.59 2.88 -0.12 0.00 -0.22 0.00 0.00 54.13 57.25 3hh8 s LEU 33 Cb -0.34 -3.63 -0.05 0.00 0.50 0.00 0.00 46.19 42.68 3hh8 s LEU 33 CO 0.42 -0.88 0.25 -0.54 -1.32 0.00 0.00 176.35 174.29 3hh8 s LYS 34 N -0.28 4.01 -0.04 1.98 1.02 -1.26 -0.66 119.74 124.52 3hh8 s LYS 34 Ca 0.64 -0.17 0.04 0.00 0.02 0.00 0.00 55.97 56.50 3hh8 s LYS 34 Cb -0.47 -3.62 -0.01 0.00 -0.52 0.00 0.00 37.83 33.22 3hh8 s LYS 34 CO 0.45 -0.14 -0.17 0.08 -0.92 0.00 0.00 175.35 174.65 3hh8 s VAL 35 N 1.65 1.39 -0.07 3.17 1.01 0.20 0.37 120.40 128.12 3hh8 s VAL 35 Ca 0.10 -0.71 0.05 0.00 0.00 0.00 0.00 61.98 61.42 3hh8 s VAL 35 Cb -0.15 -1.19 -0.00 0.00 0.00 0.00 0.00 36.38 35.03 3hh8 s VAL 35 CO 0.09 0.40 -0.23 -0.69 0.00 0.00 0.00 175.10 174.67 3hh8 s VAL 36 N -0.05 1.95 0.02 2.92 1.01 -0.47 -1.25 120.40 124.53 3hh8 s VAL 36 Ca -0.01 -0.99 0.06 0.00 0.00 0.00 0.00 61.98 61.04 3hh8 s VAL 36 Cb -0.10 -1.67 -0.03 0.00 0.00 0.00 0.00 36.38 34.58 3hh8 s VAL 36 CO 0.01 0.54 -0.18 0.00 0.00 0.00 0.00 175.10 175.48 3hh8 s ALA 37 N 0.08 2.59 0.31 5.51 0.00 -0.03 -0.07 121.76 130.15 3hh8 s ALA 37 Ca -0.10 -1.15 0.11 0.00 0.00 0.00 0.00 51.96 50.83 3hh8 s ALA 37 Cb -0.15 -0.78 0.50 0.00 0.00 0.00 0.00 23.12 22.69 3hh8 s ALA 37 CO 0.05 0.57 1.70 1.79 0.00 0.00 0.00 175.76 179.87 3hh8 h THR 38 N 4.04 1.37 -4.10 0.00 1.35 -1.57 -0.86 112.91 113.14 3hh8 h THR 38 Ca -0.47 -1.79 -0.18 0.00 -0.55 0.00 0.00 66.41 63.42 3hh8 h THR 38 Cb 1.15 1.97 -0.11 0.00 -1.73 0.00 0.00 68.15 69.43 3hh8 h THR 38 CO 0.48 0.51 -0.30 0.54 -0.25 0.00 0.00 175.52 176.50 3hh8 s ASN 39 N -6.87 0.30 0.45 5.36 2.20 -1.26 -1.11 114.94 113.99 3hh8 s ASN 39 Ca -0.02 -1.24 0.20 0.00 -0.94 0.00 0.00 52.86 50.86 3hh8 s ASN 39 Cb 0.13 0.54 1.06 0.00 -2.00 0.00 0.00 41.25 40.98 3hh8 s ASN 39 CO 0.75 -1.08 1.94 0.77 -2.94 0.00 0.00 177.10 176.54 3hh8 h SER 40 N 2.33 0.00 0.22 3.54 4.64 -1.88 -0.51 113.55 121.89 3hh8 h SER 40 Ca -0.30 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.01 3hh8 h SER 40 Cb 1.25 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.34 3hh8 h SER 40 CO 0.42 0.23 -0.11 0.40 -0.87 0.00 0.00 176.83 176.90 3hh8 h ILE 41 N 0.00 0.81 -0.92 0.95 2.04 -1.94 -0.51 117.51 117.94 3hh8 h ILE 41 Ca -0.00 -0.84 -0.00 0.00 1.00 0.00 0.00 64.86 65.02 3hh8 h ILE 41 Cb 0.50 1.25 -0.04 0.00 -0.74 0.00 0.00 36.82 37.79 3hh8 h ILE 41 CO 0.03 0.17 0.56 0.40 0.00 0.00 0.00 178.15 179.30 3hh8 h ILE 42 N -0.77 1.25 -0.69 -0.67 2.04 -1.95 -1.01 117.51 115.72 3hh8 h ILE 42 Ca -0.03 -0.54 -0.06 0.00 1.00 0.00 0.00 64.86 65.22 3hh8 h ILE 42 Cb 0.50 -0.05 -0.03 0.00 -0.74 0.00 0.00 36.82 36.51 3hh8 h ILE 42 CO 0.05 0.26 0.18 0.00 0.00 0.00 0.00 178.15 178.64 3hh8 h ALA 43 N 1.35 1.01 -0.33 1.87 0.00 -1.07 -0.33 119.26 121.76 3hh8 h ALA 43 Ca 0.33 -0.24 -0.06 0.00 0.00 0.00 0.00 54.91 54.94 3hh8 h ALA 43 Cb -0.06 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.45 3hh8 h ALA 43 CO -0.06 0.65 -0.03 0.22 0.00 0.00 0.00 179.25 180.03 3hh8 h ASP 44 N 1.04 0.59 -0.68 0.00 3.58 -0.66 0.24 116.42 120.53 3hh8 h ASP 44 Ca 0.22 -0.33 0.06 0.00 0.42 0.00 0.00 57.03 57.40 3hh8 h ASP 44 Cb 0.35 -0.16 -0.06 0.00 1.72 0.00 0.00 39.33 41.18 3hh8 h ASP 44 CO -0.00 0.78 0.37 0.24 -2.88 0.00 0.00 179.24 177.75 3hh8 h MET 45 N 0.39 0.66 -0.51 0.28 2.86 -0.96 -1.05 114.93 116.59 3hh8 h MET 45 Ca 0.09 -0.04 0.02 0.00 -2.06 0.00 0.00 59.70 57.70 3hh8 h MET 45 Cb 0.50 -0.15 -0.03 0.00 0.06 0.00 0.00 31.60 31.98 3hh8 h MET 45 CO 0.02 0.44 0.32 1.15 1.06 0.00 0.00 176.91 179.90 3hh8 h THR 46 N 0.68 1.09 -0.75 2.22 2.02 -0.68 -1.94 112.91 115.54 3hh8 h THR 46 Ca 0.31 -0.22 0.00 0.00 0.77 0.00 0.00 66.41 67.27 3hh8 h THR 46 Cb 0.21 0.38 -0.04 0.00 -1.74 0.00 0.00 68.15 66.96 3hh8 h THR 46 CO -0.19 0.12 0.48 0.11 0.37 0.00 0.00 175.52 176.41 3hh8 h LYS 47 N 0.65 1.00 -0.28 6.66 1.57 -0.55 0.10 116.57 125.72 3hh8 h LYS 47 Ca 0.20 -0.07 -0.05 0.00 -1.87 0.00 0.00 60.65 58.86 3hh8 h LYS 47 Cb -0.02 -0.22 -0.02 0.00 0.08 0.00 0.00 32.23 32.05 3hh8 h LYS 47 CO -0.07 0.68 -0.03 0.00 -0.57 0.00 0.00 179.45 179.45 3hh8 h ALA 48 N 1.51 1.43 0.19 3.86 0.00 -0.46 0.60 119.26 126.39 3hh8 h ALA 48 Ca 0.27 -0.19 -0.34 0.00 0.00 0.00 0.00 54.91 54.65 3hh8 h ALA 48 Cb -0.09 -0.13 0.02 0.00 0.00 0.00 0.00 17.79 17.59 3hh8 h ALA 48 CO -0.06 0.40 -1.62 0.82 0.00 0.00 0.00 179.25 178.80 3hh8 h ILE 49 N 0.41 1.10 0.00 0.00 2.04 -0.82 -3.41 117.51 116.82 3hh8 h ILE 49 Ca 0.09 -2.64 -0.13 0.00 1.00 0.00 0.00 64.86 63.18 3hh8 h ILE 49 Cb 0.33 2.86 -0.02 0.00 -0.74 0.00 0.00 36.82 39.24 3hh8 h ILE 49 CO 0.01 0.84 -2.10 0.00 0.00 0.00 0.00 178.15 176.90 3hh8 n ALA 50 N -2.77 2.33 -0.50 1.87 0.00 0.30 -4.31 120.51 117.42 3hh8 n ALA 50 Ca -0.20 -0.79 0.00 0.00 0.00 0.00 0.00 53.44 52.45 3hh8 n ALA 50 Cb 1.08 -0.53 0.00 0.00 0.00 0.00 0.00 19.45 20.00 3hh8 n ALA 50 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3hh8 n GLY 51 N 1.47 2.54 0.77 0.00 0.00 0.19 -1.65 105.19 108.51 3hh8 n GLY 51 Ca -0.14 -0.20 0.04 0.00 0.00 0.00 0.00 46.02 45.72 3hh8 n GLY 51 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3hh8 n ASP 52 N 1.02 2.19 0.25 1.61 5.75 -1.26 -4.04 116.55 122.07 3hh8 n ASP 52 Ca 0.00 -2.14 0.15 0.00 -0.01 0.00 0.00 54.79 52.80 3hh8 n ASP 52 Cb 0.00 -0.34 0.53 0.00 -1.03 0.00 0.00 41.12 40.28 3hh8 n ASP 52 CO 0.00 0.00 0.00 0.11 -0.11 0.00 0.00 177.20 177.20 3hh8 h LYS 53 N 1.84 0.00 -5.71 0.11 1.79 -1.73 -3.46 116.57 109.40 3hh8 h LYS 53 Ca 0.00 0.00 -0.56 0.00 -2.18 0.00 0.00 60.65 57.91 3hh8 h LYS 53 Cb 0.68 0.00 -0.14 0.00 -1.58 0.00 0.00 32.23 31.19 3hh8 h LYS 53 CO 0.07 0.00 -0.67 0.96 -1.08 0.00 0.00 179.45 178.73 3hh8 s ILE 54 N -3.51 1.93 -0.38 1.86 -4.36 -1.26 -4.23 121.20 111.26 3hh8 s ILE 54 Ca 0.03 -2.16 -0.12 0.00 -0.26 0.00 0.00 60.65 58.14 3hh8 s ILE 54 Cb 0.08 -2.57 0.02 0.00 1.25 0.00 0.00 42.46 41.24 3hh8 s ILE 54 CO 0.57 -0.23 0.23 -1.81 0.24 0.00 0.00 174.94 173.93 3hh8 s ASP 55 N -3.53 5.85 -0.11 4.36 1.01 0.17 -4.95 116.67 119.46 3hh8 s ASP 55 Ca 0.31 -0.91 0.01 0.00 0.71 0.00 0.00 52.55 52.67 3hh8 s ASP 55 Cb 0.03 -2.07 -0.02 0.00 1.01 0.00 0.00 42.92 41.88 3hh8 s ASP 55 CO 0.14 -0.38 -0.13 -0.22 0.21 0.00 0.00 175.17 174.79 3hh8 s LEU 56 N 1.60 2.74 -0.09 1.23 2.96 -1.26 -0.63 118.68 125.23 3hh8 s LEU 56 Ca 0.03 -0.29 0.04 0.00 -0.22 0.00 0.00 54.13 53.69 3hh8 s LEU 56 Cb -0.19 -1.60 0.00 0.00 0.50 0.00 0.00 46.19 44.90 3hh8 s LEU 56 CO 0.08 0.20 -0.21 -2.28 -1.32 0.00 0.00 176.35 172.82 3hh8 s HIS 57 N 0.12 2.23 -0.14 5.38 5.65 -0.38 -5.00 115.29 123.16 3hh8 s HIS 57 Ca -0.06 -0.88 -0.02 0.00 0.25 0.00 0.00 55.06 54.35 3hh8 s HIS 57 Cb -0.15 -1.52 -0.03 0.00 -1.18 0.00 0.00 32.58 29.71 3hh8 s HIS 57 CO 0.05 -0.36 -0.06 0.45 -0.65 0.00 0.00 174.74 174.17 3hh8 s SER 58 N 0.38 4.63 -0.09 9.88 0.15 -1.26 -0.85 113.70 126.53 3hh8 s SER 58 Ca -0.16 -0.15 -0.01 0.00 0.70 0.00 0.00 55.95 56.33 3hh8 s SER 58 Cb -0.17 -1.67 -0.00 0.00 -1.71 0.00 0.00 66.02 62.47 3hh8 s SER 58 CO 0.07 0.20 0.03 0.40 1.20 0.00 0.00 173.24 175.14 3hh8 h ILE 59 N 5.07 0.00 -3.03 6.45 2.04 -1.20 -3.45 117.51 123.39 3hh8 h ILE 59 Ca -0.32 -0.95 -0.56 0.00 1.00 0.00 0.00 64.86 64.03 3hh8 h ILE 59 Cb 1.19 0.00 -0.03 0.00 -0.74 0.00 0.00 36.82 37.25 3hh8 h ILE 59 CO 0.60 0.00 0.76 -0.69 0.00 0.00 0.00 178.15 178.82 3hh8 s VAL 60 N -1.63 4.24 0.58 1.67 1.01 -0.27 -4.97 120.40 121.04 3hh8 s VAL 60 Ca -0.00 1.56 -0.20 0.00 0.00 0.00 0.00 61.98 63.33 3hh8 s VAL 60 Cb 0.00 -4.00 -0.04 0.00 0.00 0.00 0.00 36.38 32.34 3hh8 s VAL 60 CO 0.01 -0.04 1.31 -2.84 0.00 0.00 0.00 175.10 173.54 3hh8 s PRO 61 N 2.58 2.98 0.12 2.72 0.02 -1.26 -4.09 135.00 138.07 3hh8 s PRO 61 Ca 0.56 2.10 -0.35 0.00 0.02 0.00 0.00 61.00 63.33 3hh8 s PRO 61 Cb -0.24 -2.10 -0.16 0.00 0.02 0.00 0.00 34.50 32.02 3hh8 s PRO 61 CO 0.20 -1.28 1.27 -0.89 -0.33 0.00 0.00 177.00 175.98 3hh8 n ILE 62 N -1.33 0.35 -0.82 2.83 5.41 -1.26 -1.73 119.36 122.80 3hh8 n ILE 62 Ca 0.12 -0.09 0.00 0.00 1.00 0.00 0.00 62.75 63.78 3hh8 n ILE 62 Cb 0.47 -0.84 0.00 0.00 -0.71 0.00 0.00 39.64 38.56 3hh8 n ILE 62 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 3hh8 n GLY 63 N 2.33 0.93 3.92 7.39 0.00 -1.26 -5.00 105.19 113.50 3hh8 n GLY 63 Ca 0.17 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.90 3hh8 n GLY 63 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3hh8 s GLN 64 N -0.17 3.49 0.02 1.61 -1.52 -0.71 -4.25 119.66 118.14 3hh8 s GLN 64 Ca 0.00 -0.38 -0.30 0.00 -1.95 0.00 0.00 55.36 52.73 3hh8 s GLN 64 Cb 0.00 -2.94 -0.08 0.00 -0.22 0.00 0.00 33.01 29.77 3hh8 s GLN 64 CO 0.00 0.52 1.80 0.34 -0.25 0.00 0.00 175.29 177.70 3hh8 s ASP 65 N -2.77 6.54 0.00 5.90 3.68 -1.26 -4.79 116.67 123.97 3hh8 s ASP 65 Ca 0.37 2.50 0.28 0.00 2.13 0.00 0.00 52.55 57.83 3hh8 s ASP 65 Cb -0.12 -2.54 1.04 0.00 -1.45 0.00 0.00 42.92 39.85 3hh8 s ASP 65 CO 0.28 -0.98 1.74 -0.81 0.13 0.00 0.00 175.17 175.52 3hh8 n PRO 66 N 6.96 1.32 0.02 4.34 -0.04 -1.26 -4.04 135.00 142.30 3hh8 n PRO 66 Ca 0.18 -0.71 -0.16 0.00 -0.04 0.00 0.00 63.50 62.77 3hh8 n PRO 66 Cb 0.41 -1.49 -0.05 0.00 -0.04 0.00 0.00 33.50 32.34 3hh8 n PRO 66 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 3hh8 h HIS 67 N 1.74 0.87 -2.95 0.54 3.86 -1.91 -3.41 115.15 113.88 3hh8 h HIS 67 Ca 0.00 -0.42 -0.39 0.00 -1.16 0.00 0.00 60.37 58.40 3hh8 h HIS 67 Cb 0.46 -0.12 -0.39 0.00 1.06 0.00 0.00 27.41 28.42 3hh8 h HIS 67 CO 0.00 1.24 -0.70 -2.00 0.86 0.00 0.00 177.93 177.32 3hh8 s GLU 68 N -3.53 0.07 0.02 2.45 2.56 -1.26 -4.58 118.70 114.43 3hh8 