#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3iv8 s MET 1 N 0.00 3.12 0.07 0.00 1.00 -1.26 -4.79 119.30 117.44 3iv8 s MET 1 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 55.69 55.67 3iv8 s MET 1 Cb 0.00 -2.33 -0.04 0.00 0.00 0.00 0.00 34.83 32.46 3iv8 s MET 1 CO 0.00 -0.51 0.01 1.52 0.00 0.00 0.00 175.02 176.04 3iv8 s TYR 2 N -2.87 0.58 -0.05 -0.03 -0.85 -1.06 -4.12 117.35 108.95 3iv8 s TYR 2 Ca 0.51 -1.07 0.06 0.00 -0.52 0.00 0.00 57.07 56.05 3iv8 s TYR 2 Cb -0.10 -0.39 -0.01 0.00 0.38 0.00 0.00 41.96 41.84 3iv8 s TYR 2 CO 0.44 -0.43 -0.25 0.00 -1.52 0.00 0.00 175.55 173.79 3iv8 s ALA 3 N -3.95 2.16 0.00 9.51 0.00 -0.37 -0.58 121.76 128.54 3iv8 s ALA 3 Ca 0.11 -1.06 -0.21 0.00 0.00 0.00 0.00 51.96 50.80 3iv8 s ALA 3 Cb 0.08 -0.65 -0.05 0.00 0.00 0.00 0.00 23.12 22.49 3iv8 s ALA 3 CO -0.07 0.44 0.60 -0.51 0.00 0.00 0.00 175.76 176.22 3iv8 s LEU 4 N -0.25 4.42 0.22 0.00 1.43 0.11 -0.12 118.68 124.49 3iv8 s LEU 4 Ca -0.01 1.18 -0.07 0.00 -1.03 0.00 0.00 54.13 54.20 3iv8 s LEU 4 Cb -0.13 -2.94 -0.02 0.00 0.03 0.00 0.00 46.19 43.13 3iv8 s LEU 4 CO 0.03 0.11 0.30 -0.89 0.23 0.00 0.00 176.35 176.13 3iv8 s THR 5 N -0.23 0.00 -0.76 5.49 2.01 -0.17 -1.29 115.64 120.68 3iv8 s THR 5 Ca 0.31 -1.69 -0.07 0.00 0.31 0.00 0.00 61.69 60.55 3iv8 s THR 5 Cb -0.18 -2.33 0.01 0.00 0.01 0.00 0.00 72.50 70.01 3iv8 s THR 5 CO 0.18 -0.02 0.61 -3.20 -0.69 0.00 0.00 174.62 171.50 3iv8 n ASN 6 N -0.32 -4.96 -3.48 3.53 5.15 -1.26 -0.65 115.26 113.26 3iv8 n ASN 6 Ca -0.00 -0.83 -0.15 0.00 -0.60 0.00 0.00 54.58 53.01 3iv8 n ASN 6 Cb 0.64 -1.67 -0.04 0.00 -0.53 0.00 0.00 39.78 38.18 3iv8 n ASN 6 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3iv8 s LYS 8 N -2.39 4.27 -0.22 0.00 2.47 -1.02 -4.28 119.74 118.58 3iv8 s LYS 8 Ca -0.05 0.86 -0.08 0.00 -1.56 0.00 0.00 55.97 55.14 3iv8 s LYS 8 Cb -0.00 -3.57 -0.04 0.00 -1.46 0.00 0.00 37.83 32.76 3iv8 s LYS 8 CO -0.01 -0.27 0.08 0.42 0.16 0.00 0.00 175.35 175.72 3iv8 s ILE 9 N 1.98 4.61 -0.82 5.43 1.01 0.01 -0.01 121.20 133.40 3iv8 s ILE 9 Ca 0.35 -0.08 -0.07 0.00 0.00 0.00 0.00 60.65 60.84 3iv8 s ILE 9 Cb -0.16 -3.12 0.21 0.00 0.01 0.00 0.00 42.46 39.39 3iv8 s ILE 9 CO 0.12 0.39 0.72 -0.31 0.00 0.00 0.00 174.94 175.85 3iv8 s TYR 10 N 1.04 3.75 0.50 3.97 2.02 0.75 -0.50 117.35 128.88 3iv8 s TYR 10 Ca 0.04 -2.56 0.15 0.00 -0.37 0.00 0.00 57.07 54.33 3iv8 s TYR 10 Cb -0.14 -3.50 1.19 0.00 -0.40 0.00 0.00 41.96 39.12 3iv8 s TYR 10 CO 0.03 -0.88 2.11 1.15 -1.57 0.00 0.00 175.55 176.39 3iv8 h THR 11 N 4.61 1.03 0.00 -0.71 2.02 -1.41 -3.38 112.91 115.07 3iv8 h THR 11 Ca 0.09 -0.15 0.00 0.00 0.77 0.00 0.00 66.41 67.12 3iv8 h THR 11 Cb 0.94 1.05 0.00 0.00 -1.74 0.00 0.00 68.15 68.40 3iv8 h THR 11 CO 0.80 0.04 0.00 0.61 0.37 0.00 0.00 175.52 177.34 3iv8 n GLY 12 N -1.42 3.10 0.04 2.16 0.00 -1.26 -0.32 105.19 107.48 3iv8 n GLY 12 Ca -0.03 -1.00 -0.01 0.00 0.00 0.00 0.00 46.02 44.98 3iv8 n GLY 12 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3iv8 n ASN 13 N 0.55 2.26 -3.85 1.61 3.02 -1.26 -5.02 115.26 112.57 3iv8 n ASN 13 Ca 0.00 0.00 -0.11 0.00 -0.03 0.00 0.00 54.58 54.44 3iv8 n ASN 13 Cb 0.00 1.05 -0.09 0.00 -0.61 0.00 0.00 39.78 40.13 3iv8 n ASN 13 CO 0.00 0.00 0.00 -1.81 -2.62 0.00 0.00 177.26 172.83 3iv8 s ASP 14 N -4.01 0.01 -0.30 6.41 1.11 -1.26 -5.12 116.67 113.51 3iv8 s ASP 14 Ca -0.05 -0.25 -0.09 0.00 0.18 0.00 0.00 52.55 52.33 3iv8 s ASP 14 Cb 0.05 0.25 -0.01 0.00 1.07 0.00 0.00 42.92 44.28 3iv8 s ASP 14 CO 0.47 -0.46 0.14 -0.69 1.18 0.00 0.00 175.17 175.80 3iv8 s VAL 15 N -1.92 4.56 -0.07 -1.27 1.01 -1.26 -1.17 120.40 120.28 3iv8 s VAL 15 Ca -0.10 -0.35 0.04 0.00 0.00 0.00 0.00 61.98 61.57 3iv8 s VAL 15 Cb -0.04 -3.28 -0.01 0.00 0.00 0.00 0.00 36.38 33.04 3iv8 s VAL 15 CO -0.01 0.13 -0.20 -0.76 0.00 0.00 0.00 175.10 174.26 3iv8 s LEU 16 N 1.62 2.34 0.11 3.92 1.43 0.35 -4.94 118.68 123.50 3iv8 s LEU 16 Ca 0.05 -0.41 0.08 0.00 -1.03 0.00 0.00 54.13 52.82 3iv8 s LEU 16 Cb -0.17 -1.46 -0.04 0.00 0.03 0.00 0.00 46.19 44.55 3iv8 s LEU 16 CO 0.06 0.25 -0.13 -0.69 0.23 0.00 0.00 176.35 176.07 3iv8 s VAL 17 N -0.17 3.18 -2.00 -1.59 1.01 -1.26 -0.81 120.40 118.76 3iv8 s VAL 17 Ca -0.02 -1.35 0.00 0.00 0.00 0.00 0.00 61.98 60.61 3iv8 s VAL 17 Cb -0.14 -2.48 0.00 0.00 0.00 0.00 0.00 36.38 33.76 3iv8 s VAL 17 CO 0.04 0.11 0.00 0.29 0.00 0.00 0.00 175.10 175.54 3iv8 n LYS 18 N 0.75 -1.53 -3.86 2.72 4.01 -1.26 -4.96 118.16 114.03 3iv8 n LYS 18 Ca -0.14 1.13 -0.24 0.00 -0.51 0.00 0.00 58.31 58.54 3iv8 n LYS 18 Cb 0.52 -5.62 -0.03 0.00 -0.51 0.00 0.00 35.03 29.39 3iv8 n LYS 18 CO 0.00 0.00 0.00 -1.01 -1.11 0.00 0.00 177.40 175.28 3iv8 s HIS 19 N -2.88 2.21 0.04 2.13 3.76 -1.26 -0.96 115.29 118.33 3iv8 s HIS 19 Ca 0.00 -0.67 -0.01 0.00 -0.15 0.00 0.00 55.06 54.23 3iv8 s HIS 19 Cb 0.00 -2.00 -0.03 0.00 1.11 0.00 0.00 32.58 31.66 3iv8 s HIS 19 CO 0.00 -0.19 -0.03 0.00 -0.85 0.00 0.00 174.74 173.67 3iv8 s ALA 20 N -2.64 0.36 -0.16 -1.40 0.00 -0.05 -4.48 121.76 113.39 3iv8 s ALA 20 Ca 0.40 -0.97 0.02 0.00 0.00 0.00 0.00 51.96 51.41 3iv8 s ALA 20 Cb -0.01 0.22 0.01 0.00 0.00 0.00 0.00 23.12 23.35 3iv8 s ALA 20 CO 0.23 -0.29 -0.20 0.08 0.00 0.00 0.00 175.76 175.58 3iv8 s VAL 21 N -2.97 2.15 -0.21 0.00 1.01 -0.41 -1.95 120.40 118.01 3iv8 s VAL 21 Ca -0.02 -0.93 -0.10 0.00 0.00 0.00 0.00 61.98 60.93 3iv8 s VAL 21 Cb 0.01 -1.88 -0.05 0.00 0.00 0.00 0.00 36.38 34.46 3iv8 s VAL 21 CO -0.07 0.54 0.14 -0.63 0.00 0.00 0.00 175.10 175.09 3iv8 s ILE 22 N 0.98 5.39 -0.17 2.22 1.01 0.47 0.08 121.20 131.18 3iv8 s ILE 22 Ca -0.03 0.20 -0.03 0.00 0.00 0.00 0.00 60.65 60.78 3iv8 s ILE 22 Cb -0.15 -3.48 -0.02 0.00 0.01 0.00 0.00 42.46 38.82 3iv8 s ILE 22 CO -0.05 0.41 -0.04 -0.63 0.00 0.00 0.00 174.94 174.62 3iv8 s ILE 23 N 0.58 3.71 -0.29 2.92 1.09 0.25 0.92 121.20 130.38 3iv8 s ILE 23 Ca 0.08 -0.41 0.03 0.00 -1.10 0.00 0.00 60.65 59.24 3iv8 s ILE 23 Cb -0.12 -2.64 0.08 0.00 -1.06 0.00 0.00 42.46 38.72 3iv8 s ILE 23 CO 0.00 0.47 -0.01 0.21 -0.10 0.00 0.00 174.94 175.51 3iv8 s ASN 24 N 0.64 4.40 1.58 3.58 2.47 -0.14 -2.56 114.94 124.90 3iv8 s ASN 24 Ca -0.03 -1.68 0.00 0.00 0.42 0.00 0.00 52.86 51.58 3iv8 s ASN 24 Cb -0.15 -1.43 0.00 0.00 -1.45 0.00 0.00 41.25 38.22 3iv8 s ASN 24 CO 0.02 -0.30 0.00 0.61 -3.72 0.00 0.00 177.10 173.72 3iv8 n GLY 25 N 4.45 3.56 0.54 1.21 0.00 -1.26 -0.95 105.19 112.74 3iv8 n GLY 25 Ca -0.05 0.23 0.12 0.00 0.00 0.00 0.00 46.02 46.33 3iv8 n GLY 25 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3iv8 n ASP 26 N 7.95 1.66 -4.57 1.61 5.68 -1.26 -3.79 116.55 123.83 3iv8 n ASP 26 Ca 0.00 -1.61 -0.24 0.00 -0.50 0.00 0.00 54.79 52.44 3iv8 n ASP 26 Cb 0.00 -0.05 -0.09 0.00 -1.14 0.00 0.00 41.12 39.84 3iv8 n ASP 26 CO 0.00 0.00 0.00 -0.54 -1.33 0.00 0.00 177.20 175.33 3iv8 s LYS 27 N -1.90 1.96 -0.42 0.11 1.02 -0.12 -1.59 119.74 118.81 3iv8 s LYS 27 Ca 0.35 -1.73 -0.24 0.00 0.02 0.00 0.00 55.97 54.38 3iv8 s LYS 27 Cb 0.20 -1.89 0.02 0.00 -0.52 0.00 0.00 37.83 35.64 3iv8 s LYS 27 CO 0.30 0.23 0.84 0.42 -0.92 0.00 0.00 175.35 176.22 3iv8 s ILE 28 N -2.50 4.62 -0.02 2.17 1.01 -0.12 -0.97 121.20 125.39 3iv8 s ILE 28 Ca 0.32 0.73 -0.25 0.00 0.00 0.00 0.00 60.65 61.46 3iv8 s ILE 28 Cb -0.02 -4.32 -0.19 0.00 0.01 0.00 0.00 42.46 37.94 3iv8 s ILE 28 CO 0.18 -0.64 1.21 -0.33 0.00 0.00 0.00 174.94 175.36 3iv8 h GLU 29 N 8.80 -0.07 -2.36 2.79 4.39 0.20 -0.75 114.58 127.59 3iv8 h GLU 29 Ca -0.24 0.00 0.04 0.00 0.34 0.00 0.00 59.36 59.50 3iv8 h GLU 29 Cb 1.08 0.02 -0.16 0.00 -0.10 0.00 0.00 28.75 29.59 3iv8 h GLU 29 CO 0.96 0.40 0.37 0.00 -1.16 0.00 0.00 179.01 179.58 3iv8 s ALA 30 N -4.23 -1.76 -0.19 3.43 0.00 -1.13 -4.65 121.76 113.23 3iv8 s ALA 30 Ca -0.15 0.98 0.01 0.00 0.00 0.00 0.00 51.96 52.80 3iv8 s ALA 30 Cb 0.01 0.34 0.03 0.00 0.00 0.00 0.00 23.12 23.51 3iv8 s ALA 30 CO 0.64 -0.61 -0.15 0.08 0.00 0.00 0.00 175.76 175.72 3iv8 s VAL 31 N -2.75 1.85 0.05 0.00 1.01 -1.26 -0.40 120.40 118.91 3iv8 s VAL 31 Ca 0.00 -1.00 -0.10 0.00 0.00 0.00 0.00 61.98 60.89 3iv8 s VAL 31 Cb -0.01 -1.80 0.01 0.00 0.00 0.00 0.00 36.38 34.58 3iv8 s VAL 31 CO -0.06 0.33 0.22 0.00 0.00 0.00 0.00 175.10 175.59 3iv8 n PRO 33 N 0.57 1.53 -0.31 0.00 -0.02 -1.26 -0.87 135.00 134.64 3iv8 n PRO 33 Ca -0.18 0.54 0.20 0.00 -2.02 0.00 0.00 63.50 62.03 3iv8 n PRO 33 Cb 0.59 -1.97 0.47 0.00 -0.02 0.00 0.00 33.50 32.57 3iv8 n PRO 33 CO 0.00 0.00 0.00 0.97 1.98 0.00 0.00 175.50 178.45 3iv8 h ILE 34 N 2.20 0.60 0.00 4.25 -0.00 -1.30 0.69 117.51 123.94 3iv8 h ILE 34 Ca -0.41 -0.16 0.00 0.00 -0.00 0.00 0.00 64.86 64.28 3iv8 h ILE 34 Cb 1.33 0.08 0.00 0.00 -0.00 0.00 0.00 36.82 38.23 3iv8 h ILE 34 CO 0.62 0.09 0.00 -0.62 -0.00 0.00 0.00 178.15 178.24 3iv8 n GLU 35 N -4.63 0.16 -0.00 2.19 4.71 -1.26 -3.01 120.64 118.79 3iv8 n GLU 35 Ca 0.24 0.16 0.08 0.00 -0.01 0.00 0.00 57.16 57.62 3iv8 n GLU 35 Cb 0.77 -1.50 0.07 0.00 -1.01 0.00 0.00 31.44 29.77 3iv8 n GLU 35 CO 0.00 0.00 0.00 0.43 0.09 0.00 0.00 177.13 177.65 3iv8 n SER 36 N -1.22 2.30 -4.79 1.62 7.64 0.23 -4.95 113.62 114.46 3iv8 n SER 36 Ca 0.05 -1.65 -0.35 0.00 1.01 0.00 0.00 58.87 57.93 3iv8 n SER 36 Cb 0.06 -0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 63.22 3iv8 n SER 36 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 3iv8 s LEU 37 N -1.29 3.90 1.43 -3.43 1.43 -1.16 -5.00 118.68 114.56 3iv8 s LEU 37 Ca 0.18 1.97 -0.23 0.00 -1.03 0.00 0.00 54.13 55.02 3iv8 s LEU 37 Cb 0.13 -4.48 0.37 0.00 0.03 0.00 0.00 46.19 42.23 3iv8 s LEU 37 CO 0.19 -0.75 0.93 -2.84 0.23 0.00 0.00 176.35 174.12 3iv8 s PRO 38 N -3.08 -2.97 -0.17 1.29 0.02 -1.26 -5.02 135.00 123.80 3iv8 s PRO 38 Ca 0.66 0.09 -0.13 0.00 0.02 0.00 0.00 61.00 61.64 3iv8 s PRO 38 Cb -0.18 -1.38 -0.22 0.00 0.02 0.00 0.00 34.50 32.75 3iv8 s PRO 38 CO 0.22 -4.89 0.23 0.43 -0.33 0.00 0.00 177.00 172.65 3iv8 n SER 39 N -5.64 2.00 0.01 2.53 7.64 -1.26 -4.36 113.62 114.54 3iv8 n SER 39 Ca 0.13 0.29 0.07 0.00 1.01 0.00 0.00 58.87 60.37 3iv8 n SER 39 Cb 0.60 -0.88 0.32 0.00 -1.01 0.00 0.00 64.21 63.23 3iv8 n SER 39 CO 0.00 0.00 0.00 -1.84 -3.01 0.00 0.00 175.04 170.19 3iv8 n GLU 40 N -3.92 0.01 -1.99 1.43 0.00 -1.26 -4.72 120.64 110.19 3iv8 n GLU 40 Ca -0.34 0.26 -0.42 0.00 0.00 0.00 0.00 57.16 56.66 3iv8 n GLU 40 Cb 0.88 -1.52 -0.03 0.00 0.00 0.00 0.00 31.44 30.77 3iv8 n GLU 40 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 177.13 178.54 3iv8 s MET 41 N -3.02 4.21 0.43 3.44 1.75 -1.26 -4.97 119.30 119.88 3iv8 s MET 41 Ca 0.07 2.24 -0.25 0.00 -1.25 0.00 0.00 55.69 56.51 3iv8 s MET 41 Cb 0.09 -3.70 -0.08 0.00 2.84 0.00 0.00 34.83 33.99 3iv8 s MET 41 CO 0.27 -0.74 1.24 -0.80 -0.65 0.00 0.00 175.02 174.34 3iv8 s ASN 42 N 2.58 6.24 0.21 1.11 0.02 -1.26 -4.89 114.94 118.94 3iv8 s ASN 42 Ca 0.72 2.50 0.09 0.00 -1.02 0.00 0.00 52.86 55.15 3iv8 s ASN 42 Cb -0.37 -2.62 -0.04 0.00 0.02 0.00 0.00 41.25 38.23 3iv8 s ASN 42 CO 0.31 -0.89 -0.07 -0.69 0.02 0.00 0.00 177.10 175.79 3iv8 s VAL 43 N -1.37 3.27 -0.19 1.60 1.01 -1.26 -1.24 120.40 122.23 3iv8 s VAL 43 Ca 0.60 -1.75 -0.01 0.00 0.00 0.00 0.00 61.98 60.81 3iv8 s VAL 43 Cb -0.34 -2.67 0.05 0.00 0.00 0.00 0.00 36.38 33.43 3iv8 s VAL 43 CO 0.43 -0.20 -0.00 -0.69 0.00 0.00 0.00 175.10 174.63 3iv8 s VAL 44 N -1.92 0.84 -0.30 2.92 1.01 0.82 -4.82 120.40 118.96 3iv8 s VAL 44 Ca 0.27 -0.67 -0.26 0.00 0.00 0.00 0.00 61.98 61.33 3iv8 s VAL 44 Cb -0.08 -1.21 0.01 0.00 0.00 0.00 0.00 36.38 35.10 3iv8 s VAL 44 CO 0.17 -0.09 0.90 -0.62 0.00 0.00 0.00 175.10 175.46 3iv8 s ASP 45 N 1.72 6.80 -0.23 3.32 -1.08 -1.26 -1.00 116.67 124.94 3iv8 s ASP 45 Ca -0.01 0.88 0.07 0.00 -0.52 0.00 0.00 52.55 52.97 3iv8 s ASP 45 Cb -0.17 -2.46 0.53 0.00 -1.46 0.00 0.00 42.92 39.36 3iv8 s ASP 45 CO -0.07 -0.68 1.49 0.18 0.52 0.00 0.00 175.17 176.60 3iv8 n LEU 46 N 6.38 4.87 -3.14 -1.34 4.77 0.17 -4.89 117.00 123.82 3iv8 n LEU 46 Ca 0.07 -2.52 -0.21 0.00 -0.03 0.00 0.00 56.01 53.32 3iv8 n LEU 46 Cb 0.48 -0.68 -0.04 0.00 -2.33 0.00 0.00 43.42 40.85 