#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 2.53 0.17 0.00 1.00 -1.26 -4.75 119.30 116.99 3iv8 s MET 1 Ca 0.00 1.30 -0.11 0.00 0.00 0.00 0.00 55.69 56.87 3iv8 s MET 1 Cb 0.00 -1.92 0.00 0.00 0.00 0.00 0.00 34.83 32.91 3iv8 s MET 1 CO 0.00 -1.45 0.35 1.52 0.00 0.00 0.00 175.02 175.44 3iv8 s TYR 2 N -2.59 0.23 0.01 -0.03 -0.85 -0.74 -4.37 117.35 109.01 3iv8 s TYR 2 Ca 0.64 -0.59 0.05 0.00 -0.52 0.00 0.00 57.07 56.66 3iv8 s TYR 2 Cb -0.19 0.07 -0.02 0.00 0.38 0.00 0.00 41.96 42.21 3iv8 s TYR 2 CO 0.48 -0.77 -0.17 0.00 -1.52 0.00 0.00 175.55 173.58 3iv8 s ALA 3 N -3.93 1.41 -0.14 9.51 0.00 -0.63 0.58 121.76 128.55 3iv8 s ALA 3 Ca 0.14 -0.80 -0.07 0.00 0.00 0.00 0.00 51.96 51.23 3iv8 s ALA 3 Cb 0.02 -0.32 -0.04 0.00 0.00 0.00 0.00 23.12 22.78 3iv8 s ALA 3 CO -0.01 0.33 0.12 -0.51 0.00 0.00 0.00 175.76 175.68 3iv8 s LEU 4 N -0.68 4.22 0.27 0.00 1.43 0.62 0.26 118.68 124.81 3iv8 s LEU 4 Ca 0.06 0.34 0.02 0.00 -1.03 0.00 0.00 54.13 53.52 3iv8 s LEU 4 Cb -0.07 -2.04 -0.04 0.00 0.03 0.00 0.00 46.19 44.07 3iv8 s LEU 4 CO 0.00 0.33 0.16 -0.89 0.23 0.00 0.00 176.35 176.17 3iv8 s THR 5 N -0.52 0.23 -1.04 5.49 2.01 0.32 -1.53 115.64 120.60 3iv8 s THR 5 Ca 0.12 -2.00 -0.09 0.00 0.31 0.00 0.00 61.69 60.03 3iv8 s THR 5 Cb -0.12 -2.53 -0.05 0.00 0.01 0.00 0.00 72.50 69.82 3iv8 s THR 5 CO 0.02 0.00 0.87 -3.20 -0.69 0.00 0.00 174.62 171.62 3iv8 n ASN 6 N -0.75 -6.40 -3.61 3.53 5.15 -1.26 -1.21 115.26 110.71 3iv8 n ASN 6 Ca 0.02 -0.74 -0.11 0.00 -0.60 0.00 0.00 54.58 53.15 3iv8 n ASN 6 Cb 0.65 -4.71 -0.04 0.00 -0.53 0.00 0.00 39.78 35.15 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 -3.80 4.24 -0.29 0.00 2.20 -0.31 -4.41 119.74 117.37 3iv8 s LYS 8 Ca 0.03 0.09 -0.05 0.00 -0.36 0.00 0.00 55.97 55.68 3iv8 s LYS 8 Cb 0.01 -3.45 0.02 0.00 -1.51 0.00 0.00 37.83 32.90 3iv8 s LYS 8 CO -0.11 0.18 0.04 0.42 -0.36 0.00 0.00 175.35 175.52 3iv8 s ILE 9 N 0.65 3.66 -0.83 5.43 1.01 -0.12 -0.07 121.20 130.93 3iv8 s ILE 9 Ca 0.16 -0.81 -0.17 0.00 0.00 0.00 0.00 60.65 59.84 3iv8 s ILE 9 Cb -0.13 -2.90 0.16 0.00 0.01 0.00 0.00 42.46 39.60 3iv8 s ILE 9 CO 0.04 0.09 0.91 -0.31 0.00 0.00 0.00 174.94 175.68 3iv8 s TYR 10 N 1.45 3.37 0.20 3.97 2.02 0.48 -1.26 117.35 127.56 3iv8 s TYR 10 Ca 0.02 -1.58 0.27 0.00 -0.37 