s GLU 68 Ca -0.08 0.13 -0.00 0.00 0.00 0.00 0.00 54.97 55.01 3hh8 s GLU 68 Cb 0.09 -1.32 -0.02 0.00 2.00 0.00 0.00 34.13 34.88 3hh8 s GLU 68 CO 0.89 -0.58 -0.02 -0.47 -0.56 0.00 0.00 175.26 174.52 3hh8 s TYR 69 N 2.21 0.23 -0.41 5.30 5.04 -1.26 -4.83 117.35 123.64 3hh8 s TYR 69 Ca 0.04 -0.48 -0.09 0.00 -2.44 0.00 0.00 57.07 54.10 3hh8 s TYR 69 Cb -0.15 -0.17 0.07 0.00 0.35 0.00 0.00 41.96 42.06 3hh8 s TYR 69 CO -0.09 -0.18 0.24 -2.00 -1.34 0.00 0.00 175.55 172.19 3hh8 s GLU 70 N -1.36 2.62 0.45 4.97 2.12 -1.26 -4.77 118.70 121.47 3hh8 s GLU 70 Ca -0.15 -1.41 -0.23 0.00 0.36 0.00 0.00 54.97 53.54 3hh8 s GLU 70 Cb -0.09 -3.76 -0.10 0.00 0.26 0.00 0.00 34.13 30.44 3hh8 s GLU 70 CO -0.01 -0.91 0.97 -2.30 -0.54 0.00 0.00 175.26 172.47 3hh8 n PRO 71 N 4.92 1.23 -2.51 4.30 -0.02 -1.26 -5.00 135.00 136.65 3hh8 n PRO 71 Ca -0.10 0.45 -0.25 0.00 -2.02 0.00 0.00 63.50 61.58 3hh8 n PRO 71 Cb 0.43 -2.03 0.04 0.00 -0.02 0.00 0.00 33.50 31.92 3hh8 n PRO 71 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 3hh8 s LEU 72 N -0.59 3.23 0.29 2.45 1.43 -1.26 -4.92 118.68 119.31 3hh8 s LEU 72 Ca 0.65 0.46 0.03 0.00 -1.03 0.00 0.00 54.13 54.24 3hh8 s LEU 72 Cb -0.53 -3.27 0.69 0.00 0.03 0.00 0.00 46.19 43.11 3hh8 s LEU 72 CO 0.55 -1.12 1.73 -0.65 0.23 0.00 0.00 176.35 177.10 3hh8 h PRO 73 N -0.11 0.52 -0.99 1.29 0.11 -2.01 -0.67 132.00 130.14 3hh8 h PRO 73 Ca -0.45 -0.03 0.05 0.00 0.11 0.00 0.00 66.00 65.68 3hh8 h PRO 73 Cb 1.27 -0.12 -0.06 0.00 0.11 0.00 0.00 31.00 32.21 3hh8 h PRO 73 CO 0.59 0.34 0.65 1.49 -0.21 0.00 0.00 178.00 180.86 3hh8 h GLU 74 N 0.53 1.18 -0.47 1.05 4.81 -2.00 -2.05 114.58 117.63 3hh8 h GLU 74 Ca 0.54 -0.07 -0.02 0.00 -0.13 0.00 0.00 59.36 59.68 3hh8 h GLU 74 Cb 0.94 -0.27 -0.02 0.00 0.63 0.00 0.00 28.75 30.03 3hh8 h GLU 74 CO -0.45 0.78 0.22 -0.44 -0.73 0.00 0.00 179.01 178.39 3hh8 h ASP 75 N 1.22 0.63 -0.57 1.04 3.32 -1.49 -0.00 116.42 120.56 3hh8 h ASP 75 Ca 0.41 -0.14 -0.07 0.00 0.02 0.00 0.00 57.03 57.25 3hh8 h ASP 75 Cb 0.08 -0.16 -0.02 0.00 0.22 0.00 0.00 39.33 39.45 3hh8 h ASP 75 CO -0.14 0.59 0.07 0.00 -1.72 0.00 0.00 179.24 178.03 3hh8 h ALA 76 N 1.06 0.76 -0.00 3.45 0.00 -1.21 -1.26 119.26 122.06 3hh8 h ALA 76 Ca 0.16 -0.26 -0.00 0.00 0.00 0.00 0.00 54.91 54.81 3hh8 h ALA 76 Cb 0.13 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 17.71 3hh8 h ALA 76 CO -0.02 0.53 0.00 1.49 0.00 0.00 0.00 179.25 181.25 3hh8 h GLU 77 N 0.85 0.00 -0.95 0.00 4.81 -1.12 -1.20 114.58 116.97 3hh8 h GLU 77 Ca 0.17 -0.00 0.02 0.00 -0.13 0.00 0.00 59.36 59.42 3hh8 h GLU 77 Cb 0.45 -0.00 -0.05 0.00 0.63 0.00 0.00 28.75 29.78 3hh8 h GLU 77 CO 0.02 0.03 0.63 0.87 -0.73 0.00 0.00 179.01 179.83 3hh8 h LYS 78 N -0.03 1.21 -0.23 1.92 1.79 -0.89 -1.75 116.57 118.60 3hh8 h LYS 78 Ca 0.00 -0.07 -0.04 0.00 -2.18 0.00 0.00 60.65 58.36 3hh8 h LYS 78 Cb 0.03 -0.27 -0.01 0.00 -1.58 0.00 0.00 32.23 30.40 3hh8 h LYS 78 CO -0.00 0.80 -0.00 1.15 -1.08 0.00 0.00 179.45 180.32 3hh8 h THR 79 N 1.25 1.26 -0.97 -0.16 2.02 -1.11 -0.09 112.91 115.11 3hh8 h THR 79 Ca 0.36 -0.90 0.02 0.00 0.77 0.00 0.00 66.41 66.66 3hh8 h THR 79 Cb -0.08 1.41 -0.05 0.00 -1.74 0.00 0.00 68.15 67.69 3hh8 h THR 79 CO -0.10 0.28 0.64 -1.28 0.37 0.00 0.00 175.52 175.43 3hh8 h SER 80 N 0.17 1.10 0.23 4.18 0.87 -0.91 -2.53 113.55 116.66 3hh8 h SER 80 Ca 0.06 -0.02 0.00 0.00 -1.23 0.00 0.00 61.79 60.60 3hh8 h SER 80 Cb 0.41 -0.27 0.00 0.00 -0.44 0.00 0.00 62.40 62.11 3hh8 h SER 80 CO 0.01 0.78 -0.16 0.59 -0.53 0.00 0.00 176.83 177.53 3hh8 n ASN 81 N -4.40 0.87 -4.76 6.23 3.02 -0.69 -4.96 115.26 110.57 3hh8 n ASN 81 Ca 0.12 -0.88 -0.36 0.00 -0.03 0.00 0.00 54.58 53.43 3hh8 n ASN 81 Cb 0.03 0.03 0.03 0.00 -0.61 0.00 0.00 39.78 39.27 3hh8 n ASN 81 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3hh8 s ALA 82 N -2.40 2.63 -0.01 5.41 0.00 -0.06 -4.89 121.76 122.44 3hh8 s ALA 82 Ca 0.29 1.01 0.01 0.00 0.00 0.00 0.00 51.96 53.27 3hh8 s ALA 82 Cb 0.20 -3.45 -0.26 0.00 0.00 0.00 0.00 23.12 19.61 3hh8 s ALA 82 CO 0.47 -1.09 0.78 -0.44 0.00 0.00 0.00 175.76 175.49 3hh8 h ASP 83 N 1.10 0.27 -4.17 0.00 3.32 -0.42 -3.48 116.42 113.04 3hh8 h ASP 83 Ca -0.50 -0.43 -0.15 0.00 0.02 0.00 0.00 57.03 55.96 3hh8 h ASP 83 Cb 1.29 -0.09 -0.24 0.00 0.22 0.00 0.00 39.33 40.51 3hh8 h ASP 83 CO 0.56 1.37 -0.42 0.54 -1.72 0.00 0.00 179.24 179.57 3hh8 s VAL 84 N -2.61 0.02 -0.07 -1.35 0.11 -0.96 -4.78 120.40 110.76 3hh8 s VAL 84 Ca -0.09 -0.18 0.02 0.00 -2.93 0.00 0.00 61.98 58.80 3hh8 s VAL 84 Cb 0.07 -0.40 0.01 0.00 -1.53 0.00 0.00 36.38 34.53 3hh8 s VAL 84 CO 0.83 -0.10 -0.13 -0.63 -3.33 0.00 0.00 175.10 171.74 3hh8 s ILE 85 N -0.32 1.23 -0.10 7.04 1.01 0.35 -1.36 121.20 129.04 3hh8 s ILE 85 Ca -0.04 -0.53 0.01 0.00 0.00 0.00 0.00 60.65 60.08 3hh8 s ILE 85 Cb -0.03 -1.11 -0.02 0.00 0.01 0.00 0.00 42.46 41.31 3hh8 s ILE 85 CO 0.01 0.37 -0.11 -0.36 0.00 0.00 0.00 174.94 174.85 3hh8 s PHE 86 N 0.62 2.83 0.15 3.97 0.08 0.90 -0.87 117.98 125.66 3hh8 s PHE 86 Ca -0.15 -0.38 0.01 0.00 0.12 0.00 0.00 56.93 56.53 3hh8 s PHE 86 Cb -0.16 -1.78 -0.04 0.00 -0.57 0.00 0.00 43.02 40.46 3hh8 s PHE 86 CO 0.04 -0.01 0.02 1.52 -0.10 0.00 0.00 175.22 176.70 3hh8 s TYR 87 N -0.09 1.07 0.00 0.36 -0.85 -0.59 -1.50 117.35 115.75 3hh8 s TYR 87 Ca -0.01 -1.10 -0.23 0.00 -0.52 0.00 0.00 57.07 55.21 3hh8 s TYR 87 Cb -0.14 -0.61 -0.18 0.00 0.38 0.00 0.00 41.96 41.41 3hh8 s TYR 87 CO 0.03 -0.33 1.25 -0.97 -1.52 0.00 0.00 175.55 174.01 3hh8 h ASN 88 N 2.77 0.23 0.00 -0.18 -1.24 -1.96 -0.97 115.58 114.23 3hh8 h ASN 88 Ca -0.36 -0.55 0.00 0.00 0.71 0.00 0.00 56.30 56.10 3hh8 h ASN 88 Cb 1.20 -0.07 0.00 0.00 0.73 0.00 0.00 38.32 40.18 3hh8 h ASN 88 CO 0.61 0.74 0.00 0.61 -1.29 0.00 0.00 177.43 178.11 3hh8 n GLY 89 N 0.41 -0.53 4.35 1.57 0.00 -1.26 -3.06 105.19 106.68 3hh8 n GLY 89 Ca -0.08 -1.10 -0.33 0.00 0.00 0.00 0.00 46.02 44.50 3hh8 n GLY 89 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 3hh8 n ILE 90 N 0.00 -0.76 -2.24 -0.61 -5.35 -1.26 -1.71 119.36 107.43 3hh8 n ILE 90 Ca 0.00 -0.38 -0.13 0.00 -0.27 0.00 0.00 62.75 61.97 3hh8 n ILE 90 Cb 0.00 -0.88 -0.01 0.00 -1.74 0.00 0.00 39.64 37.02 3hh8 n ILE 90 CO 0.00 0.00 0.00 -3.20 -1.76 0.00 0.00 176.55 171.59 3hh8 n ASN 91 N -2.76 -4.06 -0.04 7.28 5.15 -1.26 -3.05 115.26 116.51 3hh8 n ASN 91 Ca -0.22 -0.01 -0.01 0.00 -0.60 0.00 0.00 54.58 53.73 3hh8 n ASN 91 Cb 0.64 -3.25 -0.00 0.00 -0.53 0.00 0.00 39.78 36.63 3hh8 n ASN 91 CO 0.00 0.00 0.00 0.25 1.40 0.00 0.00 177.26 178.91 3hh8 h LEU 92 N 0.00 0.00 -1.59 1.20 5.85 -1.67 -3.42 115.31 115.69 3hh8 h LEU 92 Ca -0.31 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.41 3hh8 h LEU 92 Cb 1.22 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.25 3hh8 h LEU 92 CO 0.36 0.39 0.00 -1.84 -0.34 0.00 0.00 178.44 177.01 3hh8 n GLU 93 N -3.80 0.85 -0.05 1.25 0.00 -1.26 -4.25 120.64 113.37 3hh8 n GLU 93 Ca -0.02 -0.79 0.03 0.00 0.00 0.00 0.00 57.16 56.38 3hh8 n GLU 93 Cb 0.07 -0.82 0.06 0.00 0.00 0.00 0.00 31.44 30.75 3hh8 n GLU 93 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.13 176.73 3hh8 n ASP 94 N -0.19 2.25 -4.33 -1.84 5.75 -1.26 -2.12 116.55 114.81 3hh8 n ASP 94 Ca 0.00 -2.27 -0.33 0.00 -0.01 0.00 0.00 54.79 52.17 3hh8 n ASP 94 Cb 0.24 -0.14 0.12 0.00 -1.03 0.00 0.00 41.12 40.31 3hh8 n ASP 94 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3hh8 n GLY 95 N -0.59 -2.40 0.35 6.12 0.00 -1.26 -4.78 105.19 102.62 3hh8 n GLY 95 Ca 0.06 -0.75 0.17 0.00 0.00 0.00 0.00 46.02 45.50 3hh8 n GLY 95 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 3hh8 h GLY 96 N -1.63 0.00 -1.44 -0.02 0.00 -1.97 -1.24 103.07 96.77 3hh8 h GLY 96 Ca -0.46 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.87 3hh8 h GLY 96 CO 0.34 0.00 0.00 -1.06 0.00 0.00 0.00 176.54 175.82 3hh8 n GLN 97 N -4.17 2.92 -2.75 4.80 1.13 -1.26 -4.90 117.38 113.15 3hh8 n GLN 97 Ca 0.05 -2.28 -0.23 0.00 -1.94 0.00 0.00 57.00 52.60 3hh8 n GLN 97 Cb 0.44 -1.43 0.02 0.00 0.11 0.00 0.00 30.24 29.38 3hh8 n GLN 97 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 3hh8 s ALA 98 N -1.47 3.68 0.23 -1.58 0.00 -0.47 -4.97 121.76 117.18 3hh8 s ALA 98 Ca 0.29 -1.05 -0.04 0.00 0.00 0.00 0.00 51.96 51.16 3hh8 s ALA 98 Cb 0.18 -2.23 0.22 0.00 0.00 0.00 0.00 23.12 21.29 3hh8 s ALA 98 CO 0.15 -0.60 1.68 0.11 0.00 0.00 0.00 175.76 177.10 3hh8 h TRP 99 N 0.16 0.90 -0.16 0.00 5.08 -1.83 -2.80 115.95 117.30 3hh8 h TRP 99 Ca -0.45 -0.17 -0.19 0.00 1.08 0.00 0.00 58.89 59.16 3hh8 h TRP 99 Cb 1.27 -0.23 0.00 0.00 -3.00 0.00 0.00 29.16 27.20 3hh8 h TRP 99 CO 0.43 0.89 -0.68 0.35 -1.28 0.00 0.00 178.44 178.15 3hh8 h PHE 100 N 0.73 0.85 -0.34 0.12 3.57 -1.78 -1.28 116.94 118.82 3hh8 h PHE 100 Ca 0.12 -0.35 0.05 0.00 3.53 0.00 0.00 57.97 61.32 3hh8 h PHE 100 Cb 0.62 -0.14 -0.04 0.00 2.79 0.00 0.00 35.95 39.17 3hh8 h PHE 100 CO 0.03 1.14 0.07 1.15 -2.23 0.00 0.00 178.31 178.47 3hh8 h THR 101 N 0.47 0.84 -0.68 4.41 2.02 -1.61 -0.83 112.91 117.53 3hh8 h THR 101 Ca -0.02 -0.06 -0.04 0.00 0.77 0.00 0.00 66.41 67.06 3hh8 h THR 101 Cb 1.27 0.63 -0.03 0.00 -1.74 0.00 0.00 68.15 68.28 3hh8 h THR 101 CO 0.13 0.03 0.28 0.11 0.37 0.00 0.00 175.52 176.45 3hh8 h LYS 102 N 0.19 1.00 0.13 6.66 1.57 -1.33 -2.15 116.57 122.64 3hh8 h LYS 102 Ca 0.16 -0.17 0.01 0.00 -1.87 0.00 0.00 60.65 58.78 3hh8 h LYS 102 Cb 0.17 -0.17 -0.03 0.00 0.08 0.00 0.00 32.23 32.29 3hh8 h LYS 102 CO -0.21 0.82 -0.23 1.25 -0.57 0.00 0.00 179.45 180.51 3hh8 h LEU 103 N 0.95 -0.66 -0.70 2.94 5.85 -0.62 -0.04 115.31 