3iv8 n LEU 46 CO 0.53 0.67 -0.08 -3.20 -1.33 0.00 0.00 177.39 173.98 3iv8 n ASN 47 N -0.02 -1.12 0.00 -1.43 5.15 -1.23 -1.19 115.26 115.41 3iv8 n ASN 47 Ca 0.29 -0.51 0.00 0.00 -0.60 0.00 0.00 54.58 53.76 3iv8 n ASN 47 Cb 1.09 -1.01 0.00 0.00 -0.53 0.00 0.00 39.78 39.33 3iv8 n ASN 47 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 3iv8 n GLY 48 N -0.73 0.67 3.61 8.20 0.00 0.12 -5.02 105.19 112.04 3iv8 n GLY 48 Ca 0.06 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.79 3iv8 n GLY 48 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3iv8 s ALA 49 N -2.41 0.62 0.23 4.61 0.00 -0.34 -4.46 121.76 120.01 3iv8 s ALA 49 Ca 0.00 -0.66 -0.14 0.00 0.00 0.00 0.00 51.96 51.16 3iv8 s ALA 49 Cb 0.00 -3.00 -0.08 0.00 0.00 0.00 0.00 23.12 20.04 3iv8 s ALA 49 CO 0.00 -3.34 0.63 -0.80 0.00 0.00 0.00 175.76 172.25 3iv8 s ASN 50 N -3.61 6.79 -0.05 0.00 0.01 0.31 -2.43 114.94 115.97 3iv8 s ASN 50 Ca 0.68 1.15 0.04 0.00 -0.71 0.00 0.00 52.86 54.02 3iv8 s ASN 50 Cb -0.15 -2.32 0.00 0.00 0.41 0.00 0.00 41.25 39.20 3iv8 s ASN 50 CO 0.57 -0.05 -0.15 -0.22 -1.51 0.00 0.00 177.10 175.74 3iv8 s LEU 51 N -2.50 1.85 0.22 0.60 2.96 0.98 -1.60 118.68 121.19 3iv8 s LEU 51 Ca 0.46 -0.33 -0.09 0.00 -0.22 0.00 0.00 54.13 53.95 3iv8 s LEU 51 Cb -0.13 -0.91 -0.01 0.00 0.50 0.00 0.00 46.19 45.64 3iv8 s LEU 51 CO 0.20 0.12 0.36 -0.94 -1.32 0.00 0.00 176.35 174.76 3iv8 s SER 52 N 0.19 -0.01 0.69 3.68 1.04 -0.48 -0.18 113.70 118.62 3iv8 s SER 52 Ca -0.06 -1.02 -0.17 0.00 0.48 0.00 0.00 55.95 55.18 3iv8 s SER 52 Cb -0.12 0.51 -0.00 0.00 0.10 0.00 0.00 66.02 66.50 3iv8 s SER 52 CO 0.03 -1.02 1.05 -2.65 0.98 0.00 0.00 173.24 171.63 3iv8 n PRO 53 N -0.32 0.70 -1.39 4.02 -0.02 -1.26 -0.37 135.00 136.35 3iv8 n PRO 53 Ca -0.02 0.29 -0.33 0.00 -2.02 0.00 0.00 63.50 61.43 3iv8 n PRO 53 Cb 0.63 -2.29 0.09 0.00 -0.02 0.00 0.00 33.50 31.91 3iv8 n PRO 53 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 3iv8 s GLY 54 N -1.53 2.06 0.25 -1.23 0.00 0.85 -4.04 107.32 103.67 3iv8 s GLY 54 Ca 0.76 0.61 -0.23 0.00 0.00 0.00 0.00 44.72 45.87 3iv8 s GLY 54 CO 0.47 0.99 0.81 -1.36 0.00 0.00 0.00 173.10 174.01 3iv8 s PHE 55 N -2.37 3.71 -0.23 1.90 0.08 -0.39 -4.74 117.98 115.93 3iv8 s PHE 55 Ca 0.68 1.57 -0.03 0.00 0.12 0.00 0.00 56.93 59.27 3iv8 s PHE 55 Cb -0.23 -2.75 0.01 0.00 -0.57 0.00 0.00 43.02 39.48 3iv8 s PHE 55 CO 0.48 0.33 -0.05 0.42 -0.10 0.00 0.00 175.22 176.29 3iv8 s ILE 56 N -1.49 3.16 -0.32 0.64 1.01 -0.51 -1.66 121.20 122.04 3iv8 s ILE 56 Ca 0.44 -0.71 -0.07 0.00 0.00 0.00 0.00 60.65 60.31 3iv8 s ILE 56 Cb -0.18 -2.50 0.02 0.00 0.01 0.00 0.00 42.46 39.80 3iv8 s ILE 56 CO 0.23 0.34 0.11 -0.62 0.00 0.00 0.00 174.94 174.99 3iv8 s ASP 57 N 1.42 5.27 0.00 3.58 2.15 -0.68 -4.77 116.67 123.65 3iv8 s ASP 57 Ca 0.04 -0.83 0.25 0.00 0.43 0.00 0.00 52.55 52.45 3iv8 s ASP 57 Cb -0.15 -1.90 0.54 0.00 -0.30 0.00 0.00 42.92 41.10 3iv8 s ASP 57 CO -0.04 -0.25 1.43 0.18 -0.17 0.00 0.00 175.17 176.33 3iv8 n LEU 58 N 4.88 1.57 -3.48 -1.34 4.77 -1.26 -0.72 117.00 121.41 3iv8 n LEU 58 Ca -0.14 -0.51 -0.26 0.00 -0.03 0.00 0.00 56.01 55.07 3iv8 n LEU 58 Cb 0.47 -0.06 -0.13 0.00 -2.33 0.00 0.00 43.42 41.38 3iv8 n LEU 58 CO 0.32 0.28 -0.29 -1.58 -1.33 0.00 0.00 177.39 174.79 3iv8 s GLN 59 N -2.37 0.38 -0.14 3.23 0.74 -1.26 -4.67 119.66 115.57 3iv8 s GLN 59 Ca 0.25 -0.80 -0.01 0.00 0.05 0.00 0.00 55.36 54.86 3iv8 s GLN 59 Cb 0.19 -1.10 0.04 0.00 1.10 0.00 0.00 33.01 33.24 3iv8 s GLN 59 CO 0.48 -1.11 -0.04 -1.17 -0.55 0.00 0.00 175.29 172.91 3iv8 s LEU 60 N 1.70 1.27 -0.10 3.68 2.96 -1.20 -0.17 118.68 126.82 3iv8 s LEU 60 Ca 0.13 -0.49 -0.02 0.00 -0.22 0.00 0.00 54.13 53.53 3iv8 s LEU 60 Cb -0.18 -0.77 -0.25 0.00 0.50 0.00 0.00 46.19 45.49 3iv8 s LEU 60 CO -0.20 -0.19 0.44 0.59 -1.32 0.00 0.00 176.35 175.68 3iv8 n ASN 61 N 4.96 1.81 -3.66 3.68 3.02 -0.79 -1.03 115.26 123.25 3iv8 n ASN 61 Ca -0.11 0.26 0.01 0.00 -0.03 0.00 0.00 54.58 54.71 3iv8 n ASN 61 Cb 0.49 -0.66 0.01 0.00 -0.61 0.00 0.00 39.78 39.01 3iv8 n ASN 61 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 3iv8 s GLY 62 N -5.46 -0.06 0.00 7.41 0.00 -1.16 -0.91 107.32 107.13 3iv8 s GLY 62 Ca -0.18 -0.05 0.00 0.00 0.00 0.00 0.00 44.72 44.49 3iv8 s GLY 62 CO 0.78 4.22 0.00 0.00 0.00 0.00 0.00 173.10 178.11 3iv8 n GLY 64 N -0.31 -0.05 1.94 0.00 0.00 0.16 -2.31 105.19 104.61 3iv8 n GLY 64 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 3iv8 n GLY 64 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3iv8 n GLY 65 N -0.82 0.98 3.77 -0.02 0.00 0.55 -4.88 105.19 104.77 3iv8 n GLY 65 Ca -0.21 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.56 3iv8 n GLY 65 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3iv8 s VAL 66 N -3.20 2.16 -0.08 1.61 -7.23 -0.98 -4.94 120.40 107.73 3iv8 s VAL 66 Ca 0.00 -1.68 -0.03 0.00 -1.81 0.00 0.00 61.98 58.46 3iv8 s VAL 66 Cb 0.00 -2.84 0.04 0.00 0.56 0.00 0.00 36.38 34.14 3iv8 s VAL 66 CO 0.00 0.00 0.07 -0.04 -0.31 0.00 0.00 175.10 174.82 3iv8 s MET 67 N -3.96 -0.03 0.32 4.82 1.00 -1.26 -2.59 119.30 117.60 3iv8 s MET 67 Ca 0.38 0.23 0.08 0.00 0.00 0.00 0.00 55.69 56.38 3iv8 s MET 67 Cb 0.03 -0.95 0.91 0.00 0.00 0.00 0.00 34.83 34.82 3iv8 s MET 67 CO 0.21 -0.44 1.62 0.35 0.00 0.00 0.00 175.02 176.76 3iv8 h PHE 68 N 8.43 0.45 0.00 -0.03 3.57 -1.31 0.75 116.94 128.81 3iv8 h PHE 68 Ca -0.13 0.05 -0.00 0.00 3.53 0.00 0.00 57.97 61.42 3iv8 h PHE 68 Cb 1.13 -0.04 -0.00 0.00 2.79 0.00 0.00 35.95 39.83 3iv8 h PHE 68 CO 0.37 -0.31 -0.01 -0.91 -2.23 0.00 0.00 178.31 175.22 3iv8 h ASN 69 N 0.14 0.00 0.00 0.41 4.21 -1.84 -3.22 115.58 115.28 3iv8 h ASN 69 Ca 0.65 0.00 0.00 0.00 1.21 0.00 0.00 56.30 58.16 3iv8 h ASN 69 Cb 1.46 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 38.66 3iv8 h ASN 69 CO -0.73 0.01 -0.03 0.44 -1.29 0.00 0.00 177.43 175.83 3iv8 h ASP 70 N 0.00 0.00 -3.74 5.81 5.19 -1.24 -3.42 116.42 119.01 3iv8 h ASP 70 Ca -0.00 0.00 -0.78 0.00 -0.62 0.00 0.00 57.03 55.63 3iv8 h ASP 70 Cb 0.03 0.00 -0.26 0.00 0.18 0.00 0.00 39.33 39.28 3iv8 h ASP 70 CO 0.00 0.24 0.02 -0.70 -3.12 0.00 0.00 179.24 175.68 3iv8 s GLU 71 N -1.29 3.44 -1.31 3.56 2.56 -1.21 -4.97 118.70 119.48 3iv8 s GLU 71 Ca -0.01 -2.36 -0.14 0.00 0.00 0.00 0.00 54.97 52.46 3iv8 s GLU 71 Cb 0.00 -4.36 0.11 0.00 2.00 0.00 0.00 34.13 31.88 3iv8 s GLU 71 CO 0.01 -1.29 1.82 -0.89 -0.56 0.00 0.00 175.26 174.36 3iv8 n ILE 72 N 4.12 4.01 -4.17 -3.70 5.41 -1.22 -4.60 119.36 119.20 3iv8 n ILE 72 Ca 0.09 -4.07 -0.11 0.00 1.00 0.00 0.00 62.75 59.67 3iv8 n ILE 72 Cb 0.45 -2.44 -0.10 0.00 -0.71 0.00 0.00 39.64 36.84 3iv8 n ILE 72 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 176.55 176.97 3iv8 s THR 73 N 2.32 0.05 0.16 1.39 -4.23 -1.26 -4.67 115.64 109.40 3iv8 s THR 73 Ca 0.46 -1.95 -0.16 0.00 -1.18 0.00 0.00 61.69 58.86 3iv8 s THR 73 Cb 0.06 -2.29 0.05 0.00 1.34 0.00 0.00 72.50 71.66 3iv8 s THR 73 CO -0.00 -0.21 1.73 0.00 -0.54 0.00 0.00 174.62 175.60 3iv8 h ALA 74 N 2.73 0.42 0.00 3.99 0.00 -1.91 -2.57 119.26 121.92 3iv8 h ALA 74 Ca -0.35 0.07 -0.05 0.00 0.00 0.00 0.00 54.91 54.58 3iv8 h ALA 74 Cb 1.23 0.09 -0.01 0.00 0.00 0.00 0.00 17.79 19.10 3iv8 h ALA 74 CO 0.55 -0.32 -0.23 1.05 0.00 0.00 0.00 179.25 180.31 3iv8 h GLU 75 N 0.21 0.00 -0.53 0.00 4.11 -1.94 -0.76 114.58 115.67 3iv8 h GLU 75 Ca 0.18 0.00 -0.06 0.00 0.07 0.00 0.00 59.36 59.55 3iv8 h GLU 75 Cb 0.21 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.44 3iv8 h GLU 75 CO -0.24 0.23 0.09 1.15 0.07 0.00 0.00 179.01 180.31 3iv8 h THR 76 N 0.00 1.25 -0.77 -1.06 2.02 -1.72 -0.17 112.91 112.47 3iv8 h THR 76 Ca -0.00 -0.95 -0.02 0.00 0.77 0.00 0.00 66.41 66.21 3iv8 h THR 76 Cb 0.51 0.84 -0.04 0.00 -1.74 0.00 0.00 68.15 67.72 3iv8 h THR 76 CO 0.03 0.34 0.40 0.40 0.37 0.00 0.00 175.52 177.07 3iv8 h ILE 77 N 0.77 1.24 -0.12 3.11 2.04 -0.97 -1.68 117.51 121.88 3iv8 h ILE 77 Ca 0.16 -0.61 -0.00 0.00 1.00 0.00 0.00 64.86 65.41 3iv8 h ILE 77 Cb 0.41 0.24 -0.01 0.00 -0.74 0.00 0.00 36.82 36.72 3iv8 h ILE 77 CO 0.01 0.27 0.07 -0.78 0.00 0.00 0.00 178.15 177.72 3iv8 h ASP 78 N 1.07 0.15 -0.96 1.72 3.58 -0.75 -0.52 116.42 120.71 3iv8 h ASP 78 Ca 0.27 -0.08 0.13 0.00 0.42 0.00 0.00 57.03 57.76 3iv8 h ASP 78 Cb 0.06 -0.04 -0.08 0.00 1.72 0.00 0.00 39.33 40.99 3iv8 h ASP 78 CO -0.04 0.19 0.61 0.74 -2.88 0.00 0.00 179.24 177.86 3iv8 h THR 79 N 0.11 0.90 0.09 2.25 2.02 -0.68 -2.26 112.91 115.33 3iv8 h THR 79 Ca 0.04 -0.31 -0.00 0.00 0.77 0.00 0.00 66.41 66.91 3iv8 h THR 79 Cb 0.07 -0.08 0.00 0.00 -1.74 0.00 0.00 68.15 66.40 3iv8 h THR 79 CO -0.01 0.16 -0.04 0.24 0.37 0.00 0.00 175.52 176.25 3iv8 h MET 80 N 0.90 -0.11 -0.97 6.66 2.86 -0.44 -2.63 114.93 121.20 3iv8 h MET 80 Ca 0.48 0.01 0.23 0.00 -2.06 0.00 0.00 59.70 58.35 3iv8 h MET 80 Cb 0.55 0.03 -0.12 0.00 0.06 0.00 0.00 31.60 32.11 3iv8 h MET 80 CO -0.24 0.22 0.53 1.25 1.06 0.00 0.00 176.91 179.73 3iv8 h HIS 81 N -0.45 0.91 -0.12 -0.22 6.17 -0.73 -0.24 115.15 120.48 3iv8 h HIS 81 Ca -0.01 0.04 -0.21 0.00 0.71 0.00 0.00 60.37 60.89 3iv8 h HIS 81 Cb 0.38 -0.25 0.00 0.00 2.52 0.00 0.00 27.41 30.06 3iv8 h HIS 81 CO 0.04 0.07 -0.78 0.87 0.71 0.00 0.00 177.93 178.83 3iv8 h LYS 82 N 0.56 0.64 -0.20 5.26 1.57 -1.35 -2.34 116.57 120.71 3iv8 h LYS 82 Ca 0.60 -0.53 -0.02 0.00 -1.87 0.00 0.00 60.65 58.84 3iv8 h LYS 82 Cb 1.10 0.11 -0.01 0.00 0.08 0.00 0.00 32.23 33.52 3iv8 h LYS 82 CO -0.47 1.15 0.06 0.00 -0.57 0.00 0.00 179.45 179.62 3iv8 h ALA 83 N 0.70 0.26 -0.76 3.86 0.00 -1.04 -3.09 119.26 119.19 3iv8 h ALA 83 Ca -0.05 -0.14 0.17 0.00 0.00 0.00 0.00 54.91 54.90 3iv8 h ALA 83 Cb 1.39 -0.08 -0.12 0.00 0.00 0.00 0.00 17.79 18.98 3iv8 h ALA 83 CO 0.15 -0.11 0.11 -0.91 0.00 0.00 0.00 179.25 178.48 3iv8 h ASN 84 N 0.14 -0.15 -0.99 0.00 -0.26 -1.02 -0.58 115.58 112.73 3iv8 h ASN 84 Ca 0.06 0.17 0.23 0.00 -0.56 0.00 0.00 56.30 56.21 3iv8 h ASN 84 Cb 0.24 0.27 -0.09 0.00 -1.06 0.00 0.00 38.32 37.68 3iv8 h ASN 84 CO -0.00 -0.12 0.63 -0.07 -1.06 0.00 0.00 177.43 176.82 3iv8 h LEU 85 N 0.18 0.51 -2.36 1.61 4.07 -1.33 0.69 115.31 118.67 3iv8 h LEU 85 Ca 0.43 0.07 0.03 0.00 0.08 0.00 0.00 57.88 58.49 3iv8 h LEU 85 Cb 0.76 -0.01 -0.00 0.00 1.08 0.00 0.00 40.66 42.49 3iv8 h LEU 85 CO -0.59 0.15 0.12 0.11 -1.08 0.00 0.00 178.44 177.15 3iv8 h LYS 86 N 0.48 0.00 -0.03 1.13 6.56 -1.17 -2.43 116.57 121.11 3iv8 h LYS 86 Ca 0.55 0.00 -0.00 0.00 -1.06 0.00 0.00 60.65 60.14 3iv8 h LYS 86 Cb 1.27 0.00 -0.00 0.00 -0.57 0.00 0.00 32.23 32.93 3iv8 h LYS 86 CO -0.28 0.00 -0.08 -1.13 -2.06 0.00 0.00 179.45 175.90 3iv8 n SER 87 N -3.73 2.38 0.00 0.86 3.41 0.17 -4.64 113.62 112.07 3iv8 n SER 87 Ca -0.01 -3.23 0.00 0.00 -0.26 0.00 0.00 58.87 55.38 3iv8 n SER 87 Cb 0.22 -0.46 0.00 0.00 -0.26 0.00 0.00 64.21 63.71 3iv8 n SER 87 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3iv8 n GLY 88 N -1.31 0.74 3.39 5.00 0.00 -0.91 -2.70 105.19 109.40 3iv8 n GLY 88 Ca 0.17 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.76 3iv8 n GLY 88 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3iv8 n THR 90 N 5.16 0.22 -4.18 0.00 -2.24 -0.66 -3.41 114.28 109.16 3iv8 n THR 90 Ca -0.12 -0.33 -0.13 0.00 -2.27 0.00 0.00 64.05 61.20 3iv8 n THR 90 Cb 0.44 0.10 -0.10 0.00 -2.10 0.00 0.00 70.33 68.67 3iv8 n THR 90 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 3iv8 s SER 91 N -4.24 1.38 0.14 3.42 0.01 -0.87 -4.39 113.70 109.14 3iv8 s SER 91 Ca 0.01 -0.92 -0.25 0.00 1.31 0.00 0.00 55.95 56.10 3iv8 s SER 91 Cb 0.14 0.04 0.07 0.00 0.21 0.00 0.00 66.02 66.47 3iv8 s SER 91 CO 0.82 -0.36 0.95 0.72 0.41 0.00 0.00 173.24 175.79 3iv8 s PHE 92 N -3.07 -0.15 -0.35 2.43 -0.12 -0.15 -1.68 117.98 114.90 3iv8 s PHE 92 Ca 0.10 -0.14 -0.05 0.00 -0.05 0.00 0.00 56.93 56.79 3iv8 s PHE 92 Cb 0.01 0.63 0.05 0.00 -0.63 0.00 0.00 43.02 43.09 3iv8 s PHE 92 CO -0.02 -0.80 0.11 -0.51 -0.05 0.00 0.00 175.22 173.95 3iv8 s LEU 93 N -2.90 4.41 0.12 -1.99 1.43 0.10 -0.92 118.68 118.93 3iv8 s LEU 93 Ca 0.12 -1.30 -0.32 0.00 -1.03 