0.00 0.00 57.07 55.41 3iv8 s TYR 10 Cb -0.17 -4.05 1.13 0.00 -0.40 0.00 0.00 41.96 38.47 3iv8 s TYR 10 CO 0.01 -1.25 1.91 1.79 -1.57 0.00 0.00 175.55 176.44 3iv8 h THR 11 N 5.41 0.45 0.00 -0.71 1.35 -1.33 -3.39 112.91 114.68 3iv8 h THR 11 Ca 0.06 -0.88 0.00 0.00 -0.55 0.00 0.00 66.41 65.04 3iv8 h THR 11 Cb 1.04 1.62 0.00 0.00 -1.73 0.00 0.00 68.15 69.09 3iv8 h THR 11 CO 0.96 0.16 0.00 0.61 -0.25 0.00 0.00 175.52 177.00 3iv8 n GLY 12 N -0.06 2.25 0.01 5.82 0.00 -1.26 -2.37 105.19 109.58 3iv8 n GLY 12 Ca -0.00 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.04 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 0.00 3.52 -3.63 1.61 3.02 -1.26 -4.98 115.26 113.54 3iv8 n ASN 13 Ca 0.00 0.00 -0.16 0.00 -0.03 0.00 0.00 54.58 54.39 3iv8 n ASN 13 Cb 0.00 1.17 -0.07 0.00 -0.61 0.00 0.00 39.78 40.27 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 -2.93 -0.46 -0.21 6.41 1.11 -1.26 -5.14 116.67 114.18 3iv8 s ASP 14 Ca -0.02 0.48 -0.04 0.00 0.18 0.00 0.00 52.55 53.15 3iv8 s ASP 14 Cb 0.04 0.48 -0.01 0.00 1.07 0.00 0.00 42.92 44.49 3iv8 s ASP 14 CO 0.26 -0.52 -0.03 0.68 1.18 0.00 0.00 175.17 176.74 3iv8 s VAL 15 N -1.16 3.52 -0.18 -1.27 -7.23 -1.26 -0.98 120.40 111.84 3iv8 s VAL 15 Ca -0.11 -0.45 -0.01 0.00 -1.81 0.00 0.00 61.98 59.60 3iv8 s VAL 15 Cb -0.02 -2.60 -0.00 0.00 0.56 0.00 0.00 36.38 34.32 3iv8 s VAL 15 CO 0.07 0.42 -0.12 -0.76 -0.31 0.00 0.00 175.10 174.41 3iv8 s LEU 16 N 1.35 2.61 0.12 1.32 1.02 -0.39 -4.92 118.68 119.79 3iv8 s LEU 16 Ca 0.04 -0.45 -0.05 0.00 0.02 0.00 0.00 54.13 53.69 3iv8 s LEU 16 Cb -0.14 -1.62 -0.06 0.00 0.02 0.00 0.00 46.19 44.39 3iv8 s LEU 16 CO -0.01 0.05 0.37 0.68 0.02 0.00 0.00 176.35 177.45 3iv8 s VAL 17 N 1.05 5.17 -1.24 -1.59 -7.23 -1.26 -0.94 120.40 114.36 3iv8 s VAL 17 Ca -0.00 0.09 -0.02 0.00 -1.81 0.00 0.00 61.98 60.24 3iv8 s VAL 17 Cb -0.15 -3.62 0.00 0.00 0.56 0.00 0.00 36.38 33.17 3iv8 s VAL 17 CO -0.03 0.09 0.25 0.29 -0.31 0.00 0.00 175.10 175.40 3iv8 n LYS 18 N 0.27 -2.59 -4.68 4.82 4.01 -1.26 -4.98 118.16 113.75 3iv8 n LYS 18 Ca -0.04 0.72 -0.31 0.00 -0.51 0.00 0.00 58.31 58.17 3iv8 n LYS 18 Cb 0.52 -5.09 -0.08 0.00 -0.51 0.00 0.00 35.03 29.87 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 -2.91 1.81 0.04 2.13 3.76 -1.26 -1.31 