123.04 3hh8 h LEU 103 Ca 0.23 0.07 -0.09 0.00 0.84 0.00 0.00 57.88 58.93 3hh8 h LEU 103 Cb 0.19 0.25 -0.01 0.00 0.37 0.00 0.00 40.66 41.45 3hh8 h LEU 103 CO -0.02 -0.32 -0.45 -0.37 -0.34 0.00 0.00 178.44 176.94 3hh8 h VAL 104 N -0.44 0.96 -0.12 1.05 -1.51 -1.17 -1.66 116.25 113.36 3hh8 h VAL 104 Ca 0.02 -1.79 -0.01 0.00 -1.23 0.00 0.00 66.70 63.70 3hh8 h VAL 104 Cb 0.46 2.08 -0.01 0.00 -2.13 0.00 0.00 31.29 31.70 3hh8 h VAL 104 CO -0.12 0.44 0.05 0.50 -1.23 0.00 0.00 177.57 177.21 3hh8 h LYS 105 N 0.00 0.17 0.00 5.19 3.64 -1.16 -0.87 116.57 123.54 3hh8 h LYS 105 Ca -0.00 -0.03 -0.04 0.00 -1.27 0.00 0.00 60.65 59.31 3hh8 h LYS 105 Cb 1.05 -0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 32.83 3hh8 h LYS 105 CO 0.06 0.25 -0.17 -0.91 -2.27 0.00 0.00 179.45 176.40 3hh8 h ASN 106 N 0.05 0.00 0.03 4.20 2.35 -0.81 -2.52 115.58 118.88 3hh8 h ASN 106 Ca 0.04 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.79 3hh8 h ASN 106 Cb 0.14 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.51 3hh8 h ASN 106 CO -0.00 0.17 -0.06 0.00 -1.65 0.00 0.00 177.43 175.88 3hh8 n ALA 107 N -2.27 2.68 -3.61 -0.83 0.00 -0.64 -4.96 120.51 110.89 3hh8 n ALA 107 Ca -0.01 -0.48 -0.24 0.00 0.00 0.00 0.00 53.44 52.71 3hh8 n ALA 107 Cb 0.31 -1.09 0.08 0.00 0.00 0.00 0.00 19.45 18.74 3hh8 n ALA 107 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 3hh8 n GLN 108 N 0.20 -7.54 -3.77 0.00 1.13 -0.56 -4.85 117.38 101.97 3hh8 n GLN 108 Ca 0.17 0.81 -0.25 0.00 -1.94 0.00 0.00 57.00 55.79 3hh8 n GLN 108 Cb 0.39 -5.84 -0.02 0.00 0.11 0.00 0.00 30.24 24.88 3hh8 n GLN 108 CO 0.00 0.00 0.00 0.15 -1.44 0.00 0.00 177.06 175.77 3hh8 s LYS 109 N -6.21 3.48 -0.12 -1.09 -0.14 -0.44 -5.05 119.74 110.16 3hh8 s LYS 109 Ca 0.51 -0.51 -0.01 0.00 -1.36 0.00 0.00 55.97 54.60 3hh8 s LYS 109 Cb -0.23 -2.85 -0.02 0.00 -1.68 0.00 0.00 37.83 33.05 3hh8 s LYS 109 CO 0.74 0.40 -0.08 0.99 -0.76 0.00 0.00 175.35 176.63 3hh8 s THR 110 N -1.94 3.50 0.21 2.17 2.01 -1.26 -4.80 115.64 115.53 3hh8 s THR 110 Ca 0.37 -0.52 -0.32 0.00 0.31 0.00 0.00 61.69 61.53 3hh8 s THR 110 Cb -0.10 -2.48 -0.12 0.00 0.01 0.00 0.00 72.50 69.82 3hh8 s THR 110 CO 0.30 0.54 1.68 -0.75 -0.69 0.00 0.00 174.62 175.70 3hh8 s LYS 111 N -0.02 4.14 -0.67 4.92 2.47 -1.26 -0.63 119.74 128.69 3hh8 s LYS 111 Ca -0.01 2.56 0.00 0.00 -1.56 0.00 0.00 55.97 56.96 3hh8 s LYS 111 Cb -0.14 -3.08 0.00 0.00 -1.46 0.00 0.00 37.83 33.15 3hh8 s LYS 111 CO 0.03 -0.71 0.00 0.09 0.16 0.00 0.00 175.35 174.92 3hh8 n ASN 112 N 3.73 -4.79 0.01 1.43 3.02 0.26 -4.72 115.26 114.20 3hh8 n ASN 112 Ca 0.14 0.16 0.00 0.00 -0.03 0.00 0.00 54.58 54.85 3hh8 n ASN 112 Cb 0.36 -2.85 0.00 0.00 -0.61 0.00 0.00 39.78 36.68 3hh8 n ASN 112 CO 0.00 0.00 0.00 1.17 -2.62 0.00 0.00 177.26 175.81 3hh8 n LYS 113 N -1.45 0.00 -0.12 3.52 4.81 -0.88 -4.92 118.16 119.12 3hh8 n LYS 113 Ca -0.06 0.00 -0.18 0.00 -0.87 0.00 0.00 58.31 57.19 3hh8 n LYS 113 Cb 0.38 -0.43 -0.10 0.00 0.02 0.00 0.00 35.03 34.90 3hh8 n LYS 113 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 3hh8 n ASP 114 N -2.99 2.10 -4.28 3.14 8.00 0.20 -4.95 116.55 117.76 3hh8 n ASP 114 Ca 0.00 -0.04 -0.29 0.00 0.71 0.00 0.00 54.79 55.17 3hh8 n ASP 114 Cb 0.38 -0.44 -0.16 0.00 -0.02 0.00 0.00 41.12 40.88 3hh8 n ASP 114 CO 0.00 0.00 0.00 -0.72 -0.39 0.00 0.00 177.20 176.09 3hh8 s TYR 115 N -2.47 2.15 -0.03 1.24 1.13 -1.07 -0.50 117.35 117.80 3hh8 s TYR 115 Ca -0.32 -0.40 0.01 0.00 -1.41 0.00 0.00 57.07 54.94 3hh8 s TYR 115 Cb 0.09 -1.36 0.02 0.00 -1.10 0.00 0.00 41.96 39.61 3hh8 s TYR 115 CO 0.52 -0.00 -0.03 -0.06 -2.51 0.00 0.00 175.55 173.47 3hh8 s PHE 116 N -0.62 0.52 -0.29 -3.49 0.08 -0.05 -0.58 117.98 113.56 3hh8 s PHE 116 Ca 0.09 -0.10 -0.24 0.00 0.12 0.00 0.00 56.93 56.80 3hh8 s PHE 116 Cb -0.09 -0.49 0.00 0.00 -0.57 0.00 0.00 43.02 41.87 3hh8 s PHE 116 CO -0.00 -0.13 0.84 0.00 -0.10 0.00 0.00 175.22 175.83 3hh8 s ALA 117 N 0.76 3.57 -0.72 5.36 0.00 -1.26 -1.53 121.76 127.93 3hh8 s ALA 117 Ca -0.09 -0.28 0.24 0.00 0.00 0.00 0.00 51.96 51.84 3hh8 s ALA 117 Cb -0.12 -3.34 0.91 0.00 0.00 0.00 0.00 23.12 20.57 3hh8 s ALA 117 CO -0.01 -1.14 1.74 1.33 0.00 0.00 0.00 175.76 177.69 3hh8 n VAL 118 N 5.48 0.63 1.66 0.00 0.24 -0.37 -2.28 118.33 123.68 3hh8 n VAL 118 Ca 0.05 -0.02 0.15 0.00 -2.04 0.00 0.00 64.34 62.49 3hh8 n VAL 118 Cb 0.48 -0.81 0.84 0.00 -1.47 0.00 0.00 33.84 32.88 3hh8 n VAL 118 CO 0.00 0.00 0.00 -1.54 -2.14 0.00 0.00 176.83 173.15 3hh8 n SER 119 N -2.06 0.00 -4.68 -1.34 3.41 -1.17 -3.79 113.62 103.98 3hh8 n SER 119 Ca 0.04 -0.50 -0.46 0.00 -0.26 0.00 0.00 58.87 57.70 3hh8 n SER 119 Cb 0.32 -0.17 -0.04 0.00 -0.26 0.00 0.00 64.21 64.07 3hh8 n SER 119 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 3hh8 n ASP 120 N -1.17 3.53 0.00 4.04 9.92 -0.97 -2.03 116.55 129.88 3hh8 n ASP 120 Ca 0.18 1.00 0.00 0.00 -0.53 0.00 0.00 54.79 55.45 3hh8 n ASP 120 Cb 0.19 -1.44 0.00 0.00 -0.64 0.00 0.00 41.12 39.23 3hh8 n ASP 120 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 3hh8 n GLY 121 N 4.09 1.94 3.75 0.44 0.00 -1.26 -4.94 105.19 109.21 3hh8 n GLY 121 Ca 0.20 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.92 3hh8 n GLY 121 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3hh8 s ILE 122 N -2.41 2.96 -0.41 -0.61 -4.36 -0.86 -4.98 121.20 110.53 3hh8 s ILE 122 Ca 0.00 0.31 -0.28 0.00 -0.26 0.00 0.00 60.65 60.42 3hh8 s ILE 122 Cb 0.00 -2.84 0.02 0.00 1.25 0.00 0.00 42.46 40.89 3hh8 s ILE 122 CO 0.00 -0.41 1.06 -1.81 0.24 0.00 0.00 174.94 174.02 3hh8 s ASP 123 N -3.49 6.70 0.23 4.36 -0.00 -1.26 -5.01 116.67 118.20 3hh8 s ASP 123 Ca 0.62 0.60 -0.30 0.00 -0.00 0.00 0.00 52.55 53.47 3hh8 s ASP 123 Cb -0.17 -2.52 -0.09 0.00 -0.00 0.00 0.00 42.92 40.14 3hh8 s ASP 123 CO 0.56 -1.06 1.06 -0.69 -0.00 0.00 0.00 175.17 175.04 3hh8 s VAL 124 N 3.98 3.79 -0.10 -1.27 1.01 -1.26 -5.05 120.40 121.51 3hh8 s VAL 124 Ca 0.44 1.69 -0.01 0.00 0.00 0.00 0.00 61.98 64.11 3hh8 s VAL 124 Cb -0.10 -4.08 -0.03 0.00 0.00 0.00 0.00 36.38 32.18 3hh8 s VAL 124 CO 0.24 0.36 -0.06 -0.63 0.00 0.00 0.00 175.10 175.01 3hh8 s ILE 125 N -0.78 3.75 0.38 2.22 1.01 -1.26 -5.06 121.20 121.46 3hh8 s ILE 125 Ca 0.46 -0.44 0.03 0.00 0.00 0.00 0.00 60.65 60.69 3hh8 s ILE 125 Cb -0.29 -2.57 -0.01 0.00 0.01 0.00 0.00 42.46 39.60 3hh8 s ILE 125 CO 0.36 0.57 0.56 -0.31 0.00 0.00 0.00 174.94 176.12 3hh8 s TYR 126 N -0.41 3.22 0.85 3.97 2.02 -1.26 -0.60 117.35 125.14 3hh8 s TYR 126 Ca 0.06 0.04 -0.12 0.00 -0.37 0.00 0.00 57.07 56.68 3hh8 s TYR 126 Cb -0.12 -2.09 0.11 0.00 -0.40 0.00 0.00 41.96 39.45 3hh8 s TYR 126 CO 0.02 -0.12 1.19 -0.51 -1.57 0.00 0.00 175.55 174.56 3hh8 s LEU 127 N -4.34 3.03 0.19 -1.29 1.43 -0.36 -4.45 118.68 112.89 3hh8 s LEU 127 Ca 0.45 2.32 -0.33 0.00 -1.03 0.00 0.00 54.13 55.54 3hh8 s LEU 127 Cb -0.10 -4.58 -0.13 0.00 0.03 0.00 0.00 46.19 41.41 3hh8 s LEU 127 CO 0.34 -2.85 1.59 -0.62 0.23 0.00 0.00 176.35 175.04 3hh8 n GLU 128 N -3.64 2.30 -0.38 1.70 1.02 -1.26 -1.25 120.64 119.13 3hh8 n GLU 128 Ca 0.13 0.83 0.00 0.00 -0.02 0.00 0.00 57.16 58.10 3hh8 n GLU 128 Cb 0.51 -2.60 0.00 0.00 -0.02 0.00 0.00 31.44 29.33 3hh8 n GLU 128 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3hh8 n GLY 129 N 3.31 2.19 3.86 0.62 0.00 -1.26 -5.00 105.19 108.91 3hh8 n GLY 129 Ca 0.16 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.96 3hh8 n GLY 129 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hh8 s ALA 130 N -3.37 3.75 0.00 4.61 0.00 -0.38 -5.01 121.76 121.36 3hh8 s ALA 130 Ca 0.00 -1.49 0.00 0.00 0.00 0.00 0.00 51.96 50.47 3hh8 s ALA 130 Cb 0.00 -1.31 0.00 0.00 0.00 0.00 0.00 23.12 21.81 3hh8 s ALA 130 CO 0.00 0.14 0.00 -1.13 0.00 0.00 0.00 175.76 174.77 3hh8 n SER 131 N -1.30 0.00 -4.92 0.00 3.41 -1.26 -4.68 113.62 104.86 3hh8 n SER 131 Ca -0.05 -0.83 -0.28 0.00 -0.26 0.00 0.00 58.87 57.45 3hh8 n SER 131 Cb 0.59 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 64.50 3hh8 n SER 131 CO 0.00 0.00 0.00 -1.83 -0.16 0.00 0.00 175.04 173.05 3hh8 s GLU 132 N 0.00 3.53 0.34 4.33 -1.05 -1.26 -5.03 118.70 119.56 3hh8 s GLU 132 Ca 0.00 -0.31 -0.28 0.00 -0.15 0.00 0.00 54.97 54.22 3hh8 s GLU 132 Cb 0.00 -2.85 -0.12 0.00 -0.44 0.00 0.00 34.13 30.72 3hh8 s GLU 132 CO 0.00 0.42 1.34 1.17 0.95 0.00 0.00 175.26 179.14 3hh8 n LYS 133 N -0.53 2.24 0.00 -4.83 4.81 -1.26 -1.41 118.16 117.18 3hh8 n LYS 133 Ca -0.04 0.79 0.00 0.00 -0.87 0.00 0.00 58.31 58.18 3hh8 n LYS 133 Cb 0.53 -2.41 0.00 0.00 0.02 0.00 0.00 35.03 33.18 3hh8 n LYS 133 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3hh8 n GLY 134 N 0.85 3.21 1.22 3.14 0.00 -1.26 -4.89 105.19 107.46 3hh8 n GLY 134 Ca 0.05 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 46.00 3hh8 n GLY 134 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3hh8 n LYS 135 N -2.00 2.22 -1.92 1.61 5.02 -0.50 -4.88 118.16 117.71 3hh8 n LYS 135 Ca 0.00 -3.49 -0.35 0.00 -2.02 0.00 0.00 58.31 52.45 3hh8 n LYS 135 Cb 0.00 -1.88 0.04 0.00 -0.02 0.00 0.00 35.03 33.17 3hh8 n LYS 135 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 3hh8 s GLU 136 N -3.36 2.87 -0.16 1.97 8.01 -1.26 -1.23 118.70 125.53 3hh8 s GLU 136 Ca 0.45 1.75 -0.21 0.00 0.01 0.00 0.00 54.97 56.96 3hh8 s GLU 136 Cb 0.40 -1.93 -0.03 0.00 -4.31 0.00 0.00 34.13 28.26 3hh8 s GLU 136 CO -0.02 -1.27 0.62 0.34 0.01 0.00 0.00 175.26 174.95 3hh8 s ASP 137 N -1.79 6.74 0.04 -0.19 2.15 0.23 -4.36 116.67 119.50 3hh8 s ASP 137 Ca 0.75 0.90 0.28 0.00 0.43 0.00 0.00 52.55 54.91 3hh8 s ASP 137 Cb -0.28 -2.35 