0.00 0.00 54.13 51.59 3iv8 s LEU 93 Cb -0.01 -1.84 -0.12 0.00 0.03 0.00 0.00 46.19 44.25 3iv8 s LEU 93 CO 0.01 -0.36 1.78 -2.65 0.23 0.00 0.00 176.35 175.37 3iv8 n PRO 94 N 4.76 2.63 -3.95 1.29 -0.02 -1.24 -3.27 135.00 135.20 3iv8 n PRO 94 Ca -0.11 0.96 -0.35 0.00 -2.02 0.00 0.00 63.50 61.97 3iv8 n PRO 94 Cb 0.44 -2.82 -0.13 0.00 -0.02 0.00 0.00 33.50 30.97 3iv8 n PRO 94 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 3iv8 s THR 95 N 2.32 3.84 -0.31 3.45 2.01 -0.20 0.02 115.64 126.79 3iv8 s THR 95 Ca 0.81 -0.34 -0.11 0.00 0.31 0.00 0.00 61.69 62.37 3iv8 s THR 95 Cb -0.54 -2.76 -0.02 0.00 0.01 0.00 0.00 72.50 69.19 3iv8 s THR 95 CO 0.38 0.40 0.18 -0.22 -0.69 0.00 0.00 174.62 174.68 3iv8 s LEU 96 N 1.31 4.17 0.83 4.42 1.98 -0.22 -4.53 118.68 126.63 3iv8 s LEU 96 Ca 0.04 -0.33 -0.11 0.00 -2.89 0.00 0.00 54.13 50.84 3iv8 s LEU 96 Cb -0.15 -2.07 0.13 0.00 0.66 0.00 0.00 46.19 44.76 3iv8 s LEU 96 CO 0.01 -0.16 1.17 0.27 -1.89 0.00 0.00 176.35 175.75 3iv8 s ILE 97 N 1.69 2.09 0.16 6.68 -4.36 -1.26 -1.00 121.20 125.19 3iv8 s ILE 97 Ca 0.06 -0.15 -0.32 0.00 -0.26 0.00 0.00 60.65 59.98 3iv8 s ILE 97 Cb -0.17 -2.94 -0.12 0.00 1.25 0.00 0.00 42.46 40.48 3iv8 s ILE 97 CO 0.09 0.00 1.72 0.35 0.24 0.00 0.00 174.94 177.34 3iv8 n THR 98 N -3.32 0.12 -3.06 8.37 -2.24 -1.05 -4.86 114.28 108.23 3iv8 n THR 98 Ca 0.12 -0.02 0.00 0.00 -2.27 0.00 0.00 64.05 61.87 3iv8 n THR 98 Cb 0.60 -1.90 0.00 0.00 -2.10 0.00 0.00 70.33 66.93 3iv8 n THR 98 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 3iv8 n SER 99 N 4.37 0.00 -4.56 3.42 3.41 -1.26 -4.70 113.62 114.29 3iv8 n SER 99 Ca 0.17 -0.98 -0.39 0.00 -0.26 0.00 0.00 58.87 57.41 3iv8 n SER 99 Cb 0.34 0.00 0.04 0.00 -0.26 0.00 0.00 64.21 64.32 3iv8 n SER 99 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 3iv8 n SER 100 N -0.90 0.26 -0.23 4.04 3.41 -1.26 -4.80 113.62 114.14 3iv8 n SER 100 Ca 0.00 0.84 0.24 0.00 -0.26 0.00 0.00 58.87 59.69 3iv8 n SER 100 Cb 0.00 -1.30 0.60 0.00 -0.26 0.00 0.00 64.21 63.25 3iv8 n SER 100 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 3iv8 h ASP 101 N 0.68 0.24 0.66 4.04 3.45 -2.00 -2.38 116.42 121.10 3iv8 h ASP 101 Ca -0.46 0.03 -0.03 0.00 0.43 0.00 0.00 57.03 57.00 3iv8 h ASP 101 Cb 1.37 -0.01 0.01 0.00 -0.56 0.00 0.00 39.33 40.13 3iv8 h ASP 101 CO 0.51 0.08 -0.32 -0.08 -1.57 0.00 0.00 179.24 177.87 3iv8 h GLU 102 N 0.24 -0.85 -0.77 3.56 4.57 -2.01 -2.98 114.58 116.34 3iv8 h GLU 102 Ca 0.47 0.06 0.18 0.00 -1.18 0.00 0.00 59.36 58.89 3iv8 h GLU 102 Cb 1.45 0.19 -0.13 0.00 -0.16 0.00 0.00 28.75 30.10 3iv8 h GLU 102 CO -0.12 -0.53 0.04 -0.91 -1.18 0.00 0.00 179.01 176.30 3iv8 h ASN 103 N -1.13 -0.30 -1.05 1.04 2.35 -1.78 0.36 115.58 115.08 3iv8 h ASN 103 Ca -0.09 0.19 0.27 0.00 -0.55 0.00 0.00 56.30 56.13 3iv8 h ASN 103 Cb 0.71 0.33 -0.11 0.00 0.05 0.00 0.00 38.32 39.31 3iv8 h ASN 103 CO 0.15 -0.17 0.66 0.24 -1.65 0.00 0.00 177.43 176.66 3iv8 h MET 104 N 0.12 0.41 0.08 0.81 2.86 -1.40 0.16 114.93 117.97 3iv8 h MET 104 Ca 0.43 -0.02 -0.27 0.00 -2.06 0.00 0.00 59.70 57.77 3iv8 h MET 104 Cb 0.76 -0.09 -0.01 0.00 0.06 0.00 0.00 31.60 32.32 3iv8 h MET 104 CO -0.66 0.27 -1.34 0.00 1.06 0.00 0.00 176.91 176.24 3iv8 h ARG 105 N 0.42 0.18 -0.41 1.72 3.08 -0.16 -2.31 114.38 116.90 3iv8 h ARG 105 Ca 0.63 -0.31 0.05 0.00 0.07 0.00 0.00 59.98 60.42 3iv8 h ARG 105 Cb 1.51 0.11 -0.05 0.00 0.08 0.00 0.00 29.97 31.63 3iv8 h ARG 105 CO -0.37 1.07 0.14 1.96 -1.07 0.00 0.00 179.97 181.71 3iv8 h GLN 106 N 0.05 0.30 0.15 0.04 4.20 -0.33 -1.06 115.11 118.46 3iv8 h GLN 106 Ca -0.16 -0.02 -0.01 0.00 0.06 0.00 0.00 58.65 58.52 3iv8 h GLN 106 Cb 1.95 -0.07 0.00 0.00 0.30 0.00 0.00 27.48 29.66 3iv8 h GLN 106 CO 0.16 0.20 -0.07 0.00 -0.67 0.00 0.00 178.83 178.44 3iv8 h ALA 107 N 1.27 -0.21 -1.00 3.87 0.00 -0.73 0.30 119.26 122.77 3iv8 h ALA 107 Ca 0.19 -0.07 0.17 0.00 0.00 0.00 0.00 54.91 55.20 3iv8 h ALA 107 Cb 0.17 0.08 -0.10 0.00 0.00 0.00 0.00 17.79 17.95 3iv8 h ALA 107 CO -0.19 -0.59 0.62 0.82 0.00 0.00 0.00 179.25 179.90 3iv8 h ILE 108 N -0.26 0.76 0.66 0.00 2.04 -1.38 0.36 117.51 119.69 3iv8 h ILE 108 Ca -0.02 -0.27 -0.03 0.00 1.00 0.00 0.00 64.86 65.53 3iv8 h ILE 108 Cb 0.21 -0.11 0.01 0.00 -0.74 0.00 0.00 36.82 36.18 3iv8 h ILE 108 CO 0.03 0.15 -0.32 0.00 0.00 0.00 0.00 178.15 178.01 3iv8 h ALA 109 N 1.62 -0.94 -0.84 1.87 0.00 -0.11 0.24 119.26 121.10 3iv8 h ALA 109 Ca 0.55 -0.19 0.19 0.00 0.00 0.00 0.00 54.91 55.46 3iv8 h ALA 109 Cb 0.82 0.34 -0.12 0.00 0.00 0.00 0.00 17.79 18.83 3iv8 h ALA 109 CO -0.34 -0.87 0.32 0.00 0.00 0.00 0.00 179.25 178.36 3iv8 h ALA 110 N -1.31 1.26 -0.23 0.00 0.00 -0.23 -1.32 119.26 117.43 3iv8 h ALA 110 Ca -0.09 0.16 -0.04 0.00 0.00 0.00 0.00 54.91 54.94 3iv8 h ALA 110 Cb 0.68 0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.63 3iv8 h ALA 110 CO 0.15 -0.32 -0.00 0.00 0.00 0.00 0.00 179.25 179.08 3iv8 h ALA 111 N 1.67 0.31 -0.91 0.00 0.00 -0.19 -2.15 119.26 117.99 3iv8 h ALA 111 Ca 0.50 -0.22 0.14 0.00 0.00 0.00 0.00 54.91 55.33 3iv8 h ALA 111 Cb 0.91 -0.09 -0.09 0.00 0.00 0.00 0.00 17.79 18.52 3iv8 h ALA 111 CO -0.51 0.04 0.52 -0.09 0.00 0.00 0.00 179.25 179.21 3iv8 h ARG 112 N 0.18 0.75 0.47 0.00 2.43 -0.19 -1.36 114.38 116.67 3iv8 h ARG 112 Ca 0.07 -0.05 -0.02 0.00 -0.81 0.00 0.00 59.98 59.17 3iv8 h ARG 112 Cb 0.41 -0.17 0.00 0.00 -0.42 0.00 0.00 29.97 29.79 3iv8 h ARG 112 CO 0.01 0.50 -0.23 1.49 -1.51 0.00 0.00 179.97 180.23 3iv8 h GLU 113 N 0.78 -0.61 -0.75 0.20 4.81 -1.17 -2.74 114.58 115.09 3iv8 h GLU 113 Ca 0.48 0.04 0.16 0.00 -0.13 0.00 0.00 59.36 59.91 3iv8 h GLU 113 Cb 0.60 0.14 -0.11 0.00 0.63 0.00 0.00 28.75 30.01 3iv8 h GLU 113 CO -0.32 -0.33 0.23 -0.92 -0.73 0.00 0.00 179.01 176.94 3iv8 h TYR 114 N -1.07 0.37 0.00 0.92 3.20 -1.13 -0.70 116.97 118.56 3iv8 h TYR 114 Ca -0.07 0.04 -0.06 0.00 3.14 0.00 0.00 58.73 61.79 3iv8 h TYR 114 Cb 0.57 -0.05 -0.01 0.00 1.54 0.00 0.00 36.73 38.78 3iv8 h TYR 114 CO 0.01 -0.04 -0.27 1.96 -1.64 0.00 0.00 178.16 178.19 3iv8 h GLN 115 N 0.33 0.00 -0.18 1.82 4.20 -1.33 0.66 115.11 120.61 3iv8 h GLN 115 Ca 0.42 0.00 -0.13 0.00 0.06 0.00 0.00 58.65 59.00 3iv8 h GLN 115 Cb 0.71 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.48 3iv8 h GLN 115 CO -0.48 0.27 -0.44 0.00 -0.67 0.00 0.00 178.83 177.50 3iv8 h ALA 116 N 1.73 0.90 0.05 3.87 0.00 -0.81 -3.29 119.26 121.72 3iv8 h ALA 116 Ca -0.00 -0.45 -0.10 0.00 0.00 0.00 0.00 54.91 54.35 3iv8 h ALA 116 Cb 0.64 -0.10 0.01 0.00 0.00 0.00 0.00 17.79 18.34 3iv8 h ALA 116 CO 0.03 0.64 -0.43 -0.22 0.00 0.00 0.00 179.25 179.28 3iv8 h LYS 117 N 0.36 0.21 -4.48 0.00 3.64 -1.21 -3.46 116.57 111.64 3iv8 h LYS 117 Ca 0.03 -0.29 -0.60 0.00 -1.27 0.00 0.00 60.65 58.52 3iv8 h LYS 117 Cb 0.93 0.10 -0.37 0.00 -0.41 0.00 0.00 32.23 32.47 3iv8 h LYS 117 CO 0.08 1.07 -0.81 0.71 -2.27 0.00 0.00 179.45 178.24 3iv8 s TYR 118 N -2.69 2.26 0.41 1.91 2.02 0.19 -5.12 117.35 116.33 3iv8 s TYR 118 Ca -0.15 -1.49 -0.13 0.00 -0.37 0.00 0.00 57.07 54.93 3iv8 s TYR 118 Cb 0.00 -1.57 -0.07 0.00 -0.40 0.00 0.00 41.96 39.92 3iv8 s TYR 118 CO 0.77 -0.72 0.81 -1.25 -1.57 0.00 0.00 175.55 173.60 3iv8 s PRO 119 N 1.45 3.87 -1.72 -1.71 0.04 -1.26 -4.25 135.00 131.42 3iv8 s PRO 119 Ca -0.01 0.63 0.00 0.00 0.04 0.00 0.00 61.00 61.66 3iv8 s PRO 119 Cb -0.16 -2.34 0.00 0.00 0.04 0.00 0.00 34.50 32.04 3iv8 s PRO 119 CO -0.08 -0.05 0.00 0.09 0.04 0.00 0.00 177.00 177.00 3iv8 n ASN 120 N -1.16 -5.29 0.01 6.66 3.02 -1.26 -4.82 115.26 112.42 3iv8 n ASN 120 Ca 0.04 0.17 -0.00 0.00 -0.03 0.00 0.00 54.58 54.75 3iv8 n ASN 120 Cb 0.54 -4.37 -0.00 0.00 -0.61 0.00 0.00 39.78 35.34 3iv8 n ASN 120 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3iv8 n GLN 121 N -2.65 0.01 -2.82 3.52 6.02 -1.26 -4.60 117.38 115.59 3iv8 n GLN 121 Ca -0.20 0.00 -0.42 0.00 -0.01 0.00 0.00 57.00 56.37 3iv8 n GLN 121 Cb 0.64 -0.15 -0.03 0.00 1.02 0.00 0.00 30.24 31.72 3iv8 n GLN 121 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.06 176.50 3iv8 s SER 122 N -5.13 7.11 0.00 1.08 0.15 -1.26 -0.97 113.70 114.68 3iv8 s SER 122 Ca -0.00 1.36 0.20 0.00 0.70 0.00 0.00 55.95 58.21 3iv8 s SER 122 Cb 0.00 -2.50 0.55 0.00 -1.71 0.00 0.00 66.02 62.36 3iv8 s SER 122 CO 0.01 -0.35 1.46 0.18 1.20 0.00 0.00 173.24 175.74 3iv8 n LEU 123 N 4.74 3.31 0.00 3.45 4.77 -0.10 -4.93 117.00 128.25 3iv8 n LEU 123 Ca 0.05 -1.62 0.00 0.00 -0.03 0.00 0.00 56.01 54.41 3iv8 n LEU 123 Cb 0.49 -0.39 0.00 0.00 -2.33 0.00 0.00 43.42 41.20 3iv8 n LEU 123 CO 0.50 0.81 0.00 0.61 -1.33 0.00 0.00 177.39 177.98 3iv8 n GLY 124 N 1.49 3.01 3.77 -0.72 0.00 -1.26 -4.57 105.19 106.90 3iv8 n GLY 124 Ca 0.21 -2.01 -0.38 0.00 0.00 0.00 0.00 46.02 43.84 3iv8 n GLY 124 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3iv8 s LEU 125 N 0.00 4.39 -0.35 0.99 2.96 0.21 -3.71 118.68 123.17 3iv8 s LEU 125 Ca 0.00 2.01 -0.07 0.00 -0.22 0.00 0.00 54.13 55.85 3iv8 s LEU 125 Cb 0.00 -3.90 0.04 0.00 0.50 0.00 0.00 46.19 42.82 3iv8 s LEU 125 CO 0.00 -0.16 0.13 -2.28 -1.32 0.00 0.00 176.35 172.71 3iv8 s HIS 126 N -1.45 3.25 -0.52 5.38 5.65 0.10 -0.92 115.29 126.79 3iv8 s HIS 126 Ca 0.49 -1.34 -0.21 0.00 0.25 0.00 0.00 55.06 54.25 3iv8 s HIS 126 Cb -0.24 -2.31 0.05 0.00 -1.18 0.00 0.00 32.58 28.90 3iv8 s HIS 126 CO 0.30 -0.72 0.76 -0.51 -0.65 0.00 0.00 174.74 173.93 3iv8 s LEU 127 N 1.43 4.55 -0.80 8.88 1.43 0.31 -1.06 118.68 133.43 3iv8 s LEU 127 Ca -0.01 -0.61 -0.14 0.00 -1.03 0.00 0.00 54.13 52.35 3iv8 s LEU 127 Cb -0.19 -2.64 0.21 0.00 0.03 0.00 0.00 46.19 43.59 3iv8 s LEU 127 CO 0.04 -1.02 0.74 -0.70 0.23 0.00 0.00 176.35 175.63 3iv8 s GLU 128 N 3.20 3.52 0.00 1.70 2.12 -0.17 -0.06 118.70 129.01 3iv8 s GLU 128 Ca 0.22 -2.40 0.00 0.00 0.36 0.00 0.00 54.97 53.15 3iv8 s GLU 128 Cb -0.16 -4.40 0.00 0.00 0.26 0.00 0.00 34.13 29.83 3iv8 s GLU 128 CO 0.16 -1.29 0.00 0.41 -0.54 0.00 0.00 175.26 174.00 3iv8 n GLY 129 N 4.07 -3.07 0.20 -1.50 0.00 -0.94 -2.55 105.19 101.40 3iv8 n GLY 129 Ca 0.11 -2.15 0.09 0.00 0.00 0.00 0.00 46.02 44.07 3iv8 n GLY 129 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3iv8 n PRO 130 N -0.17 1.26 -1.90 1.61 -0.04 -1.26 -4.78 135.00 129.72 3iv8 n PRO 130 Ca 0.00 -0.40 -0.40 0.00 -0.04 0.00 0.00 63.50 62.66 3iv8 n PRO 130 Cb 0.00 -1.32 -0.01 0.00 -0.04 0.00 0.00 33.50 32.13 3iv8 n PRO 130 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 3iv8 n TYR 131 N -0.38 2.61 -3.73 0.54 4.01 -1.26 -2.29 117.16 116.66 3iv8 n TYR 131 Ca 0.14 -2.87 -0.25 0.00 -0.16 0.00 0.00 57.90 54.76 3iv8 n TYR 131 Cb 0.16 -1.96 0.01 0.00 -0.31 0.00 0.00 39.34 37.24 3iv8 n TYR 131 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 3iv8 s LEU 132 N -1.52 2.70 -0.25 7.72 1.43 -1.26 -1.33 118.68 126.17 3iv8 s LEU 132 Ca 0.55 -1.22 -0.13 0.00 -1.03 0.00 0.00 54.13 52.30 3iv8 s LEU 132 Cb 0.18 -1.18 -0.04 0.00 0.03 0.00 0.00 46.19 45.17 3iv8 s LEU 132 CO -0.08 -1.22 0.27 0.21 0.23 0.00 0.00 176.35 175.76 3iv8 s ASN 133 N -4.39 6.18 0.49 2.29 3.84 -0.53 -4.67 114.94 118.16 3iv8 s ASN 133 Ca 0.38 0.20 0.21 0.00 0.21 0.00 0.00 52.86 53.86 3iv8 s ASN 133 Cb -0.03 -2.16 1.25 0.00 -0.55 0.00 0.00 41.25 39.76 3iv8 s ASN 133 CO 0.24 -0.06 1.99 0.58 -2.79 0.00 0.00 177.10 177.06 3iv8 h VAL 134 N 5.23 0.79 0.00 -5.21 2.07 -1.96 0.01 116.25 117.19 3iv8 h VAL 134 Ca -0.35 -0.05 0.00 0.00 0.82 0.00 0.00 66.70 67.12 3iv8 h VAL 134 Cb 1.17 0.63 0.00 0.00 -1.52 0.00 0.00 31.29 31.57 3iv8 h VAL 134 CO 0.63 0.03 0.00 0.24 0.02 0.00 0.00 177.57 178.49 3iv8 h MET 135 N 0.16 0.00 -0.88 1.57 2.86 -1.94 -3.03 114.93 113.66 3iv8 h MET 135 Ca 0.26 0.00 -0.57 0.00 -2.06 0.00 0.00 59.70 57.34 3iv8 h MET 135 Cb 0.82 0.00 -0.42 0.00 0.06 0.00 0.00 31.60 32.07 3iv8 h MET 135 CO -0.04 0.00 -0.69 1.63 1.06 0.00 0.00 176.91 178.87 3iv8 n LYS 136 N -2.43 3.53 0.20 1.72 4.76 -0.01 -4.83 118.16 121.09 3iv8 n LYS 136 Ca 0.04 -4.16 0.05 0.00 -2.87 0.00 0.00 58.31 51.37 3iv8 n LYS 136 Cb 0.37 -2.28 0.52 0.00 -1.84 0.00 0.00 35.03 31.80 3iv8 n LYS 136 