115.29 117.55 3iv8 s HIS 19 Ca 0.13 -1.10 -0.02 0.00 -0.15 0.00 0.00 55.06 53.92 3iv8 s HIS 19 Cb -0.06 -1.43 -0.03 0.00 1.11 0.00 0.00 32.58 32.17 3iv8 s HIS 19 CO 0.16 0.01 -0.00 0.00 -0.85 0.00 0.00 174.74 174.06 3iv8 s ALA 20 N -3.00 0.28 -0.13 -1.40 0.00 0.12 -4.35 121.76 113.27 3iv8 s ALA 20 Ca 0.11 -0.90 -0.01 0.00 0.00 0.00 0.00 51.96 51.16 3iv8 s ALA 20 Cb 0.01 0.24 -0.02 0.00 0.00 0.00 0.00 23.12 23.35 3iv8 s ALA 20 CO 0.07 -0.30 -0.10 0.08 0.00 0.00 0.00 175.76 175.50 3iv8 s VAL 21 N -2.99 3.30 -0.20 0.00 1.01 -0.58 -2.21 120.40 118.73 3iv8 s VAL 21 Ca -0.02 -0.58 -0.08 0.00 0.00 0.00 0.00 61.98 61.31 3iv8 s VAL 21 Cb 0.01 -2.40 -0.04 0.00 0.00 0.00 0.00 36.38 33.95 3iv8 s VAL 21 CO -0.07 0.52 0.08 -0.63 0.00 0.00 0.00 175.10 175.00 3iv8 s ILE 22 N 0.27 4.80 0.00 2.22 1.01 0.59 -0.27 121.20 129.82 3iv8 s ILE 22 Ca -0.08 -0.02 0.02 0.00 0.00 0.00 0.00 60.65 60.57 3iv8 s ILE 22 Cb -0.15 -3.18 -0.03 0.00 0.01 0.00 0.00 42.46 39.10 3iv8 s ILE 22 CO 0.05 0.43 -0.03 -0.63 0.00 0.00 0.00 174.94 174.75 3iv8 s ILE 23 N 0.64 3.93 -0.26 2.92 1.01 0.20 0.09 121.20 129.72 3iv8 s ILE 23 Ca 0.04 -0.68 -0.01 0.00 0.00 0.00 0.00 60.65 60.00 3iv8 s ILE 23 Cb -0.13 -2.73 0.13 0.00 0.01 0.00 0.00 42.46 39.73 3iv8 s ILE 23 CO 0.01 0.38 0.31 0.21 0.00 0.00 0.00 174.94 175.85 3iv8 s ASN 24 N -1.50 1.20 1.95 3.58 2.47 -0.38 -1.80 114.94 120.47 3iv8 s ASN 24 Ca 0.18 -0.41 0.00 0.00 0.42 0.00 0.00 52.86 53.06 3iv8 s ASN 24 Cb -0.11 0.66 0.00 0.00 -1.45 0.00 0.00 41.25 40.35 3iv8 s ASN 24 CO 0.09 -0.35 0.00 0.61 -3.72 0.00 0.00 177.10 173.73 3iv8 n GLY 25 N 5.33 3.84 0.99 1.21 0.00 -1.26 -1.76 105.19 113.53 3iv8 n GLY 25 Ca -0.03 -0.01 0.06 0.00 0.00 0.00 0.00 46.02 46.04 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 6.82 2.86 -4.32 1.61 5.75 -1.26 -4.05 116.55 123.97 3iv8 n ASP 26 Ca 0.00 -2.17 -0.16 0.00 -0.01 0.00 0.00 54.79 52.45 3iv8 n ASP 26 Cb 0.00 -0.40 -0.10 0.00 -1.03 0.00 0.00 41.12 39.59 3iv8 n ASP 26 CO 0.00 0.00 0.00 -0.54 -0.11 0.00 0.00 177.20 176.55 3iv8 s LYS 27 N -1.60 1.34 -0.37 0.11 1.02 -0.72 -1.84 119.74 117.67 3iv8 s LYS 27 Ca 0.31 -1.69 -0.13 0.00 0.02 0.00 0.00 55.97 54.48 3iv8 s LYS 27 Cb 0.19 -0.44 0.01 0.00 -0.52 0.00 0.00 37.83 37.07 3iv8 s LYS 27 CO 0.17 -0.18 0.24 0.42 -0.92 0.00 0.00 175.35 175.08 3iv8 s ILE 28 N -3.58 4.95 -0.01 2.17 1.01 -0.84 -1.25 121.20 123.66 3iv8 s ILE 28 Ca 0.31 -0.61 -0.24 0.00 0.00 0.00 0.00 60.65 60.11 3iv8 s ILE 28 Cb 0.07 -3.69 -0.19 0.00 0.01 0.00 0.00 42.46 38.66 3iv8 s ILE 28 CO 0.10 -0.18 1.27 -0.33 0.00 0.00 0.00 174.94 175.80 3iv8 h GLU 29 N 8.50 0.11 -1.94 2.79 4.39 -0.66 0.41 114.58 128.17 3iv8 h GLU 29 Ca -0.28 -0.06 0.10 0.00 0.34 0.00 0.00 59.36 59.46 3iv8 h GLU 29 Cb 1.13 0.00 -0.19 0.00 -0.10 0.00 0.00 28.75 29.59 3iv8 h GLU 29 CO 0.68 0.58 0.52 0.00 -1.16 0.00 0.00 179.01 179.62 3iv8 s ALA 30 N -4.19 -1.88 -0.14 3.43 0.00 -1.18 -4.64 121.76 113.16 3iv8 s ALA 30 Ca -0.15 1.28 -0.00 0.00 0.00 0.00 0.00 51.96 53.09 3iv8 s ALA 30 Cb 0.03 -0.08 -0.01 0.00 0.00 0.00 0.00 23.12 23.06 3iv8 s ALA 30 CO 0.70 -0.52 -0.13 0.08 0.00 0.00 0.00 175.76 175.89 3iv8 s VAL 31 N -2.20 2.98 0.08 0.00 1.01 -1.26 -0.30 120.40 120.72 3iv8 s VAL 31 Ca 0.02 -0.68 -0.12 0.00 0.00 0.00 0.00 61.98 61.20 3iv8 s VAL 31 Cb -0.01 -2.26 0.01 0.00 0.00 0.00 0.00 36.38 34.13 3iv8 s VAL 31 CO -0.04 0.52 0.28 0.00 0.00 0.00 0.00 175.10 175.86 3iv8 n PRO 33 N 0.12 0.48 -0.16 0.00 -0.02 -1.26 -0.70 135.00 133.44 3iv8 n PRO 33 Ca -0.16 0.22 0.02 0.00 -2.02 0.00 0.00 63.50 61.55 3iv8 n PRO 33 Cb 0.62 -2.24 0.29 0.00 -0.02 0.00 0.00 33.50 32.15 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 -0.32 1.17 0.00 4.25 2.10 -1.46 -2.76 117.51 120.49 3iv8 h ILE 34 Ca -0.47 -0.31 -0.01 0.00 1.08 0.00 0.00 64.86 65.15 3iv8 h ILE 34 Cb 1.33 0.19 -0.00 0.00 -1.09 0.00 0.00 36.82 37.24 3iv8 h ILE 34 CO 0.47 0.16 -0.04 -0.33 -1.08 0.00 0.00 178.15 177.33 3iv8 h GLU 35 N 0.90 0.00 -0.12 2.19 3.07 -1.90 -2.27 114.58 116.45 3iv8 h GLU 35 Ca 0.25 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.11 3iv8 h GLU 35 Cb -0.10 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.81 3iv8 h GLU 35 CO -0.05 0.04 0.00 0.43 -1.40 0.00 0.00 179.01 178.03 3iv8 n SER 36 N -3.85 0.82 -4.66 1.42 7.64 -1.04 -4.88 113.62 109.07 3iv8 n SER 36 Ca -0.03 -1.77 -0.43 0.00 1.01 0.00 0.00 58.87 57.65 3iv8 n SER 36 Cb 0.13 -0.08 -0.02 0.00 -1.01 0.00 0.00 64.21 63.23 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 4.18 -0.24 -3.43 1.43 -0.86 -4.94 118.68 113.52 3iv8 s LEU 37 Ca 