1.05 0.00 -0.30 0.00 0.00 42.92 41.04 3hh8 s ASP 137 CO 0.35 -0.21 1.82 -0.81 -0.17 0.00 0.00 175.17 176.15 3hh8 n PRO 138 N 4.64 0.05 -1.07 4.34 -0.04 -1.17 -4.59 135.00 137.17 3hh8 n PRO 138 Ca -0.02 0.04 -0.16 0.00 -0.04 0.00 0.00 63.50 63.32 3hh8 n PRO 138 Cb 0.50 -1.55 -0.08 0.00 -0.04 0.00 0.00 33.50 32.33 3hh8 n PRO 138 CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 3hh8 n HIS 139 N -1.64 0.75 0.21 0.54 8.25 -1.26 -4.57 115.22 117.49 3hh8 n HIS 139 Ca 0.06 -1.64 0.07 0.00 -0.26 0.00 0.00 57.72 55.95 3hh8 n HIS 139 Cb 0.36 -1.27 0.47 0.00 1.12 0.00 0.00 29.99 30.67 3hh8 n HIS 139 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3hh8 h ALA 140 N 2.47 1.24 0.00 -1.41 0.00 -1.92 -2.95 119.26 116.68 3hh8 h ALA 140 Ca 0.24 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.89 3hh8 h ALA 140 Cb 1.09 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.84 3hh8 h ALA 140 CO 0.48 0.35 0.00 -2.67 0.00 0.00 0.00 179.25 177.42 3hh8 n TRP 141 N -3.77 0.20 0.74 0.00 2.14 -1.26 -2.16 117.44 113.33 3hh8 n TRP 141 Ca -0.01 0.07 0.10 0.00 2.07 0.00 0.00 57.50 59.72 3hh8 n TRP 141 Cb 0.38 -0.61 0.44 0.00 -0.81 0.00 0.00 31.31 30.71 3hh8 n TRP 141 CO 0.00 0.00 0.00 1.28 2.07 0.00 0.00 177.69 181.04 3hh8 n LEU 142 N -1.67 0.00 -4.59 5.67 4.77 -1.12 -4.22 117.00 115.84 3hh8 n LEU 142 Ca 0.04 0.45 -0.39 0.00 -0.03 0.00 0.00 56.01 56.08 3hh8 n LEU 142 Cb 0.24 -0.45 -0.09 0.00 -2.33 0.00 0.00 43.42 40.78 3hh8 n LEU 142 CO 0.19 -0.15 0.04 0.21 -1.33 0.00 0.00 177.39 176.35 3hh8 s ASN 143 N -2.91 6.21 0.54 -1.43 3.84 -0.92 -4.14 114.94 116.14 3hh8 s ASN 143 Ca 0.12 0.11 0.22 0.00 0.21 0.00 0.00 52.86 53.52 3hh8 s ASN 143 Cb 0.13 -2.20 1.48 0.00 -0.55 0.00 0.00 41.25 40.11 3hh8 s ASN 143 CO 0.35 -0.22 2.17 -0.07 -2.79 0.00 0.00 177.10 176.54 3hh8 h LEU 144 N 8.64 0.00 -1.49 3.21 3.38 -1.86 0.13 115.31 127.32 3hh8 h LEU 144 Ca -0.31 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.62 3hh8 h LEU 144 Cb 1.16 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.90 3hh8 h LEU 144 CO 0.65 0.03 -0.02 -0.33 0.09 0.00 0.00 178.44 178.86 3hh8 h GLU 145 N 0.00 0.30 -0.01 1.13 5.08 -1.92 -1.10 114.58 118.06 3hh8 h GLU 145 Ca -0.00 -0.05 -0.19 0.00 -1.00 0.00 0.00 59.36 58.12 3hh8 h GLU 145 Cb 0.05 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.24 3hh8 h GLU 145 CO 0.00 0.35 -0.83 -0.91 -1.00 0.00 0.00 179.01 176.62 3hh8 h ASN 146 N 0.30 0.31 -0.89 1.42 2.35 -1.22 -2.53 115.58 115.32 3hh8 h ASN 146 Ca 0.07 -0.23 0.10 0.00 -0.55 0.00 0.00 56.30 55.68 3hh8 h ASN 146 Cb 0.23 -0.09 -0.06 0.00 0.05 0.00 0.00 38.32 38.45 3hh8 h ASN 146 CO 0.01 1.01 0.57 1.23 -1.65 0.00 0.00 177.43 178.60 3hh8 h GLY 147 N 1.67 1.27 0.85 2.83 0.00 -1.04 0.12 103.07 108.78 3hh8 h GLY 147 Ca -0.04 -0.36 -0.04 0.00 0.00 0.00 0.00 47.33 46.89 3hh8 h GLY 147 CO 0.13 0.20 -0.02 -2.22 0.00 0.00 0.00 176.54 174.63 3hh8 h ILE 148 N 0.87 1.26 -0.56 2.60 2.04 -1.10 -1.19 117.51 121.43 3hh8 h ILE 148 Ca 0.41 -0.95 0.02 0.00 1.00 0.00 0.00 64.86 65.34 3hh8 h ILE 148 Cb 0.43 1.40 -0.03 0.00 -0.74 0.00 0.00 36.82 37.87 3hh8 h ILE 148 CO -0.18 0.30 0.35 0.40 0.00 0.00 0.00 178.15 179.03 3hh8 h ILE 149 N 0.21 1.09 -0.51 -0.67 2.04 -1.02 0.09 117.51 118.75 3hh8 h ILE 149 Ca 0.07 -0.24 0.02 0.00 1.00 0.00 0.00 64.86 65.71 3hh8 h ILE 149 Cb 0.45 0.32 -0.03 0.00 -0.74 0.00 0.00 36.82 36.81 3hh8 h ILE 149 CO 0.02 0.13 0.30 1.88 0.00 0.00 0.00 178.15 180.48 3hh8 h TYR 150 N 0.71 0.56 -0.68 1.37 -1.99 -0.65 -0.32 116.97 115.97 3hh8 h TYR 150 Ca 0.22 0.02 -0.04 0.00 2.00 0.00 0.00 58.73 60.93 3hh8 h TYR 150 Cb -0.02 -0.18 -0.03 0.00 2.00 0.00 0.00 36.73 38.50 3hh8 h TYR 150 CO -0.05 0.32 0.27 0.77 -0.00 0.00 0.00 178.16 179.47 3hh8 h SER 151 N 0.60 0.93 -0.67 3.88 0.02 -0.88 -0.52 113.55 116.90 3hh8 h SER 151 Ca 0.20 -0.17 -0.04 0.00 -0.84 0.00 0.00 61.79 60.95 3hh8 h SER 151 Cb 0.02 -0.24 -0.03 0.00 0.14 0.00 0.00 62.40 62.29 3hh8 h SER 151 CO -0.09 0.85 0.27 0.11 -1.14 0.00 0.00 176.83 176.83 3hh8 h LYS 152 N 0.96 1.00 -0.68 3.45 1.57 -0.67 -0.46 116.57 121.75 3hh8 h LYS 152 Ca 0.23 -0.18 -0.03 0.00 -1.87 0.00 0.00 60.65 58.80 3hh8 h LYS 152 Cb 0.20 -0.16 -0.03 0.00 0.08 0.00 0.00 32.23 32.32 3hh8 h LYS 152 CO -0.02 0.83 0.31 -0.91 -0.57 0.00 0.00 179.45 179.09 3hh8 h ASN 153 N 0.95 0.91 -0.01 0.86 2.35 -0.66 -0.50 115.58 119.48 3hh8 h ASN 153 Ca 0.22 -0.15 -0.00 0.00 -0.55 0.00 0.00 56.30 55.83 3hh8 h ASN 153 Cb 0.20 -0.23 -0.00 0.00 0.05 0.00 0.00 38.32 38.34 3hh8 h ASN 153 CO -0.02 0.80 0.01 0.40 -1.65 0.00 0.00 177.43 176.97 3hh8 h ILE 154 N 0.95 1.06 -0.80 2.81 2.04 -0.85 -2.70 117.51 120.03 3hh8 h ILE 154 Ca 0.23 -0.18 0.00 0.00 1.00 0.00 0.00 64.86 65.91 3hh8 h ILE 154 Cb 0.15 1.17 -0.04 0.00 -0.74 0.00 0.00 36.82 37.36 3hh8 h ILE 154 CO -0.03 0.05 0.51 0.00 0.00 0.00 0.00 178.15 178.68 3hh8 h ALA 155 N 0.93 1.01 -0.49 1.87 0.00 -0.95 -0.45 119.26 121.18 3hh8 h ALA 155 Ca 0.00 -0.07 0.09 0.00 0.00 0.00 0.00 54.91 54.93 3hh8 h ALA 155 Cb 0.08 -0.32 -0.08 0.00 0.00 0.00 0.00 17.79 17.47 3hh8 h ALA 155 CO -0.00 0.45 0.04 -0.22 0.00 0.00 0.00 179.25 179.51 3hh8 h LYS 156 N 1.09 0.15 0.04 0.00 3.64 -0.94 -0.58 116.57 119.97 3hh8 h LYS 156 Ca 0.29 -0.01 -0.23 0.00 -1.27 0.00 0.00 60.65 59.43 3hh8 h LYS 156 Cb -0.09 -0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 31.69 3hh8 h LYS 156 CO -0.06 0.10 -1.02 1.96 -2.27 0.00 0.00 179.45 178.17 3hh8 h GLN 157 N 0.16 0.21 -0.76 1.90 1.08 -1.09 -1.62 115.11 115.00 3hh8 h GLN 157 Ca 0.25 -0.28 0.01 0.00 -1.45 0.00 0.00 58.65 57.17 3hh8 h GLN 157 Cb 0.36 0.09 -0.04 0.00 -0.05 0.00 0.00 27.48 27.84 3hh8 h GLN 157 CO -0.37 1.06 0.50 -0.07 -0.95 0.00 0.00 178.83 178.99 3hh8 h LEU 158 N 0.09 0.86 -0.60 1.46 3.38 -0.81 -0.70 115.31 119.00 3hh8 h LEU 158 Ca -0.07 -0.02 -0.13 0.00 0.09 0.00 0.00 57.88 57.75 3hh8 h LEU 158 Cb 1.70 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 42.22 3hh8 h LEU 158 CO 0.16 0.62 -0.27 0.40 0.09 0.00 0.00 178.44 179.44 3hh8 h ILE 159 N 1.02 1.27 -0.63 1.22 2.04 -1.04 0.19 117.51 121.58 3hh8 h ILE 159 Ca 0.28 -1.41 -0.07 0.00 1.00 0.00 0.00 64.86 64.66 3hh8 h ILE 159 Cb -0.10 1.26 -0.03 0.00 -0.74 0.00 0.00 36.82 37.21 3hh8 h ILE 159 CO -0.07 0.47 0.12 0.00 0.00 0.00 0.00 178.15 178.68 3hh8 h ALA 160 N 0.98 0.84 0.00 1.87 0.00 -0.97 -2.76 119.26 119.22 3hh8 h ALA 160 Ca 0.09 -0.25 -0.05 0.00 0.00 0.00 0.00 54.91 54.69 3hh8 h ALA 160 Cb 0.81 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.35 3hh8 h ALA 160 CO 0.07 0.58 -1.08 0.87 0.00 0.00 0.00 179.25 179.68 3hh8 h LYS 161 N 0.95 0.00 -2.04 0.00 1.57 -1.06 -3.40 116.57 112.59 3hh8 h LYS 161 Ca 0.19 0.00 -0.53 0.00 -1.87 0.00 0.00 60.65 58.44 3hh8 h LYS 161 Cb 0.40 0.00 -0.40 0.00 0.08 0.00 0.00 32.23 32.31 3hh8 h LYS 161 CO 0.01 0.10 -1.06 -3.47 -0.57 0.00 0.00 179.45 174.45 3hh8 n ASP 162 N -2.77 1.16 0.11 0.86 2.03 0.65 -4.97 116.55 113.62 3hh8 n ASP 162 Ca -0.03 -2.98 0.15 0.00 0.52 0.00 0.00 54.79 52.45 3hh8 n ASP 162 Cb 0.64 -0.63 0.68 0.00 -0.72 0.00 0.00 41.12 41.10 3hh8 n ASP 162 CO 0.00 0.00 0.00 1.55 -1.92 0.00 0.00 177.20 176.83 3hh8 h PRO 163 N 3.48 0.00 -0.11 -0.67 0.13 -1.69 -1.95 132.00 131.19 3hh8 h PRO 163 Ca 0.10 0.00 0.03 0.00 -0.87 0.00 0.00 66.00 65.26 3hh8 h PRO 163 Cb 0.87 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.99 3hh8 h PRO 163 CO 0.54 0.00 0.14 1.57 -0.23 0.00 0.00 178.00 180.02 3hh8 h LYS 164 N 0.00 0.00 -0.52 0.86 2.10 -1.93 -0.71 116.57 116.37 3hh8 h LYS 164 Ca 0.14 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.79 3hh8 h LYS 164 Cb 0.59 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.92 3hh8 h LYS 164 CO -0.00 0.00 0.00 0.09 -2.00 0.00 0.00 179.45 177.54 3hh8 n ASN 165 N -3.75 3.99 -0.27 7.07 3.02 -0.73 -4.62 115.26 119.96 3hh8 n ASN 165 Ca -0.00 -2.33 0.08 0.00 -0.03 0.00 0.00 54.58 52.30 3hh8 n ASN 165 Cb 0.24 -0.46 0.22 0.00 -0.61 0.00 0.00 39.78 39.18 3hh8 n ASN 165 CO 0.00 0.00 0.00 0.50 -2.62 0.00 0.00 177.26 175.14 3hh8 h LYS 166 N 3.19 0.28 -0.44 3.52 3.64 -1.19 -1.66 116.57 123.91 3hh8 h LYS 166 Ca 0.00 -0.02 0.05 0.00 -1.27 0.00 0.00 60.65 59.42 3hh8 h LYS 166 Cb 1.17 -0.06 -0.05 0.00 -0.41 0.00 0.00 32.23 32.88 3hh8 h LYS 166 CO 0.13 0.18 0.17 1.49 -2.27 0.00 0.00 179.45 179.15 3hh8 h GLU 167 N 0.28 0.34 -0.20 1.90 4.81 -1.82 0.42 114.58 120.31 3hh8 h GLU 167 Ca 0.47 -0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 59.67 3hh8 h GLU 167 Cb 0.85 -0.08 -0.01 0.00 0.63 0.00 0.00 28.75 30.14 3hh8 h GLU 167 CO -0.54 0.23 0.07 1.15 -0.73 0.00 0.00 179.01 179.18 3hh8 h THR 168 N 0.35 1.17 -0.69 0.32 2.02 -1.71 -1.16 112.91 113.22 3hh8 h THR 168 Ca 0.20 -0.53 -0.01 0.00 0.77 0.00 0.00 66.41 66.85 3hh8 h THR 168 Cb 0.18 1.15 -0.03 0.00 -1.74 0.00 0.00 68.15 67.71 3hh8 h THR 168 CO -0.20 0.17 0.41 1.88 0.37 0.00 0.00 175.52 178.15 3hh8 h TYR 169 N 0.16 0.92 -0.32 3.16 0.05 -0.94 -0.18 116.97 119.82 3hh8 h TYR 169 Ca 0.07 -0.01 -0.18 0.00 0.05 0.00 0.00 58.73 58.66 3hh8 h TYR 169 Cb 0.20 -0.30 -0.00 0.00 1.01 0.00 0.00 36.73 37.63 3hh8 h TYR 169 CO -0.01 0.63 -0.48 0.93 -1.05 0.00 0.00 178.16 178.18 3hh8 h GLU 170 N 0.94 0.89 -0.09 4.88 5.08 -0.84 0.62 114.58 126.07 3hh8 h GLU 170 Ca 0.25 -0.53 -0.00 0.00 -1.00 0.00 0.00 59.36 58.08 3hh8 h GLU 170 Cb -0.01 0.05 -0.00 0.00 0.50 0.00 0.00 28.75 29.28 3hh8 h GLU 170 CO -0.04 1.17 0.05 -0.22 -1.00 0.00 0.00 179.01 178.96 3hh8 h LYS 171 N 0.70 0.12 -0.48 2.33 3.64 -0.92 -1.10 116.57 120.86 3hh8 h LYS 171 Ca 0.03 -0.01 -0.05 