CO 0.00 0.00 0.00 1.57 -1.37 0.00 0.00 177.40 177.60 3iv8 h LYS 137 N 2.23 0.08 0.00 1.97 2.10 -1.55 -3.44 116.57 117.97 3iv8 h LYS 137 Ca 0.38 -0.01 0.00 0.00 -2.00 0.00 0.00 60.65 59.01 3iv8 h LYS 137 Cb 1.40 -0.01 0.00 0.00 -0.90 0.00 0.00 32.23 32.71 3iv8 h LYS 137 CO 0.83 0.17 0.00 0.41 -2.00 0.00 0.00 179.45 178.86 3iv8 n GLY 138 N -1.18 3.52 1.25 0.07 0.00 -1.26 -0.79 105.19 106.79 3iv8 n GLY 138 Ca -0.02 0.24 0.11 0.00 0.00 0.00 0.00 46.02 46.35 3iv8 n GLY 138 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 3iv8 n ILE 139 N 0.00 0.95 -2.84 -0.61 -5.35 -1.26 -4.95 119.36 105.30 3iv8 n ILE 139 Ca 0.00 -0.98 -0.41 0.00 -0.27 0.00 0.00 62.75 61.09 3iv8 n ILE 139 Cb 0.00 0.55 -0.04 0.00 -1.74 0.00 0.00 39.64 38.41 3iv8 n ILE 139 CO 0.00 0.00 0.00 -1.00 -1.76 0.00 0.00 176.55 173.79 3iv8 s HIS 140 N -1.04 3.65 0.16 4.28 3.76 0.03 -5.01 115.29 121.11 3iv8 s HIS 140 Ca 0.45 1.54 -0.30 0.00 -0.15 0.00 0.00 55.06 56.60 3iv8 s HIS 140 Cb 0.24 -2.99 -0.08 0.00 1.11 0.00 0.00 32.58 30.86 3iv8 s HIS 140 CO 0.31 0.06 1.27 -1.54 -0.85 0.00 0.00 174.74 173.99 3iv8 s SER 141 N 0.80 6.97 0.57 1.40 1.04 -1.26 -4.83 113.70 118.40 3iv8 s SER 141 Ca 0.46 2.28 0.31 0.00 0.48 0.00 0.00 55.95 59.48 3iv8 s SER 141 Cb -0.20 -2.60 1.42 0.00 0.10 0.00 0.00 66.02 64.74 3iv8 s SER 141 CO 0.24 -0.50 1.79 0.58 0.98 0.00 0.00 173.24 176.34 3iv8 h VAL 142 N 3.96 0.34 -0.21 5.02 2.07 -1.94 -1.99 116.25 123.50 3iv8 h VAL 142 Ca -0.44 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.14 3iv8 h VAL 142 Cb 1.21 0.47 -0.06 0.00 -1.52 0.00 0.00 31.29 31.39 3iv8 h VAL 142 CO 0.79 0.00 -0.17 0.44 0.02 0.00 0.00 177.57 178.65 3iv8 h ASP 143 N 0.00 -0.55 0.00 0.57 3.32 -2.01 -3.29 116.42 114.47 3iv8 h ASP 143 Ca 0.37 0.11 0.00 0.00 0.02 0.00 0.00 57.03 57.53 3iv8 h ASP 143 Cb 1.76 0.27 0.00 0.00 0.22 0.00 0.00 39.33 41.58 3iv8 h ASP 143 CO -0.00 -0.21 -0.94 0.49 -1.72 0.00 0.00 179.24 176.85 3iv8 n PHE 144 N -5.32 0.00 -1.86 4.55 3.72 -0.79 -4.94 117.46 112.82 3iv8 n PHE 144 Ca -0.01 0.00 -0.42 0.00 -0.05 0.00 0.00 57.45 56.97 3iv8 n PHE 144 Cb 0.24 -0.05 -0.03 0.00 -0.94 0.00 0.00 39.48 38.70 3iv8 n PHE 144 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 176.76 177.13 3iv8 s ILE 145 N -2.73 2.51 0.14 4.37 1.01 -0.98 -4.80 121.20 120.72 3iv8 s ILE 145 Ca 0.05 0.31 -0.23 0.00 0.00 0.00 0.00 60.65 60.78 3iv8 s ILE 145 Cb 0.13 -3.20 0.07 0.00 0.01 0.00 0.00 42.46 39.47 3iv8 s ILE 145 CO 0.73 0.02 0.60 0.00 0.00 0.00 0.00 174.94 176.28 3iv8 s ARG 146 N 1.44 1.25 0.77 2.79 1.70 -0.97 -4.99 118.95 120.94 3iv8 s ARG 146 Ca 0.72 -0.41 -0.15 0.00 -0.47 0.00 0.00 55.73 55.43 3iv8 s ARG 146 Cb -0.45 0.58 0.05 0.00 -0.57 0.00 0.00 34.95 34.55 3iv8 s ARG 146 CO 0.32 -0.53 1.11 -0.35 -1.08 0.00 0.00 175.30 174.77 3iv8 n PRO 147 N -0.25 0.37 -2.48 3.89 -0.04 -1.26 -4.07 135.00 131.16 3iv8 n PRO 147 Ca -0.17 0.19 -0.41 0.00 -0.04 0.00 0.00 63.50 63.08 3iv8 n PRO 147 Cb 0.64 -2.36 -0.04 0.00 -0.04 0.00 0.00 33.50 31.70 3iv8 n PRO 147 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 3iv8 s SER 148 N -1.88 7.25 0.06 3.54 1.04 -1.26 -4.92 113.70 117.53 3iv8 s SER 148 Ca 0.74 2.19 0.04 0.00 0.48 0.00 0.00 55.95 59.40 3iv8 s SER 148 Cb -0.32 -2.62 -0.04 0.00 0.10 0.00 0.00 66.02 63.15 3iv8 s SER 148 CO 0.50 -0.19 -0.04 1.51 0.98 0.00 0.00 173.24 176.00 3iv8 s ASP 149 N -0.47 4.81 0.40 7.02 -4.77 -1.26 -4.83 116.67 117.58 3iv8 s ASP 149 Ca 0.47 -0.19 0.17 0.00 -3.30 0.00 0.00 52.55 49.70 3iv8 s ASP 149 Cb -0.31 -1.12 1.05 0.00 -1.09 0.00 0.00 42.92 41.46 3iv8 s ASP 149 CO 0.38 0.22 1.83 0.44 0.70 0.00 0.00 175.17 178.74 3iv8 h ASP 150 N 3.87 0.45 0.57 2.11 3.45 -1.98 -1.84 116.42 123.04 3iv8 h ASP 150 Ca -0.48 0.05 -0.03 0.00 0.43 0.00 0.00 57.03 57.00 3iv8 h ASP 150 Cb 1.17 -0.03 0.01 0.00 -0.56 0.00 0.00 39.33 39.92 3iv8 h ASP 150 CO 0.56 0.16 -0.27 0.74 -1.57 0.00 0.00 179.24 178.86 3iv8 h THR 151 N 0.44 0.10 -0.12 0.35 2.02 -1.99 -0.88 112.91 112.83 3iv8 h THR 151 Ca 0.51 -0.44 -0.04 0.00 0.77 0.00 0.00 66.41 67.21 3iv8 h THR 151 Cb 1.22 0.14 -0.01 0.00 -1.74 0.00 0.00 68.15 67.76 3iv8 h THR 151 CO -0.22 0.02 -0.11 -0.03 0.37 0.00 0.00 175.52 175.55 3iv8 h MET 152 N -1.16 0.18 -0.40 6.66 1.85 -1.98 -1.08 114.93 119.00 3iv8 h MET 152 Ca -0.08 -0.04 -0.12 0.00 -0.61 0.00 0.00 59.70 58.86 3iv8 h MET 152 Cb 0.61 -0.03 -0.01 0.00 0.43 0.00 0.00 31.60 32.60 3iv8 h MET 152 CO 0.13 0.30 -0.23 0.82 -0.40 0.00 0.00 176.91 177.52 3iv8 h ILE 153 N 0.17 1.27 -0.59 1.77 1.08 -1.23 -0.44 117.51 119.55 3iv8 h ILE 153 Ca 0.04 -1.36 -0.10 0.00 -0.39 0.00 0.00 64.86 63.05 3iv8 h ILE 153 Cb 0.31 1.21 -0.02 0.00 -3.07 0.00 0.00 36.82 35.25 3iv8 h ILE 153 CO 0.02 0.45 -0.01 0.44 -0.69 0.00 0.00 178.15 178.36 3iv8 h ASP 154 N 0.70 1.01 -0.83 1.72 5.19 -0.61 -1.69 116.42 121.91 3iv8 h ASP 154 Ca 0.09 -0.29 0.03 0.00 -0.62 0.00 0.00 57.03 56.24 3iv8 h ASP 154 Cb 0.75 -0.27 -0.05 0.00 0.18 0.00 0.00 39.33 39.95 3iv8 h ASP 154 CO 0.06 1.07 0.54 0.74 -3.12 0.00 0.00 179.24 178.53 3iv8 h THR 155 N 0.94 1.16 -0.03 0.35 2.02 -0.85 0.57 112.91 117.06 3iv8 h THR 155 Ca 0.17 -0.37 -0.00 0.00 0.77 0.00 0.00 66.41 66.98 3iv8 h THR 155 Cb 0.56 -0.01 -0.00 0.00 -1.74 0.00 0.00 68.15 66.96 3iv8 h THR 155 CO 0.03 0.20 0.00 0.40 0.37 0.00 0.00 175.52 176.52 3iv8 h ILE 156 N 1.07 1.23 -0.98 3.11 2.04 -0.86 -2.91 117.51 120.22 3iv8 h ILE 156 Ca 0.32 -0.70 0.06 0.00 1.00 0.00 0.00 64.86 65.54 3iv8 h ILE 156 Cb -0.03 1.66 -0.07 0.00 -0.74 0.00 0.00 36.82 37.64 3iv8 h ILE 156 CO -0.10 0.19 0.63 0.00 0.00 0.00 0.00 178.15 178.87 3iv8 h ALA 158 N 1.44 1.96 -0.81 0.00 0.00 -0.87 -2.93 119.26 118.05 3iv8 h ALA 158 Ca 0.42 -0.00 -0.41 0.00 0.00 0.00 0.00 54.91 54.92 3iv8 h ALA 158 Cb 0.15 -0.10 -0.24 0.00 0.00 0.00 0.00 17.79 17.59 3iv8 h ALA 158 CO -0.17 -0.15 0.44 0.09 0.00 0.00 0.00 179.25 179.46 3iv8 n ASN 159 N -4.50 3.49 0.05 0.00 3.02 -0.69 -4.75 115.26 111.89 3iv8 n ASN 159 Ca 0.14 -3.63 0.08 0.00 -0.03 0.00 0.00 54.58 51.14 3iv8 n ASN 159 Cb 0.44 -0.78 0.35 0.00 -0.61 0.00 0.00 39.78 39.19 3iv8 n ASN 159 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 3iv8 n SER 160 N -1.08 0.25 0.02 6.41 3.41 -1.11 -1.82 113.62 119.70 3iv8 n SER 160 Ca 0.52 0.57 0.09 0.00 -0.26 0.00 0.00 58.87 59.79 3iv8 n SER 160 Cb 1.49 -0.62 0.40 0.00 -0.26 0.00 0.00 64.21 65.23 3iv8 n SER 160 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 3iv8 n ASP 161 N -1.78 0.09 0.00 4.04 3.85 -1.26 -3.49 116.55 117.99 3iv8 n ASP 161 Ca 0.02 0.52 0.00 0.00 -0.71 0.00 0.00 54.79 54.62 3iv8 n ASP 161 Cb 0.17 -0.54 0.00 0.00 -1.35 0.00 0.00 41.12 39.40 3iv8 n ASP 161 CO 0.00 0.00 0.00 0.52 -1.01 0.00 0.00 177.20 176.71 3iv8 n VAL 162 N -1.59 0.00 -3.93 2.12 0.31 -0.75 -4.98 118.33 109.51 3iv8 n VAL 162 Ca 0.04 -0.20 -0.35 0.00 -0.01 0.00 0.00 64.34 63.82 3iv8 n VAL 162 Cb 0.23 1.28 -0.13 0.00 -0.91 0.00 0.00 33.84 34.30 3iv8 n VAL 162 CO 0.00 0.00 0.00 -0.63 -1.32 0.00 0.00 176.83 174.88 3iv8 s ILE 163 N -0.21 3.66 -0.03 2.52 1.01 -1.13 -0.62 121.20 126.39 3iv8 s ILE 163 Ca 0.00 -0.40 0.05 0.00 0.00 0.00 0.00 60.65 60.30 3iv8 s ILE 163 Cb 0.00 -2.67 -0.25 0.00 0.01 0.00 0.00 42.46 39.55 3iv8 s ILE 163 CO 0.00 0.41 0.70 0.00 0.00 0.00 0.00 174.94 176.05 3iv8 h ALA 164 N 7.99 0.55 -2.16 9.38 0.00 -1.25 -3.45 119.26 130.33 3iv8 h ALA 164 Ca -0.39 -1.32 -0.07 0.00 0.00 0.00 0.00 54.91 53.13 3iv8 h ALA 164 Cb 1.17 0.43 -0.21 0.00 0.00 0.00 0.00 17.79 19.18 3iv8 h ALA 164 CO 0.60 1.40 0.06 0.21 0.00 0.00 0.00 179.25 181.52 3iv8 s LYS 165 N -2.60 0.85 -0.11 0.00 2.20 -0.72 -1.63 119.74 117.73 3iv8 s LYS 165 Ca -0.09 0.56 0.00 0.00 -0.36 0.00 0.00 55.97 56.09 3iv8 s LYS 165 Cb 0.08 0.41 0.02 0.00 -1.51 0.00 0.00 37.83 36.82 3iv8 s LYS 165 CO 0.82 -0.18 -0.10 0.08 -0.36 0.00 0.00 175.35 175.61 3iv8 s VAL 166 N -0.36 1.16 -0.08 4.02 1.01 -0.06 -0.53 120.40 125.56 3iv8 s VAL 166 Ca -0.05 -0.40 -0.15 0.00 0.00 0.00 0.00 61.98 61.38 3iv8 s VAL 166 Cb -0.03 -1.14 -0.05 0.00 0.00 0.00 0.00 36.38 35.16 3iv8 s VAL 166 CO 0.04 0.39 0.39 -0.89 0.00 0.00 0.00 175.10 175.03 3iv8 s THR 167 N 1.48 5.16 0.14 3.92 2.01 0.91 -1.22 115.64 128.03 3iv8 s THR 167 Ca 0.02 0.79 -0.13 0.00 0.31 0.00 0.00 61.69 62.67 3iv8 s THR 167 Cb -0.13 -3.71 0.01 0.00 0.01 0.00 0.00 72.50 68.68 3iv8 s THR 167 CO -0.07 0.46 0.35 -1.48 -0.69 0.00 0.00 174.62 173.19 3iv8 s LEU 168 N -0.20 0.70 -0.25 4.42 0.05 -0.03 -2.22 118.68 121.14 3iv8 s LEU 168 Ca 0.22 -0.57 -0.16 0.00 0.05 0.00 0.00 54.13 53.68 3iv8 s LEU 168 Cb -0.15 1.56 -0.04 0.00 -2.05 0.00 0.00 46.19 45.51 3iv8 s LEU 168 CO 0.10 -0.88 0.40 0.00 -0.55 0.00 0.00 176.35 175.42 3iv8 s ALA 169 N -3.87 3.57 -0.36 1.48 0.00 -0.44 -1.88 121.76 120.25 3iv8 s ALA 169 Ca 0.08 -0.71 0.23 0.00 0.00 0.00 0.00 51.96 51.57 3iv8 s ALA 169 Cb 0.02 -2.71 0.18 0.00 0.00 0.00 0.00 23.12 20.61 3iv8 s ALA 169 CO -0.07 -0.57 1.30 -1.00 0.00 0.00 0.00 175.76 175.42 3iv8 h PRO 170 N 7.92 0.00 -0.93 0.00 0.13 -1.89 -3.40 132.00 133.84 3iv8 h PRO 170 Ca -0.32 0.00 0.27 0.00 -0.87 0.00 0.00 66.00 65.08 3iv8 h PRO 170 Cb 1.16 0.00 -0.15 0.00 0.13 0.00 0.00 31.00 32.14 3iv8 h PRO 170 CO 0.67 0.00 0.34 0.93 -0.23 0.00 0.00 178.00 179.71 3iv8 h GLU 171 N 0.00 0.22 -0.00 0.86 3.07 -1.95 -2.18 114.58 114.60 3iv8 h GLU 171 Ca 0.00 -0.01 -0.00 0.00 -0.50 0.00 0.00 59.36 58.85 3iv8 h GLU 171 Cb 0.97 -0.05 -0.00 0.00 -0.84 0.00 0.00 28.75 28.83 3iv8 h GLU 171 CO 0.00 0.14 -0.41 0.09 -1.40 0.00 0.00 179.01 177.43 3iv8 n ASN 172 N -5.19 1.83 -4.34 1.42 3.02 -1.26 -5.03 115.26 105.72 3iv8 n ASN 172 Ca 0.25 -3.76 -0.18 0.00 -0.03 0.00 0.00 54.58 50.86 3iv8 n ASN 172 Cb 0.80 -0.51 -0.10 0.00 -0.61 0.00 0.00 39.78 39.36 3iv8 n ASN 172 CO 0.00 0.00 0.00 0.20 -2.62 0.00 0.00 177.26 174.84 3iv8 s ASN 173 N -3.17 2.33 -0.10 6.41 0.01 -0.82 -4.85 114.94 114.75 3iv8 s ASN 173 Ca 0.37 -1.07 -0.29 0.00 -0.71 0.00 0.00 52.86 51.15 3iv8 s ASN 173 Cb 0.35 -0.09 -0.05 0.00 0.41 0.00 0.00 41.25 41.87 3iv8 s ASN 173 CO -0.05 -0.28 1.63 -0.54 -1.51 0.00 0.00 177.10 176.35 3iv8 s LYS 174 N -3.71 4.09 0.39 -0.60 1.02 -1.26 -4.89 119.74 114.78 3iv8 s LYS 174 Ca 0.23 2.04 0.14 0.00 0.02 0.00 0.00 55.97 58.41 3iv8 s LYS 174 Cb 0.02 -3.99 0.99 0.00 -0.52 0.00 0.00 37.83 34.33 3iv8 s LYS 174 CO 0.06 -0.95 1.85 -1.35 -0.92 0.00 0.00 175.35 174.04 3iv8 h PRO 175 N 9.77 0.50 0.00 -1.68 0.11 -1.99 -0.21 132.00 138.50 3iv8 h PRO 175 Ca -0.37 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.71 3iv8 h PRO 175 Cb 1.17 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 32.17 3iv8 h PRO 175 CO 0.96 0.33 0.00 1.05 -0.21 0.00 0.00 178.00 180.13 3iv8 h GLU 176 N 0.51 0.00 0.06 1.05 9.09 -1.97 -2.51 114.58 120.81 3iv8 h GLU 176 Ca 0.48 0.00 -0.00 0.00 0.05 0.00 0.00 59.36 59.89 3iv8 h GLU 176 Cb 1.05 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.15 3iv8 h GLU 176 CO -0.21 0.00 -0.03 0.45 0.05 0.00 0.00 179.01 179.27 3iv8 h HIS 177 N 0.00 -0.07 -0.84 2.06 3.86 -1.41 -1.78 115.15 116.96 3iv8 h HIS 177 Ca 0.00 -0.00 0.14 0.00 -1.16 0.00 0.00 60.37 59.35 3iv8 h HIS 177 Cb 0.07 0.02 -0.15 0.00 1.06 0.00 0.00 27.41 28.42 3iv8 h HIS 177 CO 0.00 0.53 -0.34 0.82 0.86 0.00 0.00 177.93 179.80 3iv8 h ILE 178 N -0.86 0.08 -0.99 2.45 2.04 -1.59 -1.24 117.51 117.40 3iv8 h ILE 178 Ca -0.01 0.00 0.04 0.00 1.00 0.00 0.00 64.86 65.89 3iv8 h ILE 178 Cb 0.64 0.08 -0.06 0.00 -0.74 0.00 0.00 36.82 36.74 3iv8 h ILE 178 CO 0.01 0.00 0.65 -0.33 0.00 0.00 0.00 178.15 178.48 3iv8 h GLU 179 N -0.05 1.22 -0.48 2.37 5.08 -1.46 -1.39 114.58 119.86 3iv8 h GLU 179 Ca 0.33 -0.07 -0.09 0.00 -1.00 0.00 0.00 59.36 58.52 3iv8 h GLU 179 Cb 0.59 -0.28 -0.02 0.00 0.50 0.00 0.00 28.75 29.55 3iv8 h GLU 179 CO -0.87 0.81 -0.08 0.87 -1.00 0.00 0.00 179.01 178.74 3iv8 h LYS 180 N 1.26 0.85 -0.32 2.33 1.57 -0.35 -1.44 116.57 120.47 3iv8 h LYS 180 Ca 0.39 -0.27 -0.13 0.00 -1.87 0.00 0.00 60.65 58.77 3iv8 h LYS 180 Cb -0.00 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.23 