0.20 1.64 -0.23 0.00 -1.03 0.00 0.00 54.13 54.72 3iv8 s LEU 37 Cb 0.10 -3.54 -0.10 0.00 0.03 0.00 0.00 46.19 42.69 3iv8 s LEU 37 CO 0.16 -0.72 0.85 -2.65 0.23 0.00 0.00 176.35 174.22 3iv8 n PRO 38 N 6.39 0.00 -0.44 1.29 -0.02 -1.26 -4.73 135.00 136.24 3iv8 n PRO 38 Ca 0.13 0.00 0.38 0.00 -2.02 0.00 0.00 63.50 61.99 3iv8 n PRO 38 Cb 0.45 -0.73 0.65 0.00 -0.02 0.00 0.00 33.50 33.86 3iv8 n PRO 38 CO 0.00 0.00 0.00 0.77 1.98 0.00 0.00 175.50 178.25 3iv8 h SER 39 N 2.97 0.24 -0.54 2.55 0.02 -1.95 -1.06 113.55 115.77 3iv8 h SER 39 Ca -0.17 0.17 -0.32 0.00 -0.84 0.00 0.00 61.79 60.63 3iv8 h SER 39 Cb 0.67 0.17 -0.19 0.00 0.14 0.00 0.00 62.40 63.20 3iv8 h SER 39 CO 0.49 -0.28 -0.03 -0.62 -1.14 0.00 0.00 176.83 175.26 3iv8 n GLU 40 N -4.83 2.22 -3.40 3.45 -0.58 -1.26 -4.99 120.64 111.25 3iv8 n GLU 40 Ca 0.39 -3.34 -0.38 0.00 -0.42 0.00 0.00 57.16 53.42 3iv8 n GLU 40 Cb 1.48 -1.97 -0.06 0.00 -0.57 0.00 0.00 31.44 30.32 3iv8 n GLU 40 CO 0.00 0.00 0.00 1.41 -0.48 0.00 0.00 177.13 178.06 3iv8 s MET 41 N -3.38 4.23 -0.22 3.49 -2.45 -0.41 -5.05 119.30 115.52 3iv8 s MET 41 Ca 0.49 0.38 -0.29 0.00 -1.25 0.00 0.00 55.69 55.02 3iv8 s MET 41 Cb 0.43 -3.38 -0.02 0.00 1.25 0.00 0.00 34.83 33.11 3iv8 s MET 41 CO 0.01 0.31 1.44 1.21 1.05 0.00 0.00 175.02 179.04 3iv8 s ASN 42 N 0.17 6.62 -0.13 1.11 3.04 -1.26 -4.90 114.94 119.58 3iv8 s ASN 42 Ca 0.24 1.56 -0.05 0.00 0.04 0.00 0.00 52.86 54.65 3iv8 s ASN 42 Cb -0.15 -2.54 -0.04 0.00 -1.54 0.00 0.00 41.25 36.99 3iv8 s ASN 42 CO 0.10 -1.06 0.04 0.68 -3.04 0.00 0.00 177.10 173.82 3iv8 s VAL 43 N 4.45 4.62 -0.33 -5.21 -7.23 -1.26 -1.60 120.40 113.84 3iv8 s VAL 43 Ca 0.63 -0.11 -0.10 0.00 -1.81 0.00 0.00 61.98 60.59 3iv8 s VAL 43 Cb -0.22 -3.02 0.00 0.00 0.56 0.00 0.00 36.38 33.70 3iv8 s VAL 43 CO 0.24 0.54 0.17 -0.69 -0.31 0.00 0.00 175.10 175.05 3iv8 s VAL 44 N -0.32 4.62 0.12 1.32 1.01 0.14 -4.95 120.40 122.34 3iv8 s VAL 44 Ca 0.08 -0.53 -0.29 0.00 0.00 0.00 0.00 61.98 61.23 3iv8 s VAL 44 Cb -0.12 -3.42 -0.06 0.00 0.00 0.00 0.00 36.38 32.78 3iv8 s VAL 44 CO 0.02 -0.02 0.94 -0.62 0.00 0.00 0.00 175.10 175.42 3iv8 s ASP 45 N 1.60 7.48 -0.16 3.32 2.15 -1.26 -0.52 116.67 129.28 3iv8 s ASP 45 Ca 0.04 1.77 0.17 0.00 0.43 0.00 0.00 52.55 54.96 3iv8 s ASP 45 Cb -0.18 -2.58 0