0.00 -1.27 0.00 0.00 60.65 59.35 3hh8 h LYS 171 Cb 1.09 -0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 32.86 3hh8 h LYS 171 CO 0.11 0.15 0.11 -0.91 -2.27 0.00 0.00 179.45 176.65 3hh8 h ASN 172 N 0.06 0.74 -0.26 4.20 2.35 -1.01 -2.30 115.58 119.37 3hh8 h ASN 172 Ca 0.03 -0.24 0.05 0.00 -0.55 0.00 0.00 56.30 55.59 3hh8 h ASN 172 Cb 0.06 -0.20 -0.04 0.00 0.05 0.00 0.00 38.32 38.19 3hh8 h ASN 172 CO -0.01 0.78 -0.03 0.25 -1.65 0.00 0.00 177.43 176.78 3hh8 h LEU 173 N 0.66 -0.16 -0.45 1.61 5.85 -0.76 -0.75 115.31 121.31 3hh8 h LEU 173 Ca 0.15 0.07 0.04 0.00 0.84 0.00 0.00 57.88 58.98 3hh8 h LEU 173 Cb 0.33 0.13 -0.04 0.00 0.37 0.00 0.00 40.66 41.45 3hh8 h LEU 173 CO 0.00 -0.05 0.22 0.50 -0.34 0.00 0.00 178.44 178.77 3hh8 h LYS 174 N 0.04 0.42 -0.64 1.25 3.64 -1.07 0.11 116.57 120.33 3hh8 h LYS 174 Ca 0.12 -0.03 -0.09 0.00 -1.27 0.00 0.00 60.65 59.39 3hh8 h LYS 174 Cb 0.17 -0.10 -0.02 0.00 -0.41 0.00 0.00 32.23 31.87 3hh8 h LYS 174 CO -0.23 0.28 0.05 0.00 -2.27 0.00 0.00 179.45 177.28 3hh8 h ALA 175 N 1.25 0.86 -0.19 5.00 0.00 -1.24 -2.49 119.26 122.44 3hh8 h ALA 175 Ca 0.20 -0.30 -0.08 0.00 0.00 0.00 0.00 54.91 54.73 3hh8 h ALA 175 Cb 0.11 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 17.66 3hh8 h ALA 175 CO -0.15 0.67 -0.20 -0.92 0.00 0.00 0.00 179.25 178.65 3hh8 h TYR 176 N 1.01 0.57 -0.85 0.00 3.20 -0.57 -1.69 116.97 118.64 3hh8 h TYR 176 Ca 0.19 -0.18 0.02 0.00 3.14 0.00 0.00 58.73 61.90 3hh8 h TYR 176 Cb 0.51 -0.12 -0.04 0.00 1.54 0.00 0.00 36.73 38.62 3hh8 h TYR 176 CO 0.04 0.84 0.56 0.28 -1.64 0.00 0.00 178.16 178.24 3hh8 h VAL 177 N 0.13 1.19 -0.49 1.81 2.07 -0.78 0.19 116.25 120.37 3hh8 h VAL 177 Ca 0.03 -0.38 -0.10 0.00 0.82 0.00 0.00 66.70 67.07 3hh8 h VAL 177 Cb 0.75 -0.03 -0.02 0.00 -1.52 0.00 0.00 31.29 30.48 3hh8 h VAL 177 CO 0.05 0.20 -0.06 0.00 0.02 0.00 0.00 177.57 177.78 3hh8 h ALA 178 N 1.48 0.67 -0.54 1.67 0.00 -1.22 0.22 119.26 121.54 3hh8 h ALA 178 Ca 0.32 -0.32 -0.04 0.00 0.00 0.00 0.00 54.91 54.87 3hh8 h ALA 178 Cb -0.08 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.51 3hh8 h ALA 178 CO -0.08 0.53 0.16 -0.22 0.00 0.00 0.00 179.25 179.65 3hh8 h LYS 179 N 0.76 0.85 -0.63 0.00 3.64 -0.89 -2.02 116.57 118.28 3hh8 h LYS 179 Ca 0.13 -0.19 -0.09 0.00 -1.27 0.00 0.00 60.65 59.24 3hh8 h LYS 179 Cb 0.60 -0.12 -0.02 0.00 -0.41 0.00 0.00 32.23 32.28 3hh8 h LYS 179 CO 0.04 0.78 0.05 -0.07 -2.27 0.00 0.00 179.45 177.98 3hh8 h LEU 180 N 0.75 1.05 -1.04 5.20 3.38 -0.82 -2.45 115.31 121.39 3hh8 h LEU 180 Ca 0.17 -0.29 0.06 0.00 0.09 0.00 0.00 57.88 57.92 3hh8 h LEU 180 Cb 0.29 -0.28 -0.06 0.00 0.09 0.00 0.00 40.66 40.70 3hh8 h LEU 180 CO -0.00 1.07 0.64 -0.33 0.09 0.00 0.00 178.44 179.91 3hh8 h GLU 181 N 0.99 1.14 -0.53 1.13 5.08 -0.83 0.77 114.58 122.32 3hh8 h GLU 181 Ca 0.18 -0.07 -0.10 0.00 -1.00 0.00 0.00 59.36 58.37 3hh8 h GLU 181 Cb 0.51 -0.26 -0.02 0.00 0.50 0.00 0.00 28.75 29.48 3hh8 h GLU 181 CO 0.02 0.76 -0.08 0.87 -1.00 0.00 0.00 179.01 179.58 3hh8 h LYS 182 N 1.18 0.99 -0.29 2.33 1.57 -1.13 -1.94 116.57 119.28 3hh8 h LYS 182 Ca 0.42 -0.36 -0.14 0.00 -1.87 0.00 0.00 60.65 58.70 3hh8 h LYS 182 Cb 0.13 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.36 3hh8 h LYS 182 CO -0.16 1.03 -0.38 1.25 -0.57 0.00 0.00 179.45 180.62 3hh8 h LEU 183 N 0.87 0.72 -0.45 2.94 5.85 -1.15 -2.24 115.31 121.84 3hh8 h LEU 183 Ca 0.14 -0.32 0.01 0.00 0.84 0.00 0.00 57.88 58.56 3hh8 h LEU 183 Cb 0.63 -0.20 -0.03 0.00 0.37 0.00 0.00 40.66 41.44 3hh8 h LEU 183 CO 0.04 1.02 0.28 -0.78 -0.34 0.00 0.00 178.44 178.66 3hh8 h ASP 184 N 0.56 0.46 -0.72 1.25 3.58 -0.70 0.64 116.42 121.49 3hh8 h ASP 184 Ca 0.05 -0.00 0.02 0.00 0.42 0.00 0.00 57.03 57.52 3hh8 h ASP 184 Cb 0.91 -0.10 -0.04 0.00 1.72 0.00 0.00 39.33 41.82 3hh8 h ASP 184 CO 0.08 0.33 0.47 0.50 -2.88 0.00 0.00 179.24 177.74 3hh8 h LYS 185 N 0.56 0.91 -0.50 0.28 3.64 -1.24 -1.31 116.57 118.92 3hh8 h LYS 185 Ca 0.17 -0.05 0.01 0.00 -1.27 0.00 0.00 60.65 59.51 3hh8 h LYS 185 Cb -0.02 -0.20 -0.03 0.00 -0.41 0.00 0.00 32.23 31.57 3hh8 h LYS 185 CO -0.07 0.60 0.32 1.49 -2.27 0.00 0.00 179.45 179.52 3hh8 h GLU 186 N 0.93 0.63 -0.89 1.90 4.81 -1.01 -2.62 114.58 118.33 3hh8 h GLU 186 Ca 0.28 -0.04 0.04 0.00 -0.13 0.00 0.00 59.36 59.51 3hh8 h GLU 186 Cb -0.05 -0.14 -0.05 0.00 0.63 0.00 0.00 28.75 29.14 3hh8 h GLU 186 CO -0.08 0.42 0.59 0.00 -0.73 0.00 0.00 179.01 179.20 3hh8 h ALA 187 N 1.20 1.45 0.00 2.92 0.00 -0.31 -1.29 119.26 123.23 3hh8 h ALA 187 Ca 0.19 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 55.05 3hh8 h ALA 187 Cb -0.04 -0.31 -0.00 0.00 0.00 0.00 0.00 17.79 17.44 3hh8 h ALA 187 CO -0.06 0.46 -0.05 0.87 0.00 0.00 0.00 179.25 180.47 3hh8 h LYS 188 N 1.11 0.00 -0.01 0.00 1.57 -0.87 -2.88 116.57 115.49 3hh8 h LYS 188 Ca 0.36 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.14 3hh8 h LYS 188 Cb 0.04 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.35 3hh8 h LYS 188 CO -0.11 0.05 -0.55 0.43 -0.57 0.00 0.00 179.45 178.70 3hh8 n SER 189 N -3.28 1.13 0.24 0.86 7.64 -0.87 -4.78 113.62 114.57 3hh8 n SER 189 Ca -0.01 -1.07 0.07 0.00 1.01 0.00 0.00 58.87 58.87 3hh8 n SER 189 Cb 0.23 0.76 0.58 0.00 -1.01 0.00 0.00 64.21 64.78 3hh8 n SER 189 CO 0.00 0.00 0.00 0.50 -3.01 0.00 0.00 175.04 172.53 3hh8 h LYS 190 N 0.81 0.00 -0.47 1.43 1.63 -1.02 -2.38 116.57 116.57 3hh8 h LYS 190 Ca 0.00 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.80 3hh8 h LYS 190 Cb 0.45 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.08 3hh8 h LYS 190 CO 0.00 0.11 0.00 1.19 -3.45 0.00 0.00 179.45 177.30 3hh8 n PHE 191 N -4.34 0.65 0.20 1.91 3.72 -1.26 -4.64 117.46 113.70 3hh8 n PHE 191 Ca -0.03 -0.51 0.11 0.00 -0.05 0.00 0.00 57.45 56.97 3hh8 n PHE 191 Cb 0.19 -0.03 0.65 0.00 -0.94 0.00 0.00 39.48 39.35 3hh8 n PHE 191 CO 0.00 0.00 0.00 -0.44 -0.05 0.00 0.00 176.76 176.27 3hh8 h ASP 192 N 2.74 0.00 -0.05 4.37 3.32 -1.76 -2.01 116.42 123.02 3hh8 h ASP 192 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3hh8 h ASP 192 Cb 0.84 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.39 3hh8 h ASP 192 CO 0.01 0.00 0.00 0.00 -1.72 0.00 0.00 179.24 177.53 3hh8 n ALA 193 N -2.56 2.56 -2.70 3.45 0.00 -1.26 -4.86 120.51 115.14 3hh8 n ALA 193 Ca -0.00 -0.48 -0.37 0.00 0.00 0.00 0.00 53.44 52.59 3hh8 n ALA 193 Cb 0.20 -1.13 -0.08 0.00 0.00 0.00 0.00 19.45 18.44 3hh8 n ALA 193 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 3hh8 s ILE 194 N -1.95 5.31 0.38 0.00 1.01 -0.76 -5.06 121.20 120.14 3hh8 s ILE 194 Ca 0.36 0.44 -0.26 0.00 0.00 0.00 0.00 60.65 61.19 3hh8 s ILE 194 Cb 0.20 -3.59 -0.11 0.00 0.01 0.00 0.00 42.46 38.96 3hh8 s ILE 194 CO 0.32 0.36 1.15 0.00 0.00 0.00 0.00 174.94 176.76 3hh8 n ALA 195 N 3.92 0.67 -0.19 9.38 0.00 -1.26 -4.88 120.51 128.15 3hh8 n ALA 195 Ca -0.13 0.30 0.07 0.00 0.00 0.00 0.00 53.44 53.69 3hh8 n ALA 195 Cb 0.52 -2.16 0.36 0.00 0.00 0.00 0.00 19.45 18.17 3hh8 n ALA 195 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 3hh8 h GLU 196 N 2.01 0.72 0.00 0.00 4.57 -1.96 0.26 114.58 120.17 3hh8 h GLU 196 Ca -0.45 -0.04 0.00 0.00 -1.18 0.00 0.00 59.36 57.69 3hh8 h GLU 196 Cb 1.31 -0.16 0.00 0.00 -0.16 0.00 0.00 28.75 29.74 3hh8 h GLU 196 CO 0.60 0.48 0.00 0.27 -1.18 0.00 0.00 179.01 179.17 3hh8 n ASN 197 N -4.49 0.00 -0.22 1.04 6.94 -1.26 -2.20 115.26 115.07 3hh8 n ASN 197 Ca 0.11 -0.90 0.04 0.00 -0.02 0.00 0.00 54.58 53.82 3hh8 n ASN 197 Cb 0.26 0.00 0.01 0.00 -2.36 0.00 0.00 39.78 37.69 3hh8 n ASN 197 CO 0.00 0.00 0.00 0.29 -1.03 0.00 0.00 177.26 176.52 3hh8 n LYS 198 N -0.86 1.86 -3.02 -3.83 5.02 0.07 -4.27 118.16 113.12 3hh8 n LYS 198 Ca 0.12 -0.64 -0.45 0.00 -2.02 0.00 0.00 58.31 55.33 3hh8 n LYS 198 Cb 0.06 -1.06 -0.03 0.00 -0.02 0.00 0.00 35.03 33.98 3hh8 n LYS 198 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 3hh8 s LYS 199 N -1.16 3.50 -0.16 1.97 1.02 -0.93 -4.65 119.74 119.33 3hh8 s LYS 199 Ca 0.08 -1.79 -0.07 0.00 0.02 0.00 0.00 55.97 54.21 3hh8 s LYS 199 Cb 0.07 -4.69 0.07 0.00 -0.52 0.00 0.00 37.83 32.76 3hh8 s LYS 199 CO 0.20 -1.65 0.36 -1.17 -0.92 0.00 0.00 175.35 172.17 3hh8 s LEU 200 N 2.27 -0.33 -0.22 3.17 2.96 -1.26 -4.14 118.68 121.13 3hh8 s LEU 200 Ca 0.26 0.82 -0.17 0.00 -0.22 0.00 0.00 54.13 54.83 3hh8 s LEU 200 Cb -0.09 1.12 -0.04 0.00 0.50 0.00 0.00 46.19 47.68 3hh8 s LEU 200 CO -0.06 -0.22 0.44 -0.63 -1.32 0.00 0.00 176.35 174.56 3hh8 s ILE 201 N 2.16 5.16 -0.18 6.68 1.01 0.04 -4.80 121.20 131.25 3hh8 s ILE 201 Ca -0.03 0.76 -0.00 0.00 0.00 0.00 0.00 60.65 61.38 3hh8 s ILE 201 Cb -0.11 -3.76 0.01 0.00 0.01 0.00 0.00 42.46 38.61 3hh8 s ILE 201 CO -0.11 0.20 -0.16 -0.69 0.00 0.00 0.00 174.94 174.18 3hh8 s VAL 202 N 1.65 2.46 0.28 2.92 1.01 -1.26 -0.33 120.40 127.13 3hh8 s VAL 202 Ca 0.20 -0.81 0.02 0.00 0.00 0.00 0.00 61.98 61.39 3hh8 s VAL 202 Cb -0.15 -2.06 -0.04 0.00 0.00 0.00 0.00 36.38 34.13 3hh8 s VAL 202 CO 0.09 0.51 0.15 0.42 0.00 0.00 0.00 175.10 176.26 3hh8 s THR 203 N 1.23 0.31 -0.06 3.92 -4.23 -0.99 -1.26 115.64 114.56 3hh8 s THR 203 Ca 0.03 -2.00 -0.19 0.00 -1.18 0.00 0.00 61.69 58.35 3hh8 s THR 203 Cb -0.14 -2.54 -0.14 0.00 1.34 0.00 0.00 72.50 71.03 3hh8 s THR 203 CO -0.08 0.00 0.75 0.28 -0.54 0.00 0.00 174.62 175.03 3hh8 h SER 204 N 2.31 -0.20 -3.57 3.99 0.02 -1.88 -3.13 113.55 111.09 3hh8 h SER 204 Ca -0.35 -0.30 -0.52 0.00 -0.84 0.00 0.00 61.79 59.79 3hh8 h SER 204 Cb 1.25 0.05 -0.03 0.00 0.14 0.00 0.00 62.40 63.81 3hh8 h SER 204 CO 0.53 0.35 0.10 -0.70 -1.14 0.00 0.00 176.83 