3iv8 h LYS 180 CO -0.12 0.90 -0.32 -0.07 -0.57 0.00 0.00 179.45 179.26 3iv8 h LEU 181 N 0.77 0.84 -0.22 2.94 3.38 -0.70 0.10 115.31 122.43 3iv8 h LEU 181 Ca 0.13 -0.47 -0.04 0.00 0.09 0.00 0.00 57.88 57.59 3iv8 h LEU 181 Cb 0.57 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 41.08 3iv8 h LEU 181 CO 0.03 1.14 -0.02 0.58 0.09 0.00 0.00 178.44 180.26 3iv8 h VAL 182 N 0.56 1.27 -0.99 1.22 2.07 -1.22 0.55 116.25 119.71 3iv8 h VAL 182 Ca 0.05 -0.95 0.05 0.00 0.82 0.00 0.00 66.70 66.68 3iv8 h VAL 182 Cb 0.90 1.44 -0.06 0.00 -1.52 0.00 0.00 31.29 32.05 3iv8 h VAL 182 CO 0.08 0.29 0.64 0.50 0.02 0.00 0.00 177.57 179.10 3iv8 h LYS 183 N 0.16 1.16 0.00 1.57 3.64 -1.25 0.11 116.57 121.96 3iv8 h LYS 183 Ca 0.06 -0.07 0.00 0.00 -1.27 0.00 0.00 60.65 59.37 3iv8 h LYS 183 Cb 0.44 -0.26 0.00 0.00 -0.41 0.00 0.00 32.23 32.00 3iv8 h LYS 183 CO 0.02 0.77 0.00 0.00 -2.27 0.00 0.00 179.45 177.96 3iv8 n ALA 184 N -2.37 1.27 -1.09 5.00 0.00 0.35 -4.86 120.51 118.81 3iv8 n ALA 184 Ca 0.14 0.06 0.00 0.00 0.00 0.00 0.00 53.44 53.64 3iv8 n ALA 184 Cb 0.15 -1.20 0.00 0.00 0.00 0.00 0.00 19.45 18.39 3iv8 n ALA 184 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3iv8 n GLY 185 N -0.87 1.11 3.59 0.00 0.00 0.40 -4.80 105.19 104.62 3iv8 n GLY 185 Ca 0.01 -0.47 -0.33 0.00 0.00 0.00 0.00 46.02 45.22 3iv8 n GLY 185 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3iv8 s ILE 186 N -2.04 3.69 -0.04 -0.61 1.01 0.10 -4.96 121.20 118.35 3iv8 s ILE 186 Ca 0.00 -0.55 -0.30 0.00 0.00 0.00 0.00 60.65 59.80 3iv8 s ILE 186 Cb 0.00 -2.53 -0.03 0.00 0.01 0.00 0.00 42.46 39.91 3iv8 s ILE 186 CO 0.00 0.55 1.07 -0.69 0.00 0.00 0.00 174.94 175.86 3iv8 s VAL 187 N -0.86 4.58 -0.14 2.92 1.01 -0.64 -3.86 120.40 123.41 3iv8 s VAL 187 Ca 0.14 1.86 -0.04 0.00 0.00 0.00 0.00 61.98 63.94 3iv8 s VAL 187 Cb -0.11 -4.20 -0.03 0.00 0.00 0.00 0.00 36.38 32.04 3iv8 s VAL 187 CO 0.03 0.07 -0.01 -0.69 0.00 0.00 0.00 175.10 174.50 3iv8 s VAL 188 N 1.58 4.18 -0.01 2.92 1.01 -1.26 -0.88 120.40 127.94 3iv8 s VAL 188 Ca 0.53 -0.27 0.04 0.00 0.00 0.00 0.00 61.98 62.28 3iv8 s VAL 188 Cb -0.22 -2.82 -0.01 0.00 0.00 0.00 0.00 36.38 33.33 3iv8 s VAL 188 CO 0.24 0.53 -0.14 -0.55 0.00 0.00 0.00 175.10 175.17 3iv8 s SER 189 N -0.07 1.72 0.06 3.32 0.15 -0.36 -1.82 113.70 116.70 3iv8 s SER 189 Ca 0.03 -0.27 -0.23 0.00 0.70 0.00 0.00 55.95 56.19 3iv8 s SER 189 Cb -0.13 -0.23 -0.06 0.00 -1.71 0.00 0.00 66.02 63.89 3iv8 s SER 189 CO 0.02 0.17 0.69 -0.51 1.20 0.00 0.00 173.24 174.81 3iv8 s ILE 190 N -0.28 4.70 -0.16 6.45 2.07 -0.31 -0.86 121.20 132.82 3iv8 s ILE 190 Ca 0.04 1.48 -0.34 0.00 -1.41 0.00 0.00 60.65 60.42 3iv8 s ILE 190 Cb -0.06 -4.04 0.13 0.00 0.13 0.00 0.00 42.46 38.62 3iv8 s ILE 190 CO -0.00 0.44 1.18 -0.83 -1.91 0.00 0.00 174.94 173.82 3iv8 s GLY 191 N -0.47 -0.32 -1.17 1.50 0.00 -0.79 -1.54 107.32 104.53 3iv8 s GLY 191 Ca 0.34 1.47 -0.02 0.00 0.00 0.00 0.00 44.72 46.51 3iv8 s GLY 191 CO 0.21 0.48 0.94 1.42 0.00 0.00 0.00 173.10 176.15 3iv8 n HIS 192 N -0.13 -2.22 -3.96 1.90 8.25 -0.54 -3.52 115.22 114.99 3iv8 n HIS 192 Ca -0.01 0.89 -0.09 0.00 -0.26 0.00 0.00 57.72 58.25 3iv8 n HIS 192 Cb 0.59 -4.72 -0.11 0.00 1.12 0.00 0.00 29.99 26.87 3iv8 n HIS 192 CO 0.00 0.00 0.00 -0.08 0.64 0.00 0.00 176.34 176.90 3iv8 s THR 193 N -3.41 0.10 -0.22 1.59 -1.32 -0.92 -1.45 115.64 110.01 3iv8 s THR 193 Ca 0.13 -0.85 0.13 0.00 -1.21 0.00 0.00 61.69 59.89 3iv8 s THR 193 Cb -0.02 -0.27 0.48 0.00 -1.51 0.00 0.00 72.50 71.18 3iv8 s THR 193 CO 0.75 -0.47 1.38 0.59 -2.21 0.00 0.00 174.62 174.66 3iv8 n ASN 194 N 1.65 2.91 -4.62 8.08 5.03 -1.26 -3.63 115.26 123.41 3iv8 n ASN 194 Ca -0.23 -3.41 -0.41 0.00 0.87 0.00 0.00 54.58 51.40 3iv8 n ASN 194 Cb 0.55 -0.56 0.01 0.00 -1.02 0.00 0.00 39.78 38.76 3iv8 n ASN 194 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 3iv8 n ALA 195 N -0.96 0.35 -1.49 5.41 0.00 -1.26 -4.91 120.51 117.65 3iv8 n ALA 195 Ca 0.25 0.23 -0.29 0.00 0.00 0.00 0.00 53.44 53.63 3iv8 n ALA 195 Cb 0.90 -2.11 0.16 0.00 0.00 0.00 0.00 19.45 18.40 3iv8 n ALA 195 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 3iv8 s THR 196 N -1.27 1.94 0.16 0.00 -4.23 -1.26 -3.96 115.64 107.02 3iv8 s THR 196 Ca 0.63 0.00 -0.23 0.00 -1.18 0.00 0.00 61.69 60.91 3iv8 s THR 196 Cb -0.55 -2.72 0.04 0.00 1.34 0.00 0.00 72.50 70.61 3iv8 s THR 196 CO 0.57 0.00 1.61 0.22 -0.54 0.00 0.00 174.62 176.47 3iv8 h TYR 197 N -1.70 -0.84 -0.92 3.99 3.20 -1.89 -0.53 116.97 118.27 3iv8 h TYR 197 Ca -0.49 0.05 0.03 0.00 3.14 0.00 0.00 58.73 61.45 3iv8 h TYR 197 Cb 1.32 0.41 -0.05 0.00 1.54 0.00 0.00 36.73 39.95 3iv8 h TYR 197 CO -0.21 -0.37 0.61 1.03 -1.64 0.00 0.00 178.16 177.57 3iv8 h SER 198 N -0.28 1.02 -0.21 -2.11 0.87 -1.92 0.20 113.55 111.11 3iv8 h SER 198 Ca 0.15 -0.01 -0.12 0.00 -1.23 0.00 0.00 61.79 60.58 3iv8 h SER 198 Cb 0.52 -0.24 -0.01 0.00 -0.44 0.00 0.00 62.40 62.23 3iv8 h SER 198 CO -0.46 0.71 -0.26 -0.33 -0.53 0.00 0.00 176.83 175.96 3iv8 h GLU 199 N 1.20 0.69 -0.41 2.24 5.08 -1.88 -2.13 114.58 119.37 3iv8 h GLU 199 Ca 0.36 -0.29 -0.15 0.00 -1.00 0.00 0.00 59.36 58.28 3iv8 h GLU 199 Cb -0.05 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.17 3iv8 h GLU 199 CO -0.10 0.88 -0.35 0.00 -1.00 0.00 0.00 179.01 178.44 3iv8 h ALA 200 N 1.11 0.60 -0.12 3.43 0.00 0.43 -1.57 119.26 123.15 3iv8 h ALA 200 Ca 0.08 -0.44 -0.01 0.00 0.00 0.00 0.00 54.91 54.54 3iv8 h ALA 200 Cb 0.75 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.41 3iv8 h ALA 200 CO 0.06 0.68 0.05 0.00 0.00 0.00 0.00 179.25 180.04 3iv8 h ARG 201 N 0.79 0.17 -0.85 0.00 2.47 -0.63 -1.73 114.38 114.60 3iv8 h ARG 201 Ca 0.07 -0.03 0.17 0.00 -1.26 0.00 0.00 59.98 58.93 3iv8 h ARG 201 Cb 0.94 -0.03 -0.11 0.00 -1.65 0.00 0.00 29.97 29.13 3iv8 h ARG 201 CO 0.09 0.28 0.40 -0.22 0.56 0.00 0.00 179.97 181.07 3iv8 h LYS 202 N 0.03 0.49 -0.24 0.04 3.11 -1.30 -1.40 116.57 117.31 3iv8 h LYS 202 Ca 0.04 -0.03 -0.10 0.00 -2.81 0.00 0.00 60.65 57.75 3iv8 h LYS 202 Cb 0.17 -0.11 -0.01 0.00 -1.00 0.00 0.00 32.23 31.27 3iv8 h LYS 202 CO -0.00 0.33 -0.28 0.66 -2.81 0.00 0.00 179.45 177.34 3iv8 h SER 203 N 0.51 0.47 -0.52 4.20 4.64 -0.89 -2.34 113.55 119.62 3iv8 h SER 203 Ca 0.49 -0.17 -0.06 0.00 -0.47 0.00 0.00 61.79 61.58 3iv8 h SER 203 Cb 0.80 -0.13 -0.02 0.00 -0.31 0.00 0.00 62.40 62.74 3iv8 h SER 203 CO -0.43 0.74 0.10 -0.26 -0.87 0.00 0.00 176.83 176.10 3iv8 h PHE 204 N 0.41 0.95 0.00 4.77 0.04 -0.39 -1.61 116.94 121.11 3iv8 h PHE 204 Ca 0.06 -0.11 -0.03 0.00 2.80 0.00 0.00 57.97 60.68 3iv8 h PHE 204 Cb 0.70 -0.27 -0.00 0.00 2.20 0.00 0.00 35.95 38.58 3iv8 h PHE 204 CO 0.02 0.81 -0.16 0.93 -0.60 0.00 0.00 178.31 179.32 3iv8 h GLU 205 N 0.86 0.00 0.00 1.51 5.08 -0.98 -1.34 114.58 119.71 3iv8 h GLU 205 Ca 0.18 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.54 3iv8 h GLU 205 Cb 0.37 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.62 3iv8 h GLU 205 CO 0.01 0.16 0.00 0.77 -1.00 0.00 0.00 179.01 178.94 3iv8 h SER 206 N 0.00 0.00 0.00 1.42 0.02 -1.00 -3.48 113.55 110.51 3iv8 h SER 206 Ca -0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 3iv8 h SER 206 Cb 0.30 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.84 3iv8 h SER 206 CO 0.02 0.00 0.00 0.61 -1.14 0.00 0.00 176.83 176.32 3iv8 n GLY 207 N 1.08 0.11 3.72 -3.77 0.00 -0.51 -3.86 105.19 101.97 3iv8 n GLY 207 Ca 0.05 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.64 3iv8 n GLY 207 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 3iv8 n ILE 208 N 0.00 0.26 -0.77 -0.61 5.41 -0.88 -4.69 119.36 118.08 3iv8 n ILE 208 Ca 0.00 -0.06 0.00 0.00 1.00 0.00 0.00 62.75 63.69 3iv8 n ILE 208 Cb 0.00 -1.94 0.00 0.00 -0.71 0.00 0.00 39.64 36.99 3iv8 n ILE 208 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 176.55 176.90 3iv8 n THR 209 N 3.46 0.36 -3.85 1.39 -2.24 -0.76 -4.39 114.28 108.25 3iv8 n THR 209 Ca 0.14 -0.37 -0.11 0.00 -2.27 0.00 0.00 64.05 61.45 3iv8 n THR 209 Cb 0.35 0.78 -0.09 0.00 -2.10 0.00 0.00 70.33 69.27 3iv8 n THR 209 CO 0.00 0.00 0.00 0.12 -0.57 0.00 0.00 175.07 174.62 3iv8 s PHE 210 N -0.39 0.04 -0.08 4.78 5.36 -1.17 -1.56 117.98 124.97 3iv8 s PHE 210 Ca 0.01 -0.22 0.01 0.00 -0.96 0.00 0.00 56.93 55.78 3iv8 s PHE 210 Cb 0.01 -0.03 0.02 0.00 -0.34 0.00 0.00 43.02 42.67 3iv8 s PHE 210 CO 0.00 -0.39 -0.11 0.00 -1.46 0.00 0.00 175.22 173.27 3iv8 s ALA 211 N -2.19 1.27 -0.09 11.12 0.00 0.78 -1.16 121.76 131.50 3iv8 s ALA 211 Ca -0.08 -0.45 -0.25 0.00 0.00 0.00 0.00 51.96 51.17 3iv8 s ALA 211 Cb -0.03 -0.68 -0.03 0.00 0.00 0.00 0.00 23.12 22.38 3iv8 s ALA 211 CO -0.02 -0.07 0.81 0.99 0.00 0.00 0.00 175.76 177.47 3iv8 s THR 212 N 1.02 4.95 -0.04 0.00 2.01 -0.59 -0.92 115.64 122.07 3iv8 s THR 212 Ca -0.08 1.64 -0.04 0.00 0.31 0.00 0.00 61.69 63.53 3iv8 s THR 212 Cb -0.15 -4.13 0.01 0.00 0.01 0.00 0.00 72.50 68.23 3iv8 s THR 212 CO -0.01 0.15 0.06 0.00 -0.69 0.00 0.00 174.62 174.14 3iv8 n HIS 213 N 4.32 -0.25 -1.57 4.92 1.44 -1.24 -4.79 115.22 118.05 3iv8 n HIS 213 Ca 0.02 0.10 -0.47 0.00 -2.01 0.00 0.00 57.72 55.37 3iv8 n HIS 213 Cb 0.50 -0.31 -0.03 0.00 0.12 0.00 0.00 29.99 30.27 3iv8 n HIS 213 CO 0.00 0.00 0.00 -0.11 -2.81 0.00 0.00 176.34 173.42 3iv8 n LEU 214 N 0.42 1.48 0.00 2.39 7.94 0.17 -2.07 117.00 127.33 3iv8 n LEU 214 Ca -0.01 1.16 0.00 0.00 -1.11 0.00 0.00 56.01 56.05 3iv8 n LEU 214 Cb 0.14 -1.23 0.00 0.00 0.53 0.00 0.00 43.42 42.86 3iv8 n LEU 214 CO 0.05 -1.43 0.00 0.49 -1.11 0.00 0.00 177.39 175.39 3iv8 n PHE 215 N 0.93 0.00 -2.88 1.96 3.72 -1.26 -4.85 117.46 115.08 3iv8 n PHE 215 Ca 0.13 0.00 -0.41 0.00 -0.05 0.00 0.00 57.45 57.12 3iv8 n PHE 215 Cb 0.27 0.00 -0.04 0.00 -0.94 0.00 0.00 39.48 38.78 3iv8 n PHE 215 CO 0.00 0.00 0.00 -0.80 -0.05 0.00 0.00 176.76 175.91 3iv8 s ASN 216 N 0.15 7.13 -1.41 4.37 0.02 -0.88 -4.21 114.94 120.11 3iv8 s ASN 216 Ca 0.00 1.37 -0.08 0.00 -1.02 0.00 0.00 52.86 53.13 3iv8 s ASN 216 Cb 0.00 -2.48 0.04 0.00 0.02 0.00 0.00 41.25 38.83 3iv8 s ASN 216 CO 0.00 -0.22 0.96 0.00 0.02 0.00 0.00 177.10 177.86 3iv8 n ALA 217 N 4.09 -1.53 -2.93 0.60 0.00 -1.26 -4.67 120.51 114.81 3iv8 n ALA 217 Ca 0.03 0.13 -0.11 0.00 0.00 0.00 0.00 53.44 53.49 3iv8 n ALA 217 Cb 0.51 -3.93 -0.06 0.00 0.00 0.00 0.00 19.45 15.97 3iv8 n ALA 217 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3iv8 s MET 218 N -6.29 1.59 0.08 0.00 0.23 -1.26 -1.47 119.30 112.18 3iv8 s MET 218 Ca 0.43 -1.46 -0.30 0.00 -1.03 0.00 0.00 55.69 53.33 3iv8 s MET 218 Cb -0.21 0.43 -0.05 0.00 -1.53 0.00 0.00 34.83 33.47 3iv8 s MET 218 CO 0.80 -0.64 1.06 0.99 -2.03 0.00 0.00 175.02 175.20 3iv8 s THR 219 N -3.76 4.35 0.75 3.16 2.01 -1.24 -4.94 115.64 115.96 3iv8 s THR 219 Ca 0.28 1.80 -0.06 0.00 0.31 0.00 0.00 61.69 64.01 3iv8 s THR 219 Cb 0.01 -4.15 0.10 0.00 0.01 0.00 0.00 72.50 68.47 3iv8 s THR 219 CO 0.13 0.20 1.05 -2.16 -0.69 0.00 0.00 174.62 173.15 3iv8 s PRO 220 N 0.54 1.80 -0.56 4.92 0.04 -1.26 -1.94 135.00 138.53 3iv8 s PRO 220 Ca 0.52 -0.54 -0.23 0.00 0.04 0.00 0.00 61.00 60.79 3iv8 s PRO 220 Cb -0.26 -2.17 0.05 0.00 0.04 0.00 0.00 34.50 32.16 3iv8 s PRO 220 CO 0.30 -1.47 0.86 1.41 0.04 0.00 0.00 177.00 178.14 3iv8 s MET 221 N -5.30 3.24 0.37 4.56 -2.45 -1.17 -3.68 119.30 114.86 3iv8 s MET 221 Ca 0.64 -0.53 0.08 0.00 -1.25 0.00 0.00 55.69 54.63 3iv8 s MET 221 Cb -0.08 -4.10 -0.07 0.00 1.25 0.00 0.00 34.83 31.84 3iv8 s MET 221 CO 0.46 -1.48 -0.01 0.14 1.05 0.00 0.00 175.02 175.18 3iv8 s VAL 222 N 3.62 2.24 0.16 10.11 -7.23 -0.41 -4.95 120.40 123.94 3iv8 s VAL 222 Ca 0.25 -2.03 -0.27 0.00 -1.81 0.00 0.00 61.98 58.12 3iv8 s VAL 222 Cb -0.15 -2.84 0.01 0.00 0.56 0.00 0.00 36.38 33.96 3iv8 s VAL 222 CO 0.16 -0.11 1.56 1.23 -0.31 0.00 0.00 175.10 177.63 3iv8 h GLY 223 N 1.83 -0.57 -1.45 2.32 0.00 -1.98 -1.06 103.07 102.15 3iv8 h GLY 223 Ca -0.43 0.60 0.00 0.00 0.00 0.00 0.00 47.33 47.50 3iv8 h GLY 223 CO 0.73 -0.15 0.00 0.54 0.00 0.00 0.00 176.54 177.66 3iv8 n ARG 224 N -5.40 2.11 -3.48 4.80 