175.98 3hh8 s GLU 205 N -3.16 4.23 -1.34 3.45 2.12 -1.26 -0.25 118.70 122.49 3hh8 s GLU 205 Ca -0.11 0.85 -0.09 0.00 0.36 0.00 0.00 54.97 55.98 3hh8 s GLU 205 Cb 0.00 -2.86 -0.09 0.00 0.26 0.00 0.00 34.13 31.45 3hh8 s GLU 205 CO 0.41 0.38 2.74 0.41 -0.54 0.00 0.00 175.26 178.66 3hh8 n GLY 206 N 0.67 3.85 1.37 -1.50 0.00 0.77 -4.57 105.19 105.77 3hh8 n GLY 206 Ca -0.02 -1.29 0.12 0.00 0.00 0.00 0.00 46.02 44.83 3hh8 n GLY 206 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hh8 n PHE 208 N 1.66 0.75 -0.30 0.00 3.72 -1.26 -4.67 117.46 117.36 3hh8 n PHE 208 Ca 0.25 -0.48 0.05 0.00 -0.05 0.00 0.00 57.45 57.22 3hh8 n PHE 208 Cb 0.63 -0.01 0.20 0.00 -0.94 0.00 0.00 39.48 39.36 3hh8 n PHE 208 CO 0.00 0.00 0.00 0.87 -0.05 0.00 0.00 176.76 177.58 3hh8 h LYS 209 N 3.42 0.72 -0.23 -1.08 1.57 -1.90 0.28 116.57 119.35 3hh8 h LYS 209 Ca 0.00 -0.04 -0.20 0.00 -1.87 0.00 0.00 60.65 58.54 3hh8 h LYS 209 Cb 0.89 -0.16 0.00 0.00 0.08 0.00 0.00 32.23 33.04 3hh8 h LYS 209 CO 0.00 0.48 -0.63 1.88 -0.57 0.00 0.00 179.45 180.60 3hh8 h TYR 210 N 0.74 1.07 -0.27 -1.35 0.05 -1.83 -1.69 116.97 113.69 3hh8 h TYR 210 Ca 0.44 -0.41 -0.01 0.00 0.05 0.00 0.00 58.73 58.79 3hh8 h TYR 210 Cb 0.50 -0.19 -0.01 0.00 1.01 0.00 0.00 36.73 38.04 3hh8 h TYR 210 CO -0.07 1.24 0.13 0.35 -1.05 0.00 0.00 178.16 178.77 3hh8 h PHE 211 N 0.61 0.40 -0.90 4.88 3.57 -1.59 -1.30 116.94 122.60 3hh8 h PHE 211 Ca -0.01 -0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.46 3hh8 h PHE 211 Cb 1.25 -0.12 -0.04 0.00 2.79 0.00 0.00 35.95 39.82 3hh8 h PHE 211 CO 0.08 0.37 0.52 0.77 -2.23 0.00 0.00 178.31 177.82 3hh8 h SER 212 N 0.31 1.11 -0.16 0.41 0.02 -0.36 0.98 113.55 115.85 3hh8 h SER 212 Ca 0.09 -0.08 -0.03 0.00 -0.84 0.00 0.00 61.79 60.93 3hh8 h SER 212 Cb 0.13 -0.28 -0.01 0.00 0.14 0.00 0.00 62.40 62.38 3hh8 h SER 212 CO -0.01 0.87 -0.03 0.50 -1.14 0.00 0.00 176.83 177.02 3hh8 h LYS 213 N 1.25 0.31 -0.30 3.45 1.63 -1.23 -1.17 116.57 120.51 3hh8 h LYS 213 Ca 0.32 -0.11 -0.17 0.00 -0.85 0.00 0.00 60.65 59.84 3hh8 h LYS 213 Cb -0.01 -0.02 -0.00 0.00 -0.60 0.00 0.00 32.23 31.59 3hh8 h LYS 213 CO -0.06 0.57 -0.47 0.00 -3.45 0.00 0.00 179.45 176.04 3hh8 h ALA 214 N 0.73 0.60 -0.07 5.00 0.00 -0.91 -3.35 119.26 121.27 3hh8 h ALA 214 Ca 0.04 -0.48 0.00 0.00 0.00 0.00 0.00 54.91 54.47 3hh8 h ALA 214 Cb 0.44 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.14 3hh8 h ALA 214 CO 0.01 0.68 0.00 0.66 0.00 0.00 0.00 179.25 180.60 3hh8 n TYR 215 N -4.02 0.09 -2.13 0.00 4.01 0.31 -4.93 117.16 110.49 3hh8 n TYR 215 Ca -0.03 -0.17 -0.08 0.00 -0.16 0.00 0.00 57.90 57.46 3hh8 n TYR 215 Cb 0.58 -0.01 -0.00 0.00 -0.31 0.00 0.00 39.34 39.59 3hh8 n TYR 215 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3hh8 n GLY 216 N 0.26 0.05 3.02 2.72 0.00 -0.45 -4.92 105.19 105.88 3hh8 n GLY 216 Ca 0.05 -0.54 -0.31 0.00 0.00 0.00 0.00 46.02 45.21 3hh8 n GLY 216 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3hh8 s VAL 217 N -2.41 1.95 0.80 1.61 1.01 -1.19 -5.08 120.40 117.10 3hh8 s VAL 217 Ca 0.00 -1.53 -0.13 0.00 0.00 0.00 0.00 61.98 60.31 3hh8 s VAL 217 Cb 0.00 -2.13 0.08 0.00 0.00 0.00 0.00 36.38 34.33 3hh8 s VAL 217 CO 0.00 -0.08 1.21 -2.84 0.00 0.00 0.00 175.10 173.38 3hh8 s PRO 218 N 1.19 1.65 0.12 2.72 0.02 -1.26 -4.19 135.00 135.24 3hh8 s PRO 218 Ca -0.07 1.76 0.03 0.00 0.02 0.00 0.00 61.00 62.74 3hh8 s PRO 218 Cb -0.20 -1.78 -0.04 0.00 0.02 0.00 0.00 34.50 32.51 3hh8 s PRO 218 CO -0.06 -2.21 -0.09 -1.54 -0.33 0.00 0.00 177.00 172.78 3hh8 s SER 219 N -2.15 1.46 0.14 2.53 1.04 -1.26 -0.78 113.70 114.68 3hh8 s SER 219 Ca 0.73 -0.96 -0.05 0.00 0.48 0.00 0.00 55.95 56.15 3hh8 s SER 219 Cb -0.29 0.03 -0.02 0.00 0.10 0.00 0.00 66.02 65.84 3hh8 s SER 219 CO 0.50 -0.36 0.16 0.00 0.98 0.00 0.00 173.24 174.52 3hh8 s ALA 220 N -3.20 0.38 0.27 5.32 0.00 0.56 -4.87 121.76 120.21 3hh8 s ALA 220 Ca 0.12 -1.14 -0.14 0.00 0.00 0.00 0.00 51.96 50.80 3hh8 s ALA 220 Cb 0.02 0.80 0.00 0.00 0.00 0.00 0.00 23.12 23.95 3hh8 s ALA 220 CO -0.02 -0.55 0.54 1.52 0.00 0.00 0.00 175.76 177.25 3hh8 s TYR 221 N -3.99 0.27 -0.14 0.00 1.13 -1.26 -2.36 117.35 111.01 3hh8 s TYR 221 Ca 0.19 -0.66 -0.10 0.00 -1.41 0.00 0.00 57.07 55.09 3hh8 s TYR 221 Cb 0.05 0.31 -0.06 0.00 -1.10 0.00 0.00 41.96 41.17 3hh8 s TYR 221 CO -0.01 -1.08 0.01 0.82 -2.51 0.00 0.00 175.55 172.78 3hh8 h ILE 222 N 2.18 0.27 -4.11 -3.49 2.04 -0.56 -3.43 117.51 110.41 3hh8 h ILE 222 Ca -0.25 -1.27 -0.69 0.00 1.00 0.00 0.00 64.86 63.65 3hh8 h ILE 222 Cb 1.25 0.58 -0.24 0.00 -0.74 0.00 0.00 36.82 37.67 3hh8 h ILE 222 CO 0.33 0.09 -0.87 -1.66 0.00 0.00 0.00 178.15 176.04 3hh8 s TRP 223 N -2.04 2.29 0.16 1.37 -2.14 -0.25 -4.76 118.94 113.57 3hh8 s TRP 223 Ca -0.13 -0.40 -0.07 0.00 2.66 0.00 0.00 56.10 58.16 3hh8 s TRP 223 Cb 0.02 -1.31 0.02 0.00 -3.10 0.00 0.00 33.47 29.10 3hh8 s TRP 223 CO 0.24 0.22 1.48 1.49 -2.66 0.00 0.00 176.95 177.72 3hh8 h GLU 224 N 4.37 0.76 -3.51 3.25 4.81 -1.93 0.22 114.58 122.55 3hh8 h GLU 224 Ca -0.48 -0.45 -0.13 0.00 -0.13 0.00 0.00 59.36 58.17 3hh8 h GLU 224 Cb 1.16 0.04 -0.19 0.00 0.63 0.00 0.00 28.75 30.38 3hh8 h GLU 224 CO 0.41 1.07 -0.45 -1.50 -0.73 0.00 0.00 179.01 177.82 3hh8 s ILE 225 N -4.17 0.09 0.35 2.32 2.07 -1.26 -3.26 121.20 117.34 3hh8 s ILE 225 Ca -0.09 -0.77 -0.29 0.00 -1.41 0.00 0.00 60.65 58.09 3hh8 s ILE 225 Cb 0.11 -0.64 -0.11 0.00 0.13 0.00 0.00 42.46 41.95 3hh8 s ILE 225 CO 0.87 -0.43 1.52 0.20 -1.91 0.00 0.00 174.94 175.19 3hh8 s ASN 226 N -1.66 6.35 0.00 4.50 0.01 -1.26 -4.95 114.94 117.93 3hh8 s ASN 226 Ca -0.11 3.02 0.00 0.00 -0.71 0.00 0.00 52.86 55.06 3hh8 s ASN 226 Cb -0.05 -2.66 0.00 0.00 0.41 0.00 0.00 41.25 38.95 3hh8 s ASN 226 CO -0.00 -0.88 0.00 0.35 -1.51 0.00 0.00 177.10 175.05 3hh8 n THR 227 N 1.00 0.00 0.78 1.60 -2.24 -1.26 -5.00 114.28 109.17 3hh8 n THR 227 Ca 0.03 0.00 0.13 0.00 -2.27 0.00 0.00 64.05 61.94 3hh8 n THR 227 Cb 0.39 0.00 0.36 0.00 -2.10 0.00 0.00 70.33 68.98 3hh8 n THR 227 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3hh8 n GLU 228 N 0.00 0.15 -0.06 -0.78 -0.58 -1.26 -4.57 120.64 113.54 3hh8 n GLU 228 Ca 0.00 0.08 -0.13 0.00 -0.42 0.00 0.00 57.16 56.69 3hh8 n GLU 228 Cb 0.00 -1.63 -0.04 0.00 -0.57 0.00 0.00 31.44 29.19 3hh8 n GLU 228 CO 0.00 0.00 0.00 -0.85 -0.48 0.00 0.00 177.13 175.80 3hh8 n GLU 229 N -1.87 0.27 -3.60 3.49 0.00 -1.26 -5.09 120.64 112.58 3hh8 n GLU 229 Ca 0.05 0.12 -0.33 0.00 0.00 0.00 0.00 57.16 57.00 3hh8 n GLU 229 Cb 0.39 -0.95 0.02 0.00 0.00 0.00 0.00 31.44 30.90 3hh8 n GLU 229 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.13 177.52 3hh8 n GLU 230 N -3.60 -1.79 0.00 3.44 1.02 -1.26 -4.73 120.64 113.72 3hh8 n GLU 230 Ca -0.24 1.19 0.00 0.00 -0.02 0.00 0.00 57.16 58.09 3hh8 n GLU 230 Cb 0.65 -2.25 0.00 0.00 -0.02 0.00 0.00 31.44 29.82 3hh8 n GLU 230 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3hh8 n GLY 231 N -0.75 0.81 3.77 0.62 0.00 -1.26 -4.95 105.19 103.42 3hh8 n GLY 231 Ca -0.17 -0.05 -0.35 0.00 0.00 0.00 0.00 46.02 45.45 3hh8 n GLY 231 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3hh8 s THR 232 N 0.00 3.09 0.32 2.61 -4.23 -1.26 -4.94 115.64 111.23 3hh8 s THR 232 Ca 0.00 0.65 0.03 0.00 -1.18 0.00 0.00 61.69 61.19 3hh8 s THR 232 Cb 0.00 -3.23 0.29 0.00 1.34 0.00 0.00 72.50 70.90 3hh8 s THR 232 CO 0.00 -0.18 1.90 -0.65 -0.54 0.00 0.00 174.62 175.14 3hh8 h PRO 233 N 0.93 0.89 -0.55 3.99 0.11 -2.00 -2.27 132.00 133.10 3hh8 h PRO 233 Ca -0.49 -0.05 -0.08 0.00 0.11 0.00 0.00 66.00 65.48 3hh8 h PRO 233 Cb 1.26 -0.20 -0.02 0.00 0.11 0.00 0.00 31.00 32.15 3hh8 h PRO 233 CO 0.56 0.59 0.03 0.22 -0.21 0.00 0.00 178.00 179.19 3hh8 h ASP 234 N 0.92 0.88 -0.56 -2.05 3.58 -1.99 0.24 116.42 117.43 3hh8 h ASP 234 Ca 0.41 -0.21 -0.04 0.00 0.42 0.00 0.00 57.03 57.61 3hh8 h ASP 234 Cb 0.37 -0.23 -0.02 0.00 1.72 0.00 0.00 39.33 41.16 3hh8 h ASP 234 CO -0.17 0.92 0.21 1.56 -2.88 0.00 0.00 179.24 178.87 3hh8 h GLN 235 N 0.85 0.85 -0.48 0.28 4.20 -1.80 -0.41 115.11 118.60 3hh8 h GLN 235 Ca 0.17 -0.17 -0.07 0.00 0.06 0.00 0.00 58.65 58.64 3hh8 h GLN 235 Cb 0.46 -0.13 -0.02 0.00 0.30 0.00 0.00 27.48 28.09 3hh8 h GLN 235 CO 0.02 0.75 0.05 0.82 -0.67 0.00 0.00 178.83 179.80 3hh8 h ILE 236 N 0.77 1.26 -0.68 2.54 2.04 -1.15 -2.36 117.51 119.94 3hh8 h ILE 236 Ca 0.18 -0.98 -0.08 0.00 1.00 0.00 0.00 64.86 64.98 3hh8 h ILE 236 Cb 0.23 0.95 -0.03 0.00 -0.74 0.00 0.00 36.82 37.23 3hh8 h ILE 236 CO -0.01 0.35 0.11 -1.28 0.00 0.00 0.00 178.15 177.31 3hh8 h SER 237 N 0.69 1.08 -0.68 1.72 0.87 -0.76 -0.74 113.55 115.72 3hh8 h SER 237 Ca 0.14 -0.26 0.01 0.00 -1.23 0.00 0.00 61.79 60.45 3hh8 h SER 237 Cb 0.44 -0.29 -0.04 0.00 -0.44 0.00 0.00 62.40 62.08 3hh8 h SER 237 CO 0.02 1.06 0.45 0.28 -0.53 0.00 0.00 176.83 178.11 3hh8 h SER 238 N 1.05 0.76 -0.18 6.23 0.02 -0.94 -0.41 113.55 120.08 3hh8 h SER 238 Ca 0.20 -0.02 -0.04 0.00 -0.84 0.00 0.00 61.79 61.10 3hh8 h SER 238 Cb 0.45 -0.19 -0.01 0.00 0.14 0.00 0.00 62.40 62.80 3hh8 h SER 238 CO 0.01 0.55 -0.03 0.25 -1.14 0.00 0.00 176.83 176.48 3hh8 h LEU 239 N 0.90 0.34 -0.80 5.07 5.85 -1.08 -1.81 115.31 123.78 3hh8 h LEU 239 Ca 0.25 -0.34 0.10 0.00 0.84 0.00 0.00 57.88 58.73 3hh8 h LEU 239 Cb -0.08 -0.09 -0.08 0.00 0.37 0.00 0.00 40.66 40.78 3hh8 h LEU 239 CO -0.06 0.60 0.44 0.40 -0.34 0.00 0.00 178.44 179.48 3hh8 h ILE 240 N 0.07 0.87 -0.33 4.05 1.08 -0.89 -0.27 117.51 122.09 3hh8 h ILE 240 Ca 0.05 -0.25 -0.04 0.00 -0.39 0.00 0.00 64.86 64.23 3hh8 h ILE 240 Cb 0.45 0.09 -0.01 0.00 -3.07 0.00 0.00 36.82 34.27 3hh8 h ILE 240 CO 0.01 0.13 0.05 -0.33 -0.69 0.00 0.00 178.15 177.33 3hh8 h GLU 241 N 0.72 0.55 -0.84 2.37 4.39 -0.90 -2.73 114.58 118.15 3hh8 h GLU 241 Ca 0.39 -0.15 0.03 0.00 0.34 0.00 0.00 59.36 59.97 3hh8 h GLU 241 Cb 0.40 -0.06 -0.05 0.00 -0.10 0.00 0.00 28.75 28.94 3hh8 h GLU 241 CO -0.27 0.63 0.54 -0.22 -1.16 0.00 0.00 179.01 178.54 3hh8 h LYS 242 N 0.38 1.04 0.00 2.33 3.64 -0.58 -1.98 116.57 121.40 3hh8 h LYS 242 Ca 0.10 -0.06 -0.00 0.00 -1.27 0.00 0.00 60.65 59.42 3hh8 h LYS 242 Cb 0.35 -0.23 -0.00 0.00 -0.41 0.00 0.00 32.23 31.94 3hh8 h LYS 242 CO 0.01 0.69 -0.01 -0.07 -2.27 0.00 0.00 179.45 177.80 3hh8 h LEU 243 N 1.07 0.00 -0.60 5.20 3.38 -0.78 -0.21 115.31 123.37 3hh8 h LEU 243 Ca 0.33 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 58.20 3hh8 h LEU 243 Cb -0.03 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.71 3hh8 h LEU 243 CO -0.10 0.01 -0.48 0.11 0.09 0.00 0.00 178.44 178.06 3hh8 h LYS 244 N 0.00 0.00 0.09 1.13 1.57 -1.12 -3.31 116.57 114.94 3hh8 h LYS 244 Ca -0.00 0.00 -0.27 0.00 -1.87 0.00 0.00 60.65 58.51 3hh8 h LYS 244 Cb 0.16 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.46 3hh8 h LYS 244 CO 0.00 0.48 -1.43 0.28 -0.57 0.00 0.00 179.45 178.21 3hh8 h VAL 245 N 0.00 0.97 -3.44 0.50 2.07 -1.07 -3.44 116.25 111.85 3hh8 h VAL 245 Ca -0.00 -2.35 -0.58 0.00 0.82 0.00 0.00 66.70 64.58 3hh8 h VAL 245 Cb 1.11 2.62 -0.39 0.00 -1.52 0.00 0.00 31.29 33.11 3hh8 h VAL 245 CO 0.06 0.66 -0.77 -0.51 0.02 0.00 0.00 177.57 177.04 3hh8 s ILE 246 N -2.46 1.16 -0.52 4.57 1.10 -0.88 -5.08 121.20 119.09 3hh8 s ILE 246 Ca -0.22 -1.15 -0.07 0.00 -0.51 0.00 0.00 60.65 58.71 3hh8 s ILE 246 Cb 0.05 -1.61 0.14 0.00 0.15 0.00 0.00 42.46 41.18 3hh8 s ILE 246 CO 0.73 -0.28 0.37 -0.75 -2.11 0.00 0.00 174.94 172.90 3hh8 s LYS 247 N 1.54 2.49 0.76 3.50 2.20 -1.25 -4.39 119.74 124.59 3hh8 s LYS 247 Ca -0.00 -2.01 -0.11 0.00 -0.36 0.00 0.00 55.97 53.49 3hh8 s LYS 247 Cb -0.18 -3.85 0.04 0.00 -1.51 0.00 0.00 37.83 32.33 3hh8 s LYS 247 CO -0.11 -1.17 1.08 -1.25 -0.36 0.00 0.00 175.35 173.54 3hh8 s PRO 248 N 0.90 2.43 0.00 4.03 0.04 -1.26 -4.82 135.00 136.32 3hh8 s PRO 248 Ca 0.10 0.73 0.28 0.00 0.04 0.00 0.00 61.00 62.15 3hh8 s PRO 248 Cb -0.23 -1.95 1.15 0.00 0.04 0.00 0.00 34.50 33.51 3hh8 s PRO 248 CO -0.03 -1.40 1.85 0.43 0.04 0.00 0.00 177.00 177.89 3hh8 n SER 249 N -3.30 0.15 -3.79 6.66 7.64 -1.26 -4.88 113.62 114.84 3hh8 n SER 249 Ca 0.07 0.12 -0.13 0.00 1.01 0.00 0.00 58.87 59.95 3hh8 n SER 249 Cb 0.55 -0.28 -0.09 0.00 -1.01 0.00 0.00 64.21 63.39 3hh8 n SER 249 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3hh8 s ALA 250 N -2.86 -0.65 0.30 -0.43 0.00 -1.26 -4.52 121.76 112.33 3hh8 s ALA 250 Ca 0.18 0.17 0.09 0.00 0.00 0.00 0.00 51.96 52.40 3hh8 s ALA 250 Cb 0.19 0.11 -0.05 0.00 0.00 0.00 0.00 23.12 23.38 3hh8 s ALA 250 CO 0.54 -0.26 0.03 -0.51 0.00 0.00 0.00 175.76 175.56 3hh8 s LEU 251 N -1.43 3.15 0.15 0.00 1.43 0.06 -4.69 118.68 117.34 3hh8 s LEU 251 Ca -0.13 -0.76 0.06 0.00 -1.03 0.00 0.00 54.13 52.28 3hh8 s LEU 251 Cb -0.05 -1.63 -0.04 0.00 0.03 0.00 0.00 46.19 44.49 3hh8 s LEU 251 CO 0.03 -0.12 -0.14 -0.36 0.23 0.00 0.00 176.35 175.99 3hh8 s PHE 252 N -2.39 1.49 -0.02 0.29 0.08 -0.39 -0.53 117.98 116.50 3hh8 s PHE 252 Ca 0.34 -0.58 0.02 0.00 0.12 0.00 0.00 56.93 56.83 3hh8 s PHE 252 Cb -0.04 -0.75 0.00 0.00 -0.57 0.00 0.00 43.02 41.66 3hh8 s PHE 252 CO 0.20 0.20 -0.09 0.54 -0.10 0.00 0.00 175.22 175.97 3hh8 s VAL 253 N -2.45 0.76 0.47 -0.44 0.11 -1.06 -4.32 120.40 113.46 3hh8 s VAL 253 Ca 0.13 -0.35 -0.19 0.00 -2.93 0.00 0.00 61.98 58.64 3hh8 s VAL 253 Cb -0.03 -0.67 -0.10 0.00 -1.53 0.00 0.00 36.38 34.05 3hh8 s VAL 253 CO 0.04 0.24 0.97 -1.61 -3.33 0.00 0.00 175.10 171.40 3hh8 s GLU 254 N 0.15 4.09 0.22 1.54 8.01 -1.26 -0.77 118.70 130.68 3hh8 s GLU 254 Ca -0.02 1.08 0.23 0.00 0.01 0.00 0.00 54.97 56.27 3hh8 s GLU 254 Cb -0.08 -2.16 0.93 0.00 -4.31 0.00 0.00 34.13 28.52 3hh8 s GLU 254 CO 0.00 -0.15 1.70 -1.13 0.01 0.00 0.00 175.26 175.69 3hh8 n SER 255 N -1.01 0.61 -0.71 -0.19 3.41 -0.25 -3.19 113.62 112.30 3hh8 n SER 255 Ca 0.07 0.64 0.06 0.00 -0.26 0.00 0.00 58.87 59.38 3hh8 n SER 255 Cb 0.54 -0.77 0.17 0.00 -0.26 0.00 0.00 64.21 63.89 3hh8 n SER 255 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 3hh8 n SER 256 N -2.16 3.08 -4.43 4.04 3.41 -1.26 -4.77 113.62 111.53 3hh8 n SER 256 Ca 0.03 -2.08 -0.23 0.00 -0.26 0.00 0.00 58.87 56.33 3hh8 n SER 256 Cb 0.24 -0.27 -0.10 0.00 -0.26 0.00 0.00 64.21 63.82 3hh8 n SER 256 CO 0.00 0.00 0.00 0.68 -0.16 0.00 0.00 175.04 175.56 3hh8 s VAL 257 N -1.15 2.28 0.08 -3.33 -7.23 -1.19 -4.07 120.40 105.78 3hh8 s VAL 257 Ca 0.26 -2.34 -0.31 0.00 -1.81 0.00 0.00 61.98 57.78 3hh8 s VAL 257 Cb 0.15 -2.22 -0.08 0.00 0.56 0.00 0.00 36.38 34.78 3hh8 s VAL 257 CO 0.16 -0.44 1.66 -0.62 -0.31 0.00 0.00 175.10 175.55 3hh8 s ASP 258 N -3.43 6.59 0.24 4.85 2.15 -1.26 -4.91 116.67 120.91 3hh8 s ASP 258 Ca 0.28 2.50 0.26 0.00 0.43 0.00 0.00 52.55 56.02 3hh8 s ASP 258 Cb -0.04 -2.56 0.84 0.00 -0.30 0.00 0.00 42.92 40.86 3hh8 s ASP 258 CO 0.13 -0.89 1.76 0.03 -0.17 0.00 0.00 175.17 176.03 3hh8 h ARG 259 N 8.26 0.00 -0.69 4.34 3.08 -1.99 -3.38 114.38 124.00 3hh8 h ARG 259 Ca -0.43 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 59.62 3hh8 h ARG 259 Cb 1.20 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 31.22 3hh8 h ARG 259 CO 0.93 0.00 0.42 0.00 -1.07 0.00 0.00 179.97 180.25 3hh8 h ARG 260 N 0.00 0.93 -0.48 0.04 3.08 -1.99 -0.89 114.38 115.06 3hh8 h ARG 260 Ca 0.00 -0.08 -0.00 0.00 0.07 0.00 0.00 59.98 59.97 3hh8 h ARG 260 Cb 0.66 -0.20 -0.02 0.00 0.08 0.00 0.00 29.97 30.49 3hh8 h ARG 260 CO 0.00 0.65 0.29 -1.35 -1.07 0.00 0.00 179.97 178.49 3hh8 h PRO 261 N 0.93 0.65 -0.03 0.04 0.11 -1.93 -1.05 132.00 130.73 3hh8 h PRO 261 Ca 0.25 -0.06 -0.07 0.00 0.11 0.00 0.00 66.00 66.23 3hh8 h PRO 261 Cb -0.05 -0.14 -0.01 0.00 0.11 0.00 0.00 31.00 30.92 3hh8 h PRO 261 CO -0.05 0.47 -0.30 1.98 -0.21 0.00 0.00 178.00 179.90 3hh8 h MET 262 N 0.65 0.05 -0.60 1.05 4.05 -1.74 -1.28 114.93 117.11 3hh8 h MET 262 Ca 0.17 -0.02 -0.02 0.00 -0.28 0.00 0.00 59.70 59.56 3hh8 h MET 262 Cb -0.01 -0.00 -0.03 0.00 -0.80 0.00 0.00 31.60 30.75 3hh8 h MET 262 CO -0.03 0.35 0.30 0.93 0.23 0.00 0.00 176.91 178.69 3hh8 h GLU 263 N 0.04 0.86 -0.36 0.39 4.39 -0.68 0.32 114.58 119.54 3hh8 h GLU 263 Ca 0.00 -0.12 0.03 0.00 0.34 0.00 0.00 59.36 59.62 3hh8 h GLU 263 Cb 0.56 -0.16 -0.03 0.00 -0.10 0.00 0.00 28.75 29.02 3hh8 h GLU 263 CO 0.04 0.68 0.16 1.15 -1.16 0.00 0.00 179.01 179.88 3hh8 h THR 264 N 0.82 0.95 -0.49 1.13 2.02 -0.73 -0.31 112.91 116.30 3hh8 h THR 264 Ca 0.21 -0.12 0.05 0.00 0.77 0.00 0.00 66.41 67.33 3hh8 h THR 264 Cb 0.09 0.59 -0.05 0.00 -1.74 0.00 0.00 68.15 67.04 3hh8 h THR 264 CO -0.03 0.06 0.22 0.58 0.37 0.00 0.00 175.52 176.72 3hh8 h VAL 265 N 0.34 0.91 -0.30 3.16 2.07 -0.69 0.08 116.25 121.82 3hh8 h VAL 265 Ca 0.16 -0.15 0.00 0.00 0.82 0.00 0.00 66.70 67.53 3hh8 h VAL 265 Cb 0.09 0.44 -0.01 0.00 -1.52 0.00 0.00 31.29 30.28 3hh8 h VAL 265 CO -0.13 0.08 0.20 -1.28 0.02 0.00 0.00 177.57 176.46 3hh8 h SER 266 N 0.43 0.34 -0.32 0.57 0.87 -0.20 0.65 113.55 115.89 3hh8 h SER 266 Ca 0.22 -0.01 0.01 0.00 -1.23 0.00 0.00 61.79 60.78 3hh8 h SER 266 Cb 0.18 -0.08 -0.02 0.00 -0.44 0.00 0.00 62.40 62.03 3hh8 h SER 266 CO -0.19 0.25 0.21 0.50 -0.53 0.00 0.00 176.83 177.06 3hh8 h LYS 267 N 0.40 0.41 -0.02 2.24 3.64 -0.68 0.38 116.57 122.93 3hh8 h LYS 267 Ca 0.11 -0.02 -0.19 0.00 -1.27 0.00 0.00 60.65 59.28 3hh8 h LYS 267 Cb -0.05 -0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 31.67 3hh8 h LYS 267 CO -0.02 0.27 -0.80 -0.44 -2.27 0.00 0.00 179.45 176.19 3hh8 h ASP 268 N 0.42 0.30 1.15 4.20 3.32 -0.77 -3.27 116.42 121.77 3hh8 h ASP 268 Ca 0.12 -0.22 -0.11 0.00 0.02 0.00 0.00 57.03 56.84 3hh8 h ASP 268 Cb -0.03 -0.09 -0.02 0.00 0.22 0.00 0.00 39.33 39.41 3hh8 h ASP 268 CO -0.04 0.98 -0.89 0.77 -1.72 0.00 0.00 179.24 178.34 3hh8 h SER 269 N 0.15 0.00 0.00 6.45 4.64 -0.84 -3.48 113.55 120.47 3hh8 h SER 269 Ca -0.04 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.28 3hh8 h SER 269 Cb 1.39 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.48 3hh8 h SER 269 CO 0.13 0.42 0.00 0.61 -0.87 0.00 0.00 176.83 177.11 3hh8 n GLY 270 N 1.28 0.61 3.69 -0.77 0.00 0.11 -5.02 105.19 105.09 3hh8 n GLY 270 Ca -0.03 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.62 3hh8 n GLY 270 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3hh8 s ILE 271 N -2.57 5.25 0.51 -0.61 1.01 -1.18 -5.02 121.20 118.58 3hh8 s ILE 271 Ca 0.00 0.60 -0.21 0.00 0.00 0.00 0.00 60.65 61.04 3hh8 s ILE 271 Cb 0.00 -3.67 -0.07 0.00 0.01 0.00 0.00 42.46 38.73 3hh8 s ILE 271 CO 0.00 0.31 1.11 -2.16 0.00 0.00 0.00 174.94 174.20 3hh8 s PRO 272 N 1.01 3.58 -0.31 2.79 0.04 -1.26 -4.41 135.00 136.44 3hh8 s PRO 272 Ca 0.17 1.58 -0.29 0.00 0.04 0.00 0.00 61.00 62.50 3hh8 s PRO 272 Cb -0.14 -2.13 0.01 0.00 0.04 0.00 0.00 34.50 32.28 3hh8 s PRO 272 CO 0.06 -0.65 1.20 0.42 0.04 0.00 0.00 177.00 178.07 3hh8 s ILE 273 N -1.77 4.30 -0.01 0.56 1.01 -1.26 -0.76 121.20 123.27 3hh8 s ILE 273 Ca 0.69 1.49 -0.19 0.00 0.00 0.00 0.00 60.65 62.63 3hh8 s ILE 273 Cb -0.23 -4.27 -0.31 0.00 0.01 0.00 0.00 42.46 37.66 3hh8 s ILE 273 CO 0.27 -0.48 0.97 0.22 0.00 0.00 0.00 174.94 175.92 3hh8 h TYR 274 N 8.73 0.72 -2.30 3.97 3.20 -1.18 -3.47 116.97 126.64 3hh8 h TYR 274 Ca -0.24 -0.49 -0.00 0.00 3.14 0.00 0.00 58.73 61.14 3hh8 