1.74 -1.26 -4.69 116.66 110.48 3iv8 n ARG 224 Ca 0.01 -1.62 -0.29 0.00 -0.77 0.00 0.00 57.85 55.18 3iv8 n ARG 224 Cb 0.35 -1.47 -0.12 0.00 -1.02 0.00 0.00 32.46 30.20 3iv8 n ARG 224 CO 0.00 0.00 0.00 -2.00 -1.52 0.00 0.00 177.63 174.11 3iv8 s GLU 225 N -1.96 0.65 0.53 5.56 2.56 -0.40 -5.00 118.70 120.64 3iv8 s GLU 225 Ca 0.32 -1.46 0.24 0.00 0.00 0.00 0.00 54.97 54.07 3iv8 s GLU 225 Cb 0.20 -1.42 1.39 0.00 2.00 0.00 0.00 34.13 36.30 3iv8 s GLU 225 CO 0.31 -1.22 2.03 -1.35 -0.56 0.00 0.00 175.26 174.47 3iv8 h PRO 226 N 6.89 0.00 0.00 4.30 0.11 -1.81 -1.09 132.00 140.40 3iv8 h PRO 226 Ca 0.07 0.00 0.07 0.00 0.11 0.00 0.00 66.00 66.25 3iv8 h PRO 226 Cb 0.96 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.05 3iv8 h PRO 226 CO 0.29 0.00 -0.09 0.41 -0.21 0.00 0.00 178.00 178.40 3iv8 n GLY 227 N -1.61 -1.75 0.15 -0.55 0.00 -1.24 -0.39 105.19 99.79 3iv8 n GLY 227 Ca 0.07 -1.27 -0.09 0.00 0.00 0.00 0.00 46.02 44.73 3iv8 n GLY 227 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 3iv8 h VAL 228 N -0.23 1.11 0.03 1.61 2.07 -1.60 -0.15 116.25 119.09 3iv8 h VAL 228 Ca 0.01 -0.25 0.03 0.00 0.82 0.00 0.00 66.70 67.31 3iv8 h VAL 228 Cb 0.23 0.70 -0.05 0.00 -1.52 0.00 0.00 31.29 30.65 3iv8 h VAL 228 CO 0.00 0.11 -0.30 0.58 0.02 0.00 0.00 177.57 177.98 3iv8 h VAL 229 N 0.41 0.34 -0.66 2.57 2.07 -1.54 -0.14 116.25 119.30 3iv8 h VAL 229 Ca 0.11 0.00 0.09 0.00 0.82 0.00 0.00 66.70 67.72 3iv8 h VAL 229 Cb 0.00 0.34 -0.07 0.00 -1.52 0.00 0.00 31.29 30.04 3iv8 h VAL 229 CO -0.02 0.00 0.31 1.23 0.02 0.00 0.00 177.57 179.11 3iv8 h GLY 230 N -0.47 0.97 1.65 2.17 0.00 -0.51 -0.27 103.07 106.62 3iv8 h GLY 230 Ca 0.05 -0.19 -0.05 0.00 0.00 0.00 0.00 47.33 47.15 3iv8 h GLY 230 CO -0.23 0.04 -0.02 0.00 0.00 0.00 0.00 176.54 176.33 3iv8 h ALA 231 N 1.41 1.44 -0.35 3.60 0.00 -0.13 0.20 119.26 125.43 3iv8 h ALA 231 Ca 0.33 -0.19 -0.08 0.00 0.00 0.00 0.00 54.91 54.97 3iv8 h ALA 231 Cb 0.35 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 3iv8 h ALA 231 CO -0.27 0.39 -0.08 0.82 0.00 0.00 0.00 179.25 180.12 3iv8 h ILE 232 N 0.42 1.28 0.00 0.00 2.04 0.02 -2.52 117.51 118.75 3iv8 h ILE 232 Ca 0.09 -1.13 -0.04 0.00 1.00 0.00 0.00 64.86 64.78 3iv8 h ILE 232 Cb 0.31 1.29 -0.01 0.00 -0.74 0.00 0.00 36.82 37.67 3iv8 h ILE 232 CO 0.01 0.37 -0.17 1.88 0.00 0.00 0.00 178.15 180.24 3iv8 h TYR 233 N 0.47 0.00 -0.02 1.37 0.99 -0.01 -2.68 116.97 117.10 3iv8 h TYR 233 Ca 0.09 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.82 3iv8 h TYR 233 Cb 0.58 0.00 0.00 0.00 1.00 0.00 0.00 36.73 38.31 3iv8 h TYR 233 CO 0.05 0.17 -0.08 -3.47 -0.00 0.00 0.00 178.16 174.83 3iv8 n ASP 234 N -3.99 1.69 -4.00 3.88 2.03 0.61 -4.83 116.55 111.93 3iv8 n ASP 234 Ca -0.02 -1.47 -0.31 0.00 0.52 0.00 0.00 54.79 53.51 3iv8 n ASP 234 Cb 0.26 0.05 -0.15 0.00 -0.72 0.00 0.00 41.12 40.56 3iv8 n ASP 234 CO 0.00 0.00 0.00 -0.89 -1.92 0.00 0.00 177.20 174.39 3iv8 s THR 235 N -2.12 2.06 0.48 5.18 2.01 -0.97 -5.01 115.64 117.26 3iv8 s THR 235 Ca 0.33 -1.95 0.18 0.00 0.31 0.00 0.00 61.69 60.56 3iv8 s THR 235 Cb 0.20 -2.39 0.34 0.00 0.01 0.00 0.00 72.50 70.66 3iv8 s THR 235 CO 0.38 -0.39 2.02 -0.65 -0.69 0.00 0.00 174.62 175.29 3iv8 h PRO 236 N 7.73 0.19 0.00 4.92 0.11 -1.88 -2.70 132.00 140.37 3iv8 h PRO 236 Ca -0.11 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.99 3iv8 h PRO 236 Cb 1.03 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.10 3iv8 h PRO 236 CO 0.49 0.13 -0.21 0.39 -0.21 0.00 0.00 178.00 178.58 3iv8 n GLU 237 N -4.45 0.12 -3.23 1.05 4.71 -1.26 -4.87 120.64 112.71 3iv8 n GLU 237 Ca 0.07 0.07 -0.39 0.00 -0.01 0.00 0.00 57.16 56.90 3iv8 n GLU 237 Cb 0.40 -1.61 -0.07 0.00 -1.01 0.00 0.00 31.44 29.15 3iv8 n GLU 237 CO 0.00 0.00 0.00 0.08 0.09 0.00 0.00 177.13 177.30 3iv8 s VAL 238 N -3.06 5.09 0.35 2.62 1.01 -1.02 -4.84 120.40 120.55 3iv8 s VAL 238 Ca 0.11 0.96 -0.17 0.00 0.00 0.00 0.00 61.98 62.87 3iv8 s VAL 238 Cb 0.16 -3.85 -0.10 0.00 0.00 0.00 0.00 36.38 32.60 3iv8 s VAL 238 CO 0.62 0.15 0.80 -0.31 0.00 0.00 0.00 175.10 176.36 3iv8 s TYR 239 N 1.81 3.38 -0.04 5.22 2.02 -0.60 -4.92 117.35 124.23 3iv8 s TYR 239 Ca 0.24 1.36 0.04 0.00 -0.37 0.00 0.00 57.07 58.33 3iv8 s TYR 239 Cb -0.15 -2.64 -0.00 0.00 -0.40 0.00 0.00 41.96 38.76 3iv8 s TYR 239 CO 0.09 0.05 -0.14 0.00 -1.57 0.00 0.00 175.55 173.99 3iv8 s ALA 240 N -2.00 1.28 0.15 3.71 0.00 0.02 -0.16 121.76 124.76 3iv8 s ALA 240 Ca 0.56 -0.55 -0.14 0.00 0.00 0.00 0.00 51.96 51.82 3iv8 s ALA 240 Cb -0.11 -0.44 -0.07 0.00 0.00 0.00 0.00 23.12 22.51 3iv8 s ALA 240 CO 0.17 0.22 0.55 0.20 0.00 0.00 0.00 175.76 176.90 3iv8 s GLY 241 N 0.11 2.45 -0.07 0.00 0.00 -0.09 -0.13 107.32 109.59 3iv8 s GLY 241 Ca -0.04 -0.13 -0.05 0.00 0.00 0.00 0.00 44.72 44.50 3iv8 s GLY 241 CO 0.02 0.14 0.17 -1.50 0.00 0.00 0.00 173.10 171.92 3iv8 s ILE 242 N -1.49 -0.02 -0.47 0.90 2.07 0.33 0.43 121.20 122.95 3iv8 s ILE 242 Ca 0.39 0.06 -0.18 0.00 -1.41 0.00 0.00 60.65 59.50 3iv8 s ILE 242 Cb -0.15 -0.25 0.05 0.00 0.13 0.00 0.00 42.46 42.24 3iv8 s ILE 242 CO 0.19 0.02 0.54 -0.63 -1.91 0.00 0.00 174.94 173.16 3iv8 s ILE 243 N 0.46 4.97 -1.15 2.00 1.01 -1.26 -2.02 121.20 125.22 3iv8 s ILE 243 Ca -0.03 -0.46 -0.05 0.00 0.00 0.00 0.00 60.65 60.11 3iv8 s ILE 243 Cb -0.05 -4.19 0.25 0.00 0.01 0.00 0.00 42.46 38.49 3iv8 s ILE 243 CO -0.02 -0.65 1.79 0.00 0.00 0.00 0.00 174.94 176.06 3iv8 n ALA 244 N 5.90 5.71 0.64 9.38 0.00 -1.26 -4.27 120.51 136.59 3iv8 n ALA 244 Ca -0.07 -4.55 0.07 0.00 0.00 0.00 0.00 53.44 48.89 3iv8 n ALA 244 Cb 0.46 -2.50 -0.05 0.00 0.00 0.00 0.00 19.45 17.36 3iv8 n ALA 244 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 3iv8 n ASP 245 N 1.53 0.95 0.00 0.00 5.75 -1.26 -4.57 116.55 118.95 3iv8 n ASP 245 Ca 0.40 -0.97 0.00 0.00 -0.01 0.00 0.00 54.79 54.20 3iv8 n ASP 245 Cb 0.31 0.81 0.00 0.00 -1.03 0.00 0.00 41.12 41.20 3iv8 n ASP 245 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3iv8 n GLY 246 N 1.23 3.23 0.15 6.12 0.00 -1.26 -4.87 105.19 109.79 3iv8 n GLY 246 Ca 0.04 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.88 3iv8 n GLY 246 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3iv8 n PHE 247 N -2.00 0.00 -0.23 1.61 3.72 -1.26 -4.64 117.46 114.67 3iv8 n PHE 247 Ca 0.00 0.00 -0.07 0.00 -0.05 0.00 0.00 57.45 57.33 3iv8 n PHE 247 Cb 0.00 -0.83 0.03 0.00 -0.94 0.00 0.00 39.48 37.75 3iv8 n PHE 247 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 3iv8 h HIS 248 N -0.20 1.00 -3.25 1.38 3.86 -1.89 -3.44 115.15 112.61 3iv8 h HIS 248 Ca -0.51 -0.09 -0.27 0.00 -1.16 0.00 0.00 60.37 58.34 3iv8 h HIS 248 Cb 1.69 -0.29 -0.33 0.00 1.06 0.00 0.00 27.41 29.53 3iv8 h HIS 248 CO 0.00 0.81 -0.63 0.08 0.86 0.00 0.00 177.93 179.06 3iv8 s VAL 249 N -5.44 -0.10 0.25 2.45 1.01 -1.26 -4.88 120.40 112.43 3iv8 s VAL 249 Ca -0.13 0.23 -0.31 0.00 0.00 0.00 0.00 61.98 61.77 3iv8 s VAL 249 Cb 0.13 -0.23 -0.13 0.00 0.00 0.00 0.00 36.38 36.16 3iv8 s VAL 249 CO 0.81 0.10 1.51 -0.67 0.00 0.00 0.00 175.10 176.85 3iv8 n ASP 250 N 4.48 3.27 -0.18 3.32 -0.08 -1.26 -4.45 116.55 121.65 3iv8 n ASP 250 Ca -0.21 1.13 0.16 0.00 -1.51 0.00 0.00 54.79 54.36 3iv8 n ASP 250 Cb 0.51 -1.50 0.51 0.00 2.34 0.00 0.00 41.12 42.98 3iv8 n ASP 250 CO 0.00 0.00 0.00 1.88 0.12 0.00 0.00 177.20 179.20 3iv8 h TYR 251 N 4.74 0.50 0.00 -0.67 0.05 -1.94 -0.57 116.97 119.08 3iv8 h TYR 251 Ca -0.46 0.01 -0.06 0.00 0.05 0.00 0.00 58.73 58.28 3iv8 h TYR 251 Cb 1.25 -0.16 -0.01 0.00 1.01 0.00 0.00 36.73 38.83 3iv8 h TYR 251 CO 0.58 0.18 -0.27 0.00 -1.05 0.00 0.00 178.16 177.60 3iv8 h ALA 252 N 1.63 1.36 0.00 3.88 0.00 -1.90 -1.36 119.26 122.87 3iv8 h ALA 252 Ca 0.39 -0.24 -0.09 0.00 0.00 0.00 0.00 54.91 54.97 3iv8 h ALA 252 Cb 0.93 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.66 3iv8 h ALA 252 CO -0.13 0.34 -0.42 -0.91 0.00 0.00 0.00 179.25 178.13 3iv8 h ASN 253 N 0.00 0.00 0.09 0.00 2.35 -1.47 -0.09 115.58 116.46 3iv8 h ASN 253 Ca -0.00 0.00 -0.25 0.00 -0.55 0.00 0.00 56.30 55.50 3iv8 h ASN 253 Cb 0.54 0.00 0.02 0.00 0.05 0.00 0.00 38.32 38.94 3iv8 h ASN 253 CO 0.03 0.42 -1.03 0.40 -1.65 0.00 0.00 177.43 175.60 3iv8 h ILE 254 N 0.00 1.35 -0.11 2.81 2.04 -1.29 -0.38 117.51 121.93 3iv8 h ILE 254 Ca -0.00 -2.37 0.04 0.00 1.00 0.00 0.00 64.86 63.52 3iv8 h ILE 254 Cb 0.97 2.73 -0.05 0.00 -0.74 0.00 0.00 36.82 39.73 3iv8 h ILE 254 CO 0.05 0.71 -0.21 -0.09 0.00 0.00 0.00 178.15 178.62 3iv8 h ARG 255 N 0.10 -0.26 -0.86 2.37 2.43 -1.00 -1.15 114.38 116.02 3iv8 h ARG 255 Ca -0.15 0.02 -0.00 0.00 -0.81 0.00 0.00 59.98 59.03 3iv8 h ARG 255 Cb 1.73 0.06 -0.04 0.00 -0.42 0.00 0.00 29.97 31.30 3iv8 h ARG 255 CO 0.20 -0.17 0.52 0.82 -1.51 0.00 0.00 179.97 179.82 3iv8 h ILE 256 N -0.27 1.24 0.00 1.20 2.04 -1.02 -2.18 117.51 118.52 3iv8 h ILE 256 Ca 0.09 -0.52 -0.09 0.00 1.00 0.00 0.00 64.86 65.35 3iv8 h ILE 256 Cb 0.41 0.03 -0.01 0.00 -0.74 0.00 0.00 36.82 36.51 3iv8 h ILE 256 CO -0.27 0.25 -0.41 0.00 0.00 0.00 0.00 178.15 177.72 3iv8 h ALA 257 N 1.28 1.31 -0.30 1.87 0.00 -0.43 -2.58 119.26 120.41 3iv8 h ALA 257 Ca 0.31 -0.37 -0.15 0.00 0.00 0.00 0.00 54.91 54.70 3iv8 h ALA 257 Cb -0.05 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 17.67 3iv8 h ALA 257 CO -0.06 0.51 -0.39 1.25 0.00 0.00 0.00 179.25 180.57 3iv8 h HIS 258 N 0.00 0.96 -0.42 0.00 -0.00 -0.60 -0.54 115.15 114.55 3iv8 h HIS 258 Ca -0.00 -0.31 0.05 0.00 -0.00 0.00 0.00 60.37 60.11 3iv8 h HIS 258 Cb 0.73 -0.19 -0.02 0.00 -0.00 0.00 0.00 27.41 27.92 3iv8 h HIS 258 CO 0.00 1.10 0.28 0.87 -0.00 0.00 0.00 177.93 180.18 3iv8 h LYS 259 N 0.55 0.35 0.12 5.26 1.79 -1.13 0.11 116.57 123.61 3iv8 h LYS 259 Ca 0.04 -0.02 -0.24 0.00 -2.18 0.00 0.00 60.65 58.24 3iv8 h LYS 259 Cb 0.98 -0.08 0.00 0.00 -1.58 0.00 0.00 32.23 31.55 3iv8 h LYS 259 CO 0.09 0.23 -1.21 0.82 -1.08 0.00 0.00 179.45 178.30 3iv8 h ILE 260 N 0.36 1.19 0.00 1.86 2.04 -1.23 -3.40 117.51 118.33 3iv8 h ILE 260 Ca 0.18 -2.44 -0.06 0.00 1.00 0.00 0.00 64.86 63.53 3iv8 h ILE 260 Cb 0.26 2.87 -0.01 0.00 -0.74 0.00 0.00 36.82 39.20 3iv8 h ILE 260 CO -0.04 0.70 -1.78 0.29 0.00 0.00 0.00 178.15 177.32 3iv8 n LYS 261 N -4.00 0.65 0.00 2.37 4.76 -0.24 -5.03 118.16 116.67 3iv8 n LYS 261 Ca -0.21 -0.07 0.00 0.00 -2.87 0.00 0.00 58.31 55.16 3iv8 n LYS 261 Cb 0.87 -1.61 0.00 0.00 -1.84 0.00 0.00 35.03 32.45 3iv8 n LYS 261 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3iv8 n GLY 262 N 1.32 2.66 0.39 0.72 0.00 0.36 -1.18 105.19 109.46 3iv8 n GLY 262 Ca -0.07 0.29 0.17 0.00 0.00 0.00 0.00 46.02 46.41 3iv8 n GLY 262 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3iv8 h GLU 263 N 0.00 0.00 -0.00 1.61 5.08 -1.96 -2.12 114.58 117.19 3iv8 h GLU 263 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3iv8 h GLU 263 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 3iv8 h GLU 263 CO 0.00 0.00 -0.18 1.63 -1.00 0.00 0.00 179.01 179.46 3iv8 n LYS 264 N -3.14 0.36 -3.21 2.33 4.76 -0.32 -4.77 118.16 114.16 3iv8 n LYS 264 Ca 0.06 -0.13 -0.40 0.00 -2.87 0.00 0.00 58.31 54.97 3iv8 n LYS 264 Cb 0.79 -1.50 -0.07 0.00 -1.84 0.00 0.00 35.03 32.41 3iv8 n LYS 264 CO 0.00 0.00 0.00 -1.17 -1.37 0.00 0.00 177.40 174.86 3iv8 s LEU 265 N -2.73 4.12 -0.09 -0.35 0.20 -0.80 -0.80 118.68 118.23 3iv8 s LEU 265 Ca 0.21 0.67 0.02 0.00 0.69 0.00 0.00 54.13 55.71 3iv8 s LEU 265 Cb 0.19 -2.74 -0.02 0.00 -0.43 0.00 0.00 46.19 43.19 3iv8 s LEU 265 CO 0.54 -0.24 -0.13 -0.69 -0.29 0.00 0.00 176.35 175.55 3iv8 s VAL 266 N 1.92 3.10 -0.11 1.68 1.01 0.82 -4.74 120.40 124.07 3iv8 s VAL 266 Ca 0.24 -0.68 -0.30 0.00 0.00 0.00 0.00 61.98 61.25 3iv8 s VAL 266 Cb -0.16 -2.26 -0.02 0.00 0.00 0.00 0.00 36.38 33.95 3iv8 s VAL 266 CO 0.09 0.56 1.12 -0.76 0.00 0.00 0.00 175.10 176.11 3iv8 s LEU 267 N -0.19 4.24 0.11 3.92 1.02 -0.14 -0.52 118.68 127.11 3iv8 s LEU 267 Ca 0.00 1.65 0.08 0.00 0.02 0.00 0.00 54.13 55.88 3iv8 s LEU 267 Cb -0.13 -3.55 -0.04 0.00 0.02 0.00 0.00 46.19 42.49 3iv8 s LEU 267 CO 0.03 -0.57 -0.20 0.54 0.02 0.00 0.00 176.35 