h TYR 274 Cb 1.08 -0.04 -0.17 0.00 1.54 0.00 0.00 36.73 39.14 3hh8 h TYR 274 CO 0.86 1.37 0.29 0.45 -1.64 0.00 0.00 178.16 179.49 3hh8 s SER 275 N -7.14 -0.55 0.50 -2.11 0.15 -1.26 -5.08 113.70 98.21 3hh8 s SER 275 Ca -0.12 0.34 -0.20 0.00 0.70 0.00 0.00 55.95 56.67 3hh8 s SER 275 Cb 0.02 0.50 -0.08 0.00 -1.71 0.00 0.00 66.02 64.76 3hh8 s SER 275 CO 0.87 -0.69 1.06 -0.70 1.20 0.00 0.00 173.24 174.98 3hh8 s GLU 276 N -2.28 3.72 0.30 5.44 2.12 -1.26 -2.55 118.70 124.18 3hh8 s GLU 276 Ca -0.04 1.42 0.03 0.00 0.36 0.00 0.00 54.97 56.74 3hh8 s GLU 276 Cb -0.01 -2.09 -0.04 0.00 0.26 0.00 0.00 34.13 32.25 3hh8 s GLU 276 CO -0.01 -0.51 0.12 0.96 -0.54 0.00 0.00 175.26 175.28 3hh8 s ILE 277 N -1.92 0.53 -0.19 -3.70 -4.36 0.05 -4.88 121.20 106.72 3hh8 s ILE 277 Ca 0.68 -2.00 0.00 0.00 -0.26 0.00 0.00 60.65 59.07 3hh8 s ILE 277 Cb -0.18 -2.57 0.02 0.00 1.25 0.00 0.00 42.46 40.98 3hh8 s ILE 277 CO 0.22 0.00 -0.16 -0.36 0.24 0.00 0.00 174.94 174.87 3hh8 s PHE 278 N -3.59 2.85 0.02 1.37 0.08 -1.26 -1.08 117.98 116.36 3hh8 s PHE 278 Ca 0.35 -1.57 0.00 0.00 0.12 0.00 0.00 56.93 55.83 3hh8 s PHE 278 Cb 0.06 -1.96 0.00 0.00 -0.57 0.00 0.00 43.02 40.55 3hh8 s PHE 278 CO 0.16 -0.77 0.00 0.25 -0.10 0.00 0.00 175.22 174.76 3hh8 n THR 279 N 4.64 0.20 1.37 0.64 -2.24 -1.26 -4.86 114.28 112.76 3hh8 n THR 279 Ca -0.20 0.06 0.13 0.00 -2.27 0.00 0.00 64.05 61.78 3hh8 n THR 279 Cb 0.50 -1.08 0.44 0.00 -2.10 0.00 0.00 70.33 68.09 3hh8 n THR 279 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 3hh8 n ASP 280 N -2.66 1.78 -3.69 3.42 8.00 -1.26 -4.88 116.55 117.27 3hh8 n ASP 280 Ca 0.00 -1.61 -0.15 0.00 0.71 0.00 0.00 54.79 53.75 3hh8 n ASP 280 Cb 0.00 -0.02 -0.08 0.00 -0.02 0.00 0.00 41.12 41.00 3hh8 n ASP 280 CO 0.00 0.00 0.00 -0.55 -0.39 0.00 0.00 177.20 176.26 3hh8 s SER 281 N -1.94 -0.36 0.96 -2.24 0.15 -1.26 -4.64 113.70 104.38 3hh8 s SER 281 Ca 0.36 0.36 -0.13 0.00 0.70 0.00 0.00 55.95 57.24 3hh8 s SER 281 Cb 0.20 0.45 0.17 0.00 -1.71 0.00 0.00 66.02 65.13 3hh8 s SER 281 CO 0.32 -0.46 1.13 0.27 1.20 0.00 0.00 173.24 175.70 3hh8 s ILE 282 N -1.10 1.98 0.68 6.45 -4.36 -1.26 -4.73 121.20 118.86 3hh8 s ILE 282 Ca -0.11 0.00 -0.12 0.00 -0.26 0.00 0.00 60.65 60.16 3hh8 s ILE 282 Cb -0.04 -2.66 0.00 0.00 1.25 0.00 0.00 42.46 41.02 3hh8 s ILE 282 CO 0.05 0.00 1.06 0.00 0.24 0.00 0.00 174.94 176.30 3hh8 s ALA 283 N -3.18 2.65 0.58 2.27 0.00 -0.26 -4.35 121.76 119.47 3hh8 s ALA 283 Ca 0.65 0.17 -0.20 0.00 0.00 0.00 0.00 51.96 52.58 3hh8 s ALA 283 Cb -0.15 -3.20 -0.04 0.00 0.00 0.00 0.00 23.12 19.73 3hh8 s ALA 283 CO 0.55 -1.19 1.32 0.36 0.00 0.00 0.00 175.76 176.79 3hh8 n LYS 284 N -2.93 1.47 -1.71 0.00 2.85 -1.26 -4.36 118.16 112.22 3hh8 n LYS 284 Ca 0.08 0.55 -0.43 0.00 -1.05 0.00 0.00 58.31 57.46 3hh8 n LYS 284 Cb 0.53 -2.54 -0.02 0.00 -0.65 0.00 0.00 35.03 32.36 3hh8 n LYS 284 CO 0.00 0.00 0.00 1.17 -0.05 0.00 0.00 177.40 178.52 3hh8 n LYS 285 N -1.28 2.36 0.00 -1.58 4.81 -1.26 -1.45 118.16 119.75 3hh8 n LYS 285 Ca 0.12 0.84 0.00 0.00 -0.87 0.00 0.00 58.31 58.40 3hh8 n LYS 285 Cb 0.46 -2.56 0.00 0.00 0.02 0.00 0.00 35.03 32.95 3hh8 n LYS 285 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3hh8 n GLY 286 N 2.16 1.87 3.94 3.14 0.00 -1.26 -5.05 105.19 109.99 3hh8 n GLY 286 Ca 0.10 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.85 3hh8 n GLY 286 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3hh8 s LYS 287 N -0.53 3.45 0.34 1.61 -0.14 -0.53 -5.06 119.74 118.88 3hh8 s LYS 287 Ca 0.00 -0.54 -0.29 0.00 -1.36 0.00 0.00 55.97 53.78 3hh8 s LYS 287 Cb 0.00 -2.96 -0.12 0.00 -1.68 0.00 0.00 37.83 33.07 3hh8 s LYS 287 CO 0.00 0.52 1.41 -2.30 -0.76 0.00 0.00 175.35 174.22 3hh8 n PRO 288 N -0.43 2.38 -0.32 -1.68 -0.02 -1.26 -2.28 135.00 131.39 3hh8 n PRO 288 Ca -0.06 0.84 0.00 0.00 -2.02 0.00 0.00 63.50 62.25 3hh8 n PRO 288 Cb 0.53 -2.50 0.00 0.00 -0.02 0.00 0.00 33.50 31.52 3hh8 n PRO 288 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3hh8 n GLY 289 N 0.96 0.84 1.45 -1.23 0.00 -1.26 -4.69 105.19 101.25 3hh8 n GLY 289 Ca 0.05 -0.03 -0.05 0.00 0.00 0.00 0.00 46.02 45.99 3hh8 n GLY 289 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3hh8 n ASP 290 N 0.05 4.66 -3.84 1.61 5.75 -0.97 -1.10 116.55 122.71 3hh8 n ASP 290 Ca 0.00 -2.48 -0.08 0.00 -0.01 0.00 0.00 54.79 52.23 3hh8 n ASP 290 Cb 0.00 -0.88 -0.02 0.00 -1.03 0.00 0.00 41.12 39.19 3hh8 n ASP 290 CO 0.00 0.00 0.00 -0.94 -0.11 0.00 0.00 177.20 176.15 3hh8 s SER 291 N 1.07 -0.27 0.11 -1.12 1.04 -1.26 -4.80 113.70 108.48 3hh8 s SER 291 Ca 0.10 -0.59 -0.20 0.00 0.48 0.00 0.00 55.95 55.74 3hh8 s SER 291 Cb 0.08 0.71 -0.08 0.00 0.10 0.00 0.00 66.02 66.83 3hh8 s SER 291 CO 0.01 -1.30 1.74 0.22 0.98 0.00 0.00 173.24 174.88 3hh8 h TYR 292 N 2.02 0.24 -0.07 5.02 3.20 -1.87 0.21 116.97 125.72 3hh8 h TYR 292 Ca -0.21 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.67 3hh8 h TYR 292 Cb 1.25 -0.08 -0.00 0.00 1.54 0.00 0.00 36.73 39.44 3hh8 h TYR 292 CO 0.41 0.18 0.04 -0.92 -1.64 0.00 0.00 178.16 176.24 3hh8 h TYR 293 N 0.22 0.08 -0.80 -3.82 3.20 -1.96 -1.77 116.97 112.12 3hh8 h TYR 293 Ca 0.07 0.00 -0.01 0.00 3.14 0.00 0.00 58.73 61.93 3hh8 h TYR 293 Cb 0.01 -0.03 -0.04 0.00 1.54 0.00 0.00 36.73 38.22 3hh8 h TYR 293 CO -0.05 0.05 0.46 0.00 -1.64 0.00 0.00 178.16 176.97 3hh8 h ALA 294 N 1.03 1.02 -0.13 1.82 0.00 -1.85 -1.00 119.26 120.14 3hh8 h ALA 294 Ca 0.03 -0.11 -0.10 0.00 0.00 0.00 0.00 54.91 54.73 3hh8 h ALA 294 Cb -0.01 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.45 3hh8 h ALA 294 CO -0.01 0.51 -0.34 0.00 0.00 0.00 0.00 179.25 179.41 3hh8 h MET 295 N 1.10 0.27 0.01 0.00 -0.00 -0.38 -0.35 114.93 115.58 3hh8 h MET 295 Ca 0.28 -0.11 -0.22 0.00 -0.00 0.00 0.00 59.70 59.65 3hh8 h MET 295 Cb 0.00 -0.01 -0.00 0.00 -0.00 0.00 0.00 31.60 31.59 3hh8 h MET 295 CO -0.05 0.59 -0.95 0.52 -0.00 0.00 0.00 176.91 177.02 3hh8 h MET 296 N 0.23 0.35 -0.38 -0.10 2.07 -0.90 -0.57 114.93 115.64 3hh8 h MET 296 Ca 0.03 -0.39 -0.04 0.00 -2.07 0.00 0.00 59.70 57.23 3hh8 h MET 296 Cb 0.72 0.11 -0.02 0.00 -1.87 0.00 0.00 31.60 30.55 3hh8 h MET 296 CO 0.05 1.08 0.07 -0.22 1.07 0.00 0.00 176.91 178.97 3hh8 h LYS 297 N 0.19 0.62 -0.08 1.72 1.63 -1.03 -0.78 116.57 118.84 3hh8 h LYS 297 Ca -0.08 -0.16 0.03 0.00 -0.85 0.00 0.00 60.65 59.60 3hh8 h LYS 297 Cb 1.59 -0.08 -0.04 0.00 -0.60 0.00 0.00 32.23 33.10 3hh8 h LYS 297 CO 0.16 0.67 -0.16 2.35 -3.45 0.00 0.00 179.45 179.02 3hh8 h TRP 298 N 0.47 -0.40 -0.33 1.91 2.91 -0.98 -0.82 115.95 118.70 3hh8 h TRP 298 Ca 0.12 0.02 0.05 0.00 1.13 0.00 0.00 58.89 60.20 3hh8 h TRP 298 Cb 0.34 0.19 -0.04 0.00 -0.51 0.00 0.00 29.16 29.14 3hh8 h TRP 298 CO 0.02 -0.23 0.06 -0.91 -1.03 0.00 0.00 178.44 176.35 3hh8 h ASN 299 N -0.22 -0.01 -0.33 2.65 2.35 -0.96 0.18 115.58 119.24 3hh8 h ASN 299 Ca 0.08 0.06 0.00 0.00 -0.55 0.00 0.00 56.30 55.89 3hh8 h ASN 299 Cb 0.33 0.08 -0.02 0.00 0.05 0.00 0.00 38.32 38.76 3hh8 h ASN 299 CO -0.21 0.03 0.21 -0.07 -1.65 0.00 0.00 177.43 175.75 3hh8 h LEU 300 N 0.17 0.38 0.13 1.61 3.38 -0.87 0.87 115.31 120.98 3hh8 h LEU 300 Ca 0.16 -0.02 -0.01 0.00 0.09 0.00 0.00 57.88 58.10 3hh8 h LEU 300 Cb 0.18 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 40.83 3hh8 h LEU 300 CO -0.21 0.29 -0.06 0.44 0.09 0.00 0.00 178.44 178.98 3hh8 h ASP 301 N 0.44 -0.15 -0.43 -0.43 3.32 -0.80 -1.82 116.42 116.55 3hh8 h ASP 301 Ca 0.12 -0.15 -0.14 0.00 0.02 0.00 0.00 57.03 56.87 3hh8 h ASP 301 Cb -0.04 0.04 -0.01 0.00 0.22 0.00 0.00 39.33 39.54 3hh8 h ASP 301 CO -0.03 0.07 -0.28 0.11 -1.72 0.00 0.00 179.24 177.39 3hh8 h LYS 302 N -0.36 0.97 -0.17 3.56 1.79 -0.53 -0.27 116.57 121.55 3hh8 h LYS 302 Ca -0.02 -0.45 -0.06 0.00 -2.18 0.00 0.00 60.65 57.94 3hh8 h LYS 302 Cb 0.29 -0.01 -0.00 0.00 -1.58 0.00 0.00 32.23 30.93 3hh8 h LYS 302 CO 0.03 1.12 -0.14 0.82 -1.08 0.00 0.00 179.45 180.20 3hh8 h ILE 303 N 0.82 1.33 -0.55 1.86 2.04 -0.89 0.83 117.51 122.95 3hh8 h ILE 303 Ca 0.09 -1.26 -0.10 0.00 1.00 0.00 0.00 64.86 64.60 3hh8 h ILE 303 Cb 0.87 1.77 -0.02 0.00 -0.74 0.00 0.00 36.82 38.70 3hh8 h ILE 303 CO 0.08 0.38 -0.04 0.77 0.00 0.00 0.00 178.15 179.34 3hh8 h SER 304 N 0.06 0.95 -0.47 1.72 4.64 -1.28 -0.92 113.55 118.24 3hh8 h SER 304 Ca 0.03 -0.27 -0.08 0.00 -0.47 0.00 0.00 61.79 61.00 3hh8 h SER 304 Cb 0.65 -0.25 -0.02 0.00 -0.31 0.00 0.00 62.40 62.47 3hh8 h SER 304 CO 0.04 1.02 -0.03 -0.33 -0.87 0.00 0.00 176.83 176.66 3hh8 h GLU 305 N 0.88 0.85 -0.33 4.77 5.08 -0.99 -2.19 114.58 122.66 3hh8 h GLU 305 Ca 0.15 -0.29 -0.06 0.00 -1.00 0.00 0.00 59.36 58.16 3hh8 h GLU 305 Cb 0.57 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.74 3hh8 h GLU 305 CO 0.03 0.92 -0.04 0.78 -1.00 0.00 0.00 179.01 179.70 3hh8 h GLY 306 N 0.70 0.66 2.00 -3.84 0.00 -0.67 -2.95 103.07 98.97 3hh8 h GLY 306 Ca 0.13 -0.52 -0.05 0.00 0.00 0.00 0.00 47.33 46.89 3hh8 h GLY 306 CO 0.03 0.48 -0.23 1.41 0.00 0.00 0.00 176.54 178.24 3hh8 h LEU 307 N 0.40 0.00 0.00 3.11 3.38 -1.16 -2.94 115.31 118.10 3hh8 h LEU 307 Ca 0.09 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.06 3hh8 h LEU 307 Cb 0.52 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.27 3hh8 h LEU 307 CO 0.03 0.23 0.00 0.00 0.09 0.00 0.00 178.44 178.78 3hh8 n ALA 308 N -2.23 2.29 0.75 1.53 0.00 -0.83 -4.58 120.51 117.44 3hh8 n ALA 308 Ca -0.00 -0.10 0.06 0.00 0.00 0.00 0.00 53.44 53.40 3hh8 n ALA 308 Cb 0.42 -1.45 0.35 0.00 0.00 0.00 0.00 19.45 18.77 3hh8 n ALA 308 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13