176.18 3iv8 s VAL 268 N 2.40 1.69 -0.17 -1.59 0.11 -0.86 -4.70 120.40 117.29 3iv8 s VAL 268 Ca 0.52 -1.60 -0.08 0.00 -2.93 0.00 0.00 61.98 57.89 3iv8 s VAL 268 Cb -0.21 -1.58 -0.22 0.00 -1.53 0.00 0.00 36.38 32.84 3iv8 s VAL 268 CO 0.18 -0.12 0.19 0.35 -3.33 0.00 0.00 175.10 172.37 3iv8 n THR 269 N 0.96 1.67 -3.93 5.04 -2.24 -1.26 -4.32 114.28 110.21 3iv8 n THR 269 Ca -0.18 -0.51 -0.29 0.00 -2.27 0.00 0.00 64.05 60.79 3iv8 n THR 269 Cb 0.54 -1.75 0.02 0.00 -2.10 0.00 0.00 70.33 67.04 3iv8 n THR 269 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 3iv8 n ASP 270 N -3.67 -3.82 -4.85 3.42 2.03 0.76 -4.62 116.55 105.81 3iv8 n ASP 270 Ca -0.36 -0.83 -0.32 0.00 0.52 0.00 0.00 54.79 53.80 3iv8 n ASP 270 Cb 0.96 -3.72 -0.02 0.00 -0.72 0.00 0.00 41.12 37.63 3iv8 n ASP 270 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3iv8 s ALA 271 N -3.39 3.07 0.42 -1.67 0.00 -1.25 -3.03 121.76 115.91 3iv8 s ALA 271 Ca 0.54 0.09 0.03 0.00 0.00 0.00 0.00 51.96 52.63 3iv8 s ALA 271 Cb -0.27 -3.11 -0.03 0.00 0.00 0.00 0.00 23.12 19.71 3iv8 s ALA 271 CO 0.84 -0.41 0.07 0.95 0.00 0.00 0.00 175.76 177.21 3iv8 s THR 272 N -2.81 0.98 0.10 0.00 -4.23 -0.59 -1.88 115.64 107.21 3iv8 s THR 272 Ca 0.58 -2.00 -0.06 0.00 -1.18 0.00 0.00 61.69 59.02 3iv8 s THR 272 Cb -0.10 -2.42 0.13 0.00 1.34 0.00 0.00 72.50 71.44 3iv8 s THR 272 CO 0.39 0.00 0.65 0.00 -0.54 0.00 0.00 174.62 175.12 3iv8 n ALA 273 N -0.98 -0.01 0.32 3.99 0.00 -1.24 -1.01 120.51 121.58 3iv8 n ALA 273 Ca -0.09 0.43 0.13 0.00 0.00 0.00 0.00 53.44 53.91 3iv8 n ALA 273 Cb 0.66 -0.21 0.59 0.00 0.00 0.00 0.00 19.45 20.49 3iv8 n ALA 273 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 3iv8 h PRO 274 N 0.00 0.00 -6.34 0.00 0.13 -1.88 0.17 132.00 124.08 3iv8 h PRO 274 Ca 0.16 0.00 -0.55 0.00 -0.87 0.00 0.00 66.00 64.74 3iv8 h PRO 274 Cb 0.26 0.00 0.02 0.00 0.13 0.00 0.00 31.00 31.41 3iv8 h PRO 274 CO -0.42 0.00 1.21 0.00 -0.23 0.00 0.00 178.00 178.56 3iv8 n ALA 275 N -1.84 1.44 -2.95 -0.56 0.00 -0.18 -1.86 120.51 114.55 3iv8 n ALA 275 Ca 0.01 0.23 -0.21 0.00 0.00 0.00 0.00 53.44 53.46 3iv8 n ALA 275 Cb 0.19 -2.65 0.02 0.00 0.00 0.00 0.00 19.45 17.00 3iv8 n ALA 275 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3iv8 n GLY 276 N 4.53 -0.51 3.90 0.00 0.00 -1.26 0.38 105.19 112.23 3iv8 n GLY 276 Ca 0.21 0.09 -0.29 0.00 0.00 0.00 0.00 46.02 46.03 3iv8 n GLY 276 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3iv8 s ALA 277 N -3.05 3.92 0.16 4.61 0.00 -0.77 -3.90 121.76 122.73 3iv8 s ALA 277 Ca 0.25 -0.94 -0.17 0.00 0.00 0.00 0.00 51.96 51.10 3iv8 s ALA 277 Cb -0.12 -1.74 0.10 0.00 0.00 0.00 0.00 23.12 21.37 3iv8 s ALA 277 CO 0.31 0.71 1.20 0.39 0.00 0.00 0.00 175.76 178.38 3iv8 n GLU 278 N 0.01 -0.24 -3.32 0.00 -0.58 -1.26 -5.01 120.64 110.24 3iv8 n GLU 278 Ca -0.06 1.19 0.03 0.00 -0.42 0.00 0.00 57.16 57.89 3iv8 n GLU 278 Cb 0.52 -1.76 -0.03 0.00 -0.57 0.00 0.00 31.44 29.60 3iv8 n GLU 278 CO 0.00 0.00 0.00 1.41 -0.48 0.00 0.00 177.13 178.06 3iv8 s MET 279 N -5.61 0.27 0.00 3.49 -2.45 -1.26 -5.20 119.30 108.53 3iv8 s MET 279 Ca -0.10 0.63 0.00 0.00 -1.25 0.00 0.00 55.69 54.97 3iv8 s MET 279 Cb 0.13 0.37 0.00 0.00 1.25 0.00 0.00 34.83 36.58 3iv8 s MET 279 CO 0.53 -0.15 0.00 -0.11 1.05 0.00 0.00 175.02 176.34 3iv8 n LEU 303 N 5.09 0.00 0.00 4.11 0.00 -1.26 -4.85 117.00 120.10 3iv8 n LEU 303 Ca -0.08 0.00 0.00 0.00 0.00 0.00 0.00 56.01 55.93 3iv8 n LEU 303 Cb 0.53 0.00 0.00 0.00 0.00 0.00 0.00 43.42 43.95 3iv8 n LEU 303 CO -0.05 0.00 0.00 0.61 0.00 0.00 0.00 177.39 177.95 3iv8 n GLY 304 N 0.00 1.14 0.00 -3.96 0.00 -1.26 -4.94 105.19 96.17 3iv8 n GLY 304 Ca 0.00 -0.62 0.00 0.00 0.00 0.00 0.00 46.02 45.40 3iv8 n GLY 304 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3iv8 n GLY 305 N 0.00 -1.66 3.90 -0.02 0.00 -1.26 -5.00 105.19 101.16 3iv8 n GLY 305 Ca 0.00 -1.09 -0.29 0.00 0.00 0.00 0.00 46.02 44.64 3iv8 n GLY 305 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3iv8 s SER 306 N -2.07 6.20 -0.21 1.61 1.04 -1.17 -4.97 113.70 114.14 3iv8 s SER 306 Ca 0.00 0.18 0.14 0.00 0.48 0.00 0.00 55.95 56.76 3iv8 s SER 306 Cb 0.00 -1.86 0.48 0.00 0.10 0.00 0.00 66.02 64.74 3iv8 s SER 306 CO 0.00 0.13 1.39 0.00 0.98 0.00 0.00 173.24 175.74 3iv8 n ALA 307 N 0.04 3.33 -1.78 5.32 0.00 -1.26 -1.54 120.51 124.61 3iv8 n ALA 307 Ca -0.06 -2.66 -0.36 0.00 0.00 0.00 0.00 53.44 50.36 3iv8 n ALA 307 Cb 0.52 -0.66 -0.04 0.00 0.00 0.00 0.00 19.45 19.27 3iv8 n ALA 307 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 3iv8 s LEU 308 N -2.99 4.07 0.27 0.00 2.96 -1.26 -4.47 118.68 117.26 3iv8 s LEU 308 Ca 0.41 2.05 0.10 0.00 -0.22 0.00 0.00 54.13 56.47 3iv8 s LEU 308 Cb 0.35 -4.26 -0.05 0.00 0.50 0.00 0.00 46.19 42.74 3iv8 s LEU 308 CO 0.05 -0.59 -0.05 0.42 -1.32 0.00 0.00 176.35 174.86 3iv8 s THR 309 N -1.71 3.19 0.23 3.68 -4.23 -1.26 -4.67 115.64 110.87 3iv8 s THR 309 Ca 0.60 -2.03 -0.07 0.00 -1.18 0.00 0.00 61.69 59.01 3iv8 s THR 309 Cb -0.22 -2.72 0.18 0.00 1.34 0.00 0.00 72.50 71.08 3iv8 s THR 309 CO 0.27 -0.37 1.81 0.24 -0.54 0.00 0.00 174.62 176.03 3iv8 h MET 310 N 1.97 0.73 -0.67 3.99 2.86 -1.95 -1.68 114.93 120.17 3iv8 h MET 310 Ca -0.43 -0.04 -0.03 0.00 -2.06 0.00 0.00 59.70 57.14 3iv8 h MET 310 Cb 1.25 -0.16 -0.03 0.00 0.06 0.00 0.00 31.60 32.72 3iv8 h MET 310 CO 0.61 0.48 0.32 0.97 1.06 0.00 0.00 176.91 180.34 3iv8 h ILE 311 N 0.75 1.22 -0.07 -1.22 6.09 -1.90 -1.12 117.51 121.26 3iv8 h ILE 311 Ca 0.34 -0.62 -0.14 0.00 -1.37 0.00 0.00 64.86 63.07 3iv8 h ILE 311 Cb 0.25 0.37 -0.01 0.00 0.47 0.00 0.00 36.82 37.89 3iv8 h ILE 311 CO -0.21 0.26 -0.59 -0.33 -3.07 0.00 0.00 178.15 174.22 3iv8 h GLU 312 N 0.95 0.24 -0.56 2.19 5.08 -1.76 -0.90 114.58 119.82 3iv8 h GLU 312 Ca 0.23 -0.16 -0.09 0.00 -1.00 0.00 0.00 59.36 58.34 3iv8 h GLU 312 Cb 0.11 0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.36 3iv8 h GLU 312 CO -0.03 0.76 0.00 0.00 -1.00 0.00 0.00 179.01 178.74 3iv8 h ALA 313 N 1.21 0.76 -0.37 3.43 0.00 -0.59 0.66 119.26 124.36 3iv8 h ALA 313 Ca -0.00 -0.30 -0.01 0.00 0.00 0.00 0.00 54.91 54.60 3iv8 h ALA 313 Cb 1.08 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.65 3iv8 h ALA 313 CO 0.09 0.59 0.19 0.28 0.00 0.00 0.00 179.25 180.40 3iv8 h VAL 314 N 0.88 1.15 -0.12 0.00 2.07 -1.05 -2.33 116.25 116.86 3iv8 h VAL 314 Ca 0.16 -0.41 -0.01 0.00 0.82 0.00 0.00 66.70 67.25 3iv8 h VAL 314 Cb 0.54 0.75 -0.00 0.00 -1.52 0.00 0.00 31.29 31.06 3iv8 h VAL 314 CO 0.03 0.16 0.02 -0.61 0.02 0.00 0.00 177.57 177.19 3iv8 h GLN 315 N 0.46 0.19 -1.00 1.57 4.15 -0.57 -1.72 115.11 118.19 3iv8 h GLN 315 Ca 0.13 -0.05 0.15 0.00 0.77 0.00 0.00 58.65 59.64 3iv8 h GLN 315 Cb 0.08 -0.02 -0.09 0.00 0.21 0.00 0.00 27.48 27.66 3iv8 h GLN 315 CO -0.02 0.38 0.62 -0.91 -1.93 0.00 0.00 178.83 176.98 3iv8 h ASN 316 N -0.03 0.87 -0.27 -0.69 2.35 0.29 0.47 115.58 118.58 3iv8 h ASN 316 Ca 0.04 0.07 -0.16 0.00 -0.55 0.00 0.00 56.30 55.69 3iv8 h ASN 316 Cb 0.28 -0.10 -0.01 0.00 0.05 0.00 0.00 38.32 38.54 3iv8 h ASN 316 CO 0.00 0.41 -0.44 0.74 -1.65 0.00 0.00 177.43 176.49 3iv8 h THR 317 N 0.90 1.28 0.19 2.81 2.02 -1.06 0.36 112.91 119.40 3iv8 h THR 317 Ca 0.53 -1.62 -0.01 0.00 0.77 0.00 0.00 66.41 66.08 3iv8 h THR 317 Cb 0.65 1.49 0.00 0.00 -1.74 0.00 0.00 68.15 68.55 3iv8 h THR 317 CO -0.31 0.53 -0.09 0.58 0.37 0.00 0.00 175.52 176.61 3iv8 h VAL 318 N 0.67 0.89 -0.01 3.16 2.07 -0.78 -2.01 116.25 120.24 3iv8 h VAL 318 Ca 0.04 -0.92 -0.16 0.00 0.82 0.00 0.00 66.70 66.48 3iv8 h VAL 318 Cb 1.01 1.40 -0.02 0.00 -1.52 0.00 0.00 31.29 32.17 3iv8 h VAL 318 CO 0.10 0.19 -0.74 -0.33 0.02 0.00 0.00 177.57 176.81 3iv8 h GLU 319 N -0.75 0.09 0.00 1.57 4.39 -0.01 -3.25 114.58 116.63 3iv8 h GLU 319 Ca -0.03 -0.09 -0.04 0.00 0.34 0.00 0.00 59.36 59.55 3iv8 h GLU 319 Cb 0.51 0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 29.17 3iv8 h GLU 319 CO 0.04 0.79 -1.16 0.72 -1.16 0.00 0.00 179.01 178.24 3iv8 n HIS 320 N -3.71 0.00 0.12 4.33 8.25 0.12 -4.62 115.22 119.72 3iv8 n HIS 320 Ca -0.02 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.44 3iv8 n HIS 320 Cb 0.71 -0.11 0.05 0.00 1.12 0.00 0.00 29.99 31.76 3iv8 n HIS 320 CO 0.00 0.00 0.00 0.28 0.64 0.00 0.00 176.34 177.26 3iv8 h VAL 321 N 0.00 1.15 0.00 1.59 2.07 -1.21 -3.46 116.25 116.39 3iv8 h VAL 321 Ca -0.06 -2.45 0.00 0.00 0.82 0.00 0.00 66.70 65.01 3iv8 h VAL 321 Cb 1.12 2.45 0.00 0.00 -1.52 0.00 0.00 31.29 33.33 3iv8 h VAL 321 CO -0.00 0.62 0.00 0.61 0.02 0.00 0.00 177.57 178.81 3iv8 n GLY 322 N 1.03 0.68 3.87 2.17 0.00 -0.79 -4.64 105.19 107.52 3iv8 n GLY 322 Ca 0.01 -0.73 -0.36 0.00 0.00 0.00 0.00 46.02 44.95 3iv8 n GLY 322 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3iv8 s ILE 323 N -2.00 5.21 0.49 -0.61 1.01 -0.98 -5.02 121.20 119.30 3iv8 s ILE 323 Ca 0.00 0.41 -0.23 0.00 0.00 0.00 0.00 60.65 60.82 3iv8 s ILE 323 Cb 0.00 -3.60 -0.07 0.00 0.01 0.00 0.00 42.46 38.80 3iv8 s ILE 323 CO 0.00 0.43 1.27 0.00 0.00 0.00 0.00 174.94 176.64 3iv8 n ALA 324 N 1.33 1.29 -0.20 9.38 0.00 -1.26 -4.01 120.51 127.03 3iv8 n ALA 324 Ca -0.12 0.18 0.01 0.00 0.00 0.00 0.00 53.44 53.51 3iv8 n ALA 324 Cb 0.53 -2.28 0.12 0.00 0.00 0.00 0.00 19.45 17.81 3iv8 n ALA 324 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 3iv8 h LEU 325 N 1.65 -0.03 -1.33 0.00 5.85 -1.97 0.20 115.31 119.69 3iv8 h LEU 325 Ca -0.49 0.12 -0.04 0.00 0.84 0.00 0.00 57.88 58.31 3iv8 h LEU 325 Cb 1.31 0.17 -0.02 0.00 0.37 0.00 0.00 40.66 42.49 3iv8 h LEU 325 CO 0.58 -0.01 0.04 -2.24 -0.34 0.00 0.00 178.44 176.47 3iv8 h ASP 326 N 0.24 0.46 -0.01 1.25 2.03 -1.99 -0.16 116.42 118.24 3iv8 h ASP 326 Ca 0.33 -0.07 -0.02 0.00 -0.73 0.00 0.00 57.03 56.54 3iv8 h ASP 326 Cb 0.51 -0.12 0.00 0.00 -0.83 0.00 0.00 39.33 38.89 3iv8 h ASP 326 CO -0.43 0.49 -0.07 -0.08 -1.03 0.00 0.00 179.24 178.12 3iv8 h GLU 327 N 0.48 0.06 -0.70 4.15 4.57 -1.23 -2.20 114.58 119.72 3iv8 h GLU 327 Ca 0.11 -0.05 0.15 0.00 -1.18 0.00 0.00 59.36 58.38 3iv8 h GLU 327 Cb 0.25 0.01 -0.10 0.00 -0.16 0.00 0.00 28.75 28.75 3iv8 h GLU 327 CO 0.00 0.78 0.15 0.00 -1.18 0.00 0.00 179.01 178.76 3iv8 h ALA 328 N 0.28 0.87 -0.62 2.92 0.00 -0.61 -1.01 119.26 121.08 3iv8 h ALA 328 Ca -0.01 0.16 0.03 0.00 0.00 0.00 0.00 54.91 55.10 3iv8 h ALA 328 Cb 0.80 0.23 -0.04 0.00 0.00 0.00 0.00 17.79 18.78 3iv8 h ALA 328 CO 0.01 -0.34 0.37 -0.07 0.00 0.00 0.00 179.25 179.23 3iv8 h LEU 329 N 0.25 0.60 -2.13 0.00 3.38 -0.94 0.87 115.31 117.35 3iv8 h LEU 329 Ca 0.39 0.01 -0.01 0.00 0.09 0.00 0.00 57.88 58.36 3iv8 h LEU 329 Cb 0.64 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 41.27 3iv8 h LEU 329 CO -0.49 0.42 -0.02 0.03 0.09 0.00 0.00 178.44 178.46 3iv8 h ARG 330 N 0.73 0.00 0.00 1.13 3.08 -0.57 -1.99 114.38 116.76 3iv8 h ARG 330 Ca 0.25 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.30 3iv8 h ARG 330 Cb 0.05 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.10 3iv8 h ARG 330 CO -0.11 0.02 0.00 -1.33 -1.07 0.00 0.00 179.97 177.48 3iv8 n MET 331 N -4.23 0.22 -0.08 0.04 2.81 0.28 -1.23 117.12 114.93 3iv8 n MET 331 Ca -0.03 0.35 0.04 0.00 -1.81 0.00 0.00 57.70 56.25 3iv8 n MET 331 Cb 0.11 -1.85 0.08 0.00 -0.71 0.00 0.00 33.22 30.85 3iv8 n MET 331 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 3iv8 n ALA 332 N -1.78 2.22 -1.00 3.04 0.00 -0.78 -0.97 120.51 121.24 3iv8 n ALA 332 Ca 0.03 -0.94 0.00 0.00 0.00 0.00 0.00 53.44 52.53 3iv8 n ALA 332 Cb 0.30 -0.28 0.00 0.00 0.00 0.00 0.00 19.45 19.47 3iv8 n ALA 332 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 3iv8 n THR 333 N 0.24 0.00 0.01 0.00 -2.24 -1.00 -1.43 114.28 109.87 3iv8 n THR 333 Ca 0.07 0.00 -0.11 0.00 -2.27 0.00 0.00 64.05 61.73 3iv8 n THR 333 Cb 0.31 0.00 -0.06 0.00 -2.10 0.00 0.00 70.33 68.48 3iv8 n THR 333 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 3iv8 h LEU 334 N 0.00 0.07 0.05 3.22 6.46 -1.52 -1.38 115.31 122.21 3iv8 h LEU 334 Ca 0.00 -0.03 -0.00 0.00 -0.12 0.00 0.00 57.88 57.73 3iv8 h LEU 334 Cb 0.00 -0.02 0.00 0.00 -0.73 0.00 0.00 40.66 39.91 3iv8 h LEU 334 CO 0.00 0.08 -0.02 1.88 -0.62 0.00 0.00 178.44 179.76 3iv8 h TYR 335 N 0.06 -0.06 -0.99 1.25 0.05 -1.45 0.17 116.97 115.99 3iv8 h TYR 335 Ca 0.02 -0.00 0.03 0.00 0.05 0.00 0.00 58.73 58.83 3iv8 h TYR 335 Cb 0.02 0.02 -0.06 0.00 1.01 0.00 0.00 36.73 37.72 3iv8 h TYR 335 CO -0.07 0.07 0.65 -1.35 -1.05 0.00 0.00 178.16 176.42 3iv8 h PRO 336 N -0.18 1.23 -0.31 4.88 0.11 -1.76 -0.31 132.00 135.67 3iv8 h PRO 336 Ca -0.01 -0.07 0.02 0.00 0.11 0.00 0.00 66.00 66.05 3iv8 h PRO 336 Cb 0.16 -0.28 -0.03 0.00 0.11 0.00 0.00 31.00 30.96 3iv8 h PRO 336 CO 0.01 0.81 0.15 0.00 -0.21 0.00 0.00 178.00 178.77 3iv8 h ALA 337 N 1.40 0.38 -0.50 -0.75 0.00 -0.74 -1.70 119.26 117.34 3iv8 h ALA 337 Ca 0.39 0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.30 3iv8 h ALA 337 Cb -0.02 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 3iv8 h ALA 337 CO -0.12 -0.23 0.24 0.87 0.00 0.00 0.00 179.25 180.01 3iv8 h LYS 338 N 0.32 0.70 -0.51 0.00 1.57 -0.13 0.12 116.57 118.65 3iv8 h LYS 338 Ca 0.13 -0.08 -0.05 0.00 -1.87 0.00 0.00 60.65 58.78 3iv8 h LYS 338 Cb 0.05 -0.14 -0.02 0.00 0.08 0.00 0.00 32.23 32.20 3iv8 h LYS 338 CO -0.09 0.55 0.12 0.00 -0.57 0.00 0.00 179.45 179.45 3iv8 h ALA 339 N 1.56 0.67 -0.02 3.86 0.00 -0.21 -2.85 119.26 122.27 3iv8 h ALA 339 Ca 0.18 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.87 3iv8 h ALA 339 Cb 0.07 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.67 3iv8 h ALA 339 CO -0.02 0.37 -0.12 0.44 0.00 0.00 0.00 179.25 179.91 3iv8 n ILE 340 N -4.45 0.00 -2.63 0.00 -5.35 -0.78 -4.97 119.36 101.18 3iv8 n ILE 340 Ca 0.01 -0.34 -0.06 0.00 -0.27 0.00 0.00 62.75 62.10 3iv8 n ILE 340 Cb 0.23 1.03 0.02 0.00 -1.74 0.00 0.00 39.64 39.18 3iv8 n ILE 340 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3iv8 n GLY 341 N 1.31 0.38 0.47 3.28 0.00 0.05 -4.97 105.19 105.72 3iv8 n GLY 341 Ca 0.14 -0.37 0.08 0.00 0.00 0.00 0.00 46.02 45.88 3iv8 n GLY 341 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 3iv8 n VAL 342 N -2.61 2.10 0.59 1.61 0.24 0.21 -4.79 118.33 115.68 3iv8 n VAL 342 Ca -0.04 -2.22 0.13 0.00 -2.04 0.00 0.00 64.34 60.17 3iv8 n VAL 342 Cb 0.53 -0.25 0.39 0.00 -1.47 0.00 0.00 33.84 33.04 3iv8 n VAL 342 CO 0.00 0.00 0.00 -2.24 -2.14 0.00 0.00 176.83 172.45 3iv8 h ASP 343 N 0.78 0.00 -0.02 -1.34 3.04 -1.71 0.21 116.42 117.38 3iv8 h ASP 343 Ca 0.02 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.81 3iv8 h ASP 343 Cb 1.21 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 39.50 3iv8 h ASP 343 CO 0.11 0.00 0.00 -0.62 -2.04 0.00 0.00 179.24 176.69 3iv8 n GLU 344 N -2.33 1.09 0.00 4.15 1.02 -1.26 -4.22 120.64 119.08 3iv8 n GLU 344 Ca 0.05 -0.14 0.00 0.00 -0.02 0.00 0.00 57.16 57.06 3iv8 n GLU 344 Cb 0.43 -1.28 0.00 0.00 -0.02 0.00 0.00 31.44 30.57 3iv8 n GLU 344 CO 0.00 0.00 0.00 0.36 1.18 0.00 0.00 177.13 178.67 3iv8 n LYS 345 N -0.63 4.66 -4.32 3.49 2.85 -0.75 -4.82 118.16 118.64 3iv8 n LYS 345 Ca 0.13 0.00 -0.17 0.00 -1.05 0.00 0.00 58.31 57.22 3iv8 n LYS 345 Cb 0.09 -0.43 -0.10 0.00 -0.65 0.00 0.00 35.03 33.94 3iv8 n LYS 345 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 177.40 176.84 3iv8 s LEU 346 N -0.10 2.55 0.00 -5.58 1.43 0.66 -0.99 118.68 116.65 3iv8 s LEU 346 Ca 0.00 -1.02 0.00 0.00 -1.03 0.00 0.00 54.13 52.08 3iv8 s LEU 346 Cb 0.00 -0.59 0.00 0.00 0.03 0.00 0.00 46.19 45.63 3iv8 s LEU 346 CO 0.00 -0.21 0.00 0.61 0.23 0.00 0.00 176.35 176.98 3iv8 n GLY 347 N -0.32 1.78 3.39 -3.19 0.00 -1.26 -4.14 105.19 101.45 3iv8 n GLY 347 Ca -0.09 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.71 3iv8 n GLY 347 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3iv8 s ARG 348 N -0.83 1.44 -0.76 1.61 0.52 -1.26 -3.59 118.95 116.08 3iv8 s ARG 348 Ca 0.00 -1.59 -0.16 0.00 -0.52 0.00 0.00 55.73 53.47 3iv8 s ARG 348 Cb 0.00 -1.45 0.17 0.00 0.52 0.00 0.00 34.95 34.20 3iv8 s ARG 348 CO 0.00 0.27 0.78 0.42 0.02 0.00 0.00 175.30 176.79 3iv8 s ILE 349 N -2.44 5.29 0.09 1.52 1.01 0.56 -4.83 121.20 122.40 3iv8 s ILE 349 Ca 0.23 -1.95 -0.19 0.00 0.00 0.00 0.00 60.65 58.73 3iv8 s ILE 349 Cb -0.04 -4.50 0.05 0.00 0.01 0.00 0.00 42.46 37.97 3iv8 s ILE 349 CO 0.09 -1.10 0.47 -1.59 0.00 0.00 0.00 174.94 172.82 3iv8 s LYS 350 N 1.19 1.06 -0.35 2.79 -2.85 -1.26 -4.84 119.74 115.48 3iv8 s LYS 350 Ca 0.17 -0.46 -0.42 0.00 -1.00 0.00 0.00 55.97 54.26 3iv8 s LYS 350 Cb -0.14 0.48 -0.19 0.00 -2.06 0.00 0.00 37.83 35.92 3iv8 s LYS 350 CO -0.05 -0.41 1.36 1.17 0.10 0.00 0.00 175.35 177.53 3iv8 n LYS 351 N 0.08 0.00 0.00 1.78 4.81 -1.26 -1.42 118.16 122.16 3iv8 n LYS 351 Ca -0.17 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.27 3iv8 n LYS 351 Cb 0.62 -1.39 0.00 0.00 0.02 0.00 0.00 35.03 34.28 3iv8 n LYS 351 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3iv8 n GLY 352 N 3.13 3.05 3.73 3.14 0.00 -0.29 -4.99 105.19 112.96 3iv8 n GLY 352 Ca 0.26 -0.79 -0.30 0.00 0.00 0.00 0.00 46.02 45.20 3iv8 n GLY 352 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3iv8 s MET 353 N 0.00 1.29 0.18 1.61 -1.94 -0.50 -4.53 119.30 115.41 3iv8 s MET 353 Ca 0.00 0.72 -0.30 0.00 -1.71 0.00 0.00 55.69 54.40 3iv8 s MET 353 Cb 0.00 -1.82 -0.08 0.00 2.01 0.00 0.00 34.83 34.94 3iv8 s MET 353 CO 0.00 -2.19 1.24 0.42 -0.01 0.00 0.00 175.02 174.47 3iv8 s ILE 354 N -3.00 3.46 -1.00 2.53 1.09 -0.17 -0.95 121.20 123.18 3iv8 s ILE 354 Ca 0.63 1.21 -0.20 0.00 -1.10 0.00 0.00 60.65 61.20 3iv8 s ILE 354 Cb -0.17 -3.78 -0.09 0.00 -1.06 0.00 0.00 42.46 37.36 3iv8 s ILE 354 CO 0.56 0.19 2.02 0.00 -0.10 0.00 0.00 174.94 177.61 3iv8 n ALA 355 N 2.61 3.97 -3.02 9.38 0.00 -0.62 -4.77 120.51 128.06 3iv8 n ALA 355 Ca 0.05 -3.49 -0.39 0.00 0.00 0.00 0.00 53.44 49.61 3iv8 n ALA 355 Cb 0.44 -3.60 -0.12 0.00 0.00 0.00 0.00 19.45 16.17 3iv8 n ALA 355 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 3iv8 s ASN 356 N 4.47 5.51 0.09 0.00 -0.87 -1.25 -1.91 114.94 120.98 3iv8 s ASN 356 Ca 0.54 -1.01 0.02 0.00 -1.57 0.00 0.00 52.86 50.84 3iv8 s ASN 356 Cb 0.14 -1.95 -0.04 0.00 -0.02 0.00 0.00 41.25 39.38 3iv8 s ASN 356 CO 0.05 -0.34 -0.08 -0.76 -2.57 0.00 0.00 177.10 173.41 3iv8 s LEU 357 N 1.49 2.43 -0.00 0.60 1.02 0.11 -0.11 118.68 124.22 3iv8 s LEU 357 Ca 0.01 -0.86 0.05 0.00 0.02 0.00 0.00 54.13 53.34 3iv8 s LEU 357 Cb -0.19 -0.14 -0.01 0.00 0.02 0.00 0.00 46.19 45.87 3iv8 s LEU 357 CO 0.05 -0.36 -0.15 -0.89 0.02 0.00 0.00 176.35 175.02 3iv8 s THR 358 N -2.87 1.15 -0.16 5.49 2.01 0.49 -0.73 115.64 121.02 3iv8 s THR 358 Ca 0.05 -0.69 -0.01 0.00 0.31 0.00 0.00 61.69 61.36 3iv8 s THR 358 Cb 0.00 -0.97 -0.00 0.00 0.01 0.00 0.00 72.50 71.53 3iv8 s THR 358 CO -0.03 0.27 -0.13 -0.69 -0.69 0.00 0.00 174.62 173.36 3iv8 s VAL 359 N -0.43 2.87 0.03 3.82 1.01 -0.49 -1.39 120.40 125.82 3iv8 s VAL 359 Ca 0.05 -0.70 -0.05 0.00 0.00 0.00 0.00 61.98 61.28 3iv8 s VAL 359 Cb -0.06 -2.23 -0.01 0.00 0.00 0.00 0.00 36.38 34.08 3iv8 s VAL 359 CO -0.00 0.50 0.09 0.72 0.00 0.00 0.00 175.10 176.41 3iv8 s PHE 360 N 0.88 0.18 0.02 5.22 -0.12 -0.63 -0.21 117.98 123.33 3iv8 s PHE 360 Ca -0.03 -0.43 0.00 0.00 -0.05 0.00 0.00 56.93 56.42 3iv8 s PHE 360 Cb -0.15 -0.13 0.00 0.00 -0.63 0.00 0.00 43.02 42.11 3iv8 s PHE 360 CO -0.01 -0.33 0.03 -0.40 -0.05 0.00 0.00 175.22 174.47 3iv8 n ASP 361 N 1.00 0.06 0.00 1.98 5.68 -0.23 0.12 116.55 125.16 3iv8 n ASP 361 Ca -0.20 -1.05 0.12 0.00 -0.50 0.00 0.00 54.79 53.16 3iv8 n ASP 361 Cb 0.57 -0.02 0.58 0.00 -1.14 0.00 0.00 41.12 41.11 3iv8 n ASP 361 CO 0.00 0.00 0.00 -2.11 -1.33 0.00 0.00 177.20 173.76 3iv8 n ARG 362 N -1.05 0.21 -0.25 0.11 1.85 -1.26 -1.39 116.66 114.88 3iv8 n ARG 362 Ca 0.01 0.07 0.09 0.00 -1.00 0.00 0.00 57.85 57.01 3iv8 n ARG 362 Cb 0.02 -1.50 0.23 0.00 -1.05 0.00 0.00 32.46 30.16 3iv8 n ARG 362 CO 0.00 0.00 0.00 -0.25 -0.01 0.00 0.00 177.63 177.37 3iv8 n ASP 363 N -1.37 3.40 -3.22 2.89 8.00 -1.26 -4.97 116.55 120.02 3iv8 n ASP 363 Ca 0.09 -1.97 -0.20 0.00 0.71 0.00 0.00 54.79 53.42 3iv8 n ASP 363 Cb 0.23 -0.33 0.07 0.00 -0.02 0.00 0.00 41.12 41.07 3iv8 n ASP 363 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 3iv8 n PHE 364 N 1.17 -2.46 -3.48 1.24 3.72 -0.48 -4.99 117.46 112.18 3iv8 n PHE 364 Ca 0.18 0.89 -0.37 0.00 -0.05 0.00 0.00 57.45 58.10 3iv8 n PHE 364 Cb 0.53 -4.60 -0.08 0.00 -0.94 0.00 0.00 39.48 34.40 3iv8 n PHE 364 CO 0.00 0.00 0.00 -0.80 -0.05 0.00 0.00 176.76 175.91 3iv8 s ASN 365 N -3.42 6.40 0.01 4.37 0.01 -1.26 -4.90 114.94 116.15 3iv8 s ASN 365 Ca 0.44 0.47 -0.30 0.00 -0.71 0.00 0.00 52.86 52.76 3iv8 s ASN 365 Cb -0.19 -2.20 -0.04 0.00 0.41 0.00 0.00 41.25 39.22 3iv8 s ASN 365 CO 0.64 0.02 1.19 -0.69 -1.51 0.00 0.00 177.10 176.74 3iv8 s VAL 366 N 0.92 4.19 -0.05 1.60 1.01 -1.26 -1.06 120.40 125.74 3iv8 s VAL 366 Ca 0.17 1.55 0.19 0.00 0.00 0.00 0.00 61.98 63.89 3iv8 s VAL 366 Cb -0.14 -3.99 -0.29 0.00 0.00 0.00 0.00 36.38 31.96 3iv8 s VAL 366 CO 0.06 0.07 0.37 0.29 0.00 0.00 0.00 175.10 175.89 3iv8 n LYS 367 N 4.45 0.66 -3.61 2.72 4.76 0.71 -4.83 118.16 123.03 3iv8 n LYS 367 Ca 0.10 -0.15 -0.01 0.00 -2.87 0.00 0.00 58.31 55.38 3iv8 n LYS 367 Cb 0.47 -1.47 -0.01 0.00 -1.84 0.00 0.00 35.03 32.18 3iv8 n LYS 367 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 3iv8 s ALA 368 N -3.21 -2.24 0.09 7.82 0.00 -1.15 -1.16 121.76 121.91 3iv8 s ALA 368 Ca -0.07 1.36 -0.00 0.00 0.00 0.00 0.00 51.96 53.25 3iv8 s ALA 368 Cb 0.11 -0.03 -0.04 0.00 0.00 0.00 0.00 23.12 23.17 3iv8 s ALA 368 CO 0.80 -0.78 -0.00 0.95 0.00 0.00 0.00 175.76 176.73 3iv8 s THR 369 N -2.22 0.27 -0.10 0.00 -4.23 -0.75 -1.40 115.64 107.21 3iv8 s THR 369 Ca 0.12 -1.87 -0.00 0.00 -1.18 0.00 0.00 61.69 58.76 3iv8 s THR 369 Cb 0.02 -1.75 0.02 0.00 1.34 0.00 0.00 72.50 72.13 3iv8 s THR 369 CO -0.04 -0.77 -0.08 -0.69 -0.54 0.00 0.00 174.62 172.50 3iv8 s VAL 370 N -3.91 1.01 -0.14 2.29 1.01 0.09 -1.29 120.40 119.45 3iv8 s VAL 370 Ca 0.14 -0.30 0.00 0.00 0.00 0.00 0.00 61.98 61.83 3iv8 s VAL 370 Cb 0.07 -1.01 0.02 0.00 0.00 0.00 0.00 36.38 35.46 3iv8 s VAL 370 CO -0.05 0.36 -0.14 -0.69 0.00 0.00 0.00 175.10 174.59 3iv8 s VAL 371 N 1.55 1.52 -1.30 2.92 1.01 -1.11 0.08 120.40 125.07 3iv8 s VAL 371 Ca 0.02 -0.60 -0.20 0.00 0.00 0.00 0.00 61.98 61.20 3iv8 s VAL 371 Cb -0.13 -1.43 0.02 0.00 0.00 0.00 0.00 36.38 34.84 3iv8 s VAL 371 CO -0.06 0.45 0.52 0.59 0.00 0.00 0.00 175.10 176.60 3iv8 n ASN 372 N 4.71 -2.75 0.00 3.32 3.02 -1.07 -0.58 115.26 121.91 3iv8 n ASN 372 Ca -0.17 -1.20 0.00 0.00 -0.03 0.00 0.00 54.58 53.19 3iv8 n ASN 372 Cb 0.50 -2.21 0.00 0.00 -0.61 0.00 0.00 39.78 37.46 3iv8 n ASN 372 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3iv8 n GLY 373 N -2.10 0.76 3.51 7.41 0.00 -0.80 -4.27 105.19 109.71 3iv8 n GLY 373 Ca -0.18 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.41 3iv8 n GLY 373 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3iv8 s GLN 374 N -0.26 3.30 0.53 1.61 -1.52 0.26 -4.93 119.66 118.64 3iv8 s GLN 374 Ca 0.00 -0.35 -0.21 0.00 -1.95 0.00 0.00 55.36 52.85 3iv8 s GLN 374 Cb 0.00 -4.08 -0.06 0.00 -0.22 0.00 0.00 33.01 28.66 3iv8 s GLN 374 CO 0.00 -1.52 1.18 -0.47 -0.25 0.00 0.00 175.29 174.23 3iv8 s TYR 375 N 3.93 2.63 -0.30 0.91 6.14 -1.26 -2.73 117.35 126.67 3iv8 s TYR 375 Ca 0.29 1.52 -0.02 0.00 0.64 0.00 0.00 57.07 59.50 3iv8 s TYR 375 Cb -0.13 -3.41 0.19 0.00 0.42 0.00 0.00 41.96 39.03 3iv8 s TYR 375 CO 0.18 -1.82 0.64 -2.00 0.64 0.00 0.00 175.55 173.18 3iv8 s GLU 376 N -3.08 0.54 0.63 4.97 2.12 -0.41 -4.98 118.70 118.48 3iv8 s GLU 376 Ca 0.71 0.93 -0.17 0.00 0.36 0.00 0.00 54.97 56.80 3iv8 s GLU 376 Cb -0.28 0.51 -0.02 0.00 0.26 0.00 0.00 34.13 34.61 3iv8 s GLU 376 CO 0.33 -0.61 1.18 -1.14 -0.54 0.00 0.00 175.26 174.48 3iv8 s GLN 377 N 2.87 2.80 0.00 4.30 0.74 -1.26 -1.81 119.66 127.29 3iv8 s GLN 377 Ca 0.19 1.71 0.28 0.00 0.05 0.00 0.00 55.36 57.58 3iv8 s GLN 377 Cb -0.14 -1.92 0.96 0.00 1.10 0.00 0.00 33.01 33.00 3iv8 s GLN 377 CO -0.20 -1.31 1.69 0.09 -0.55 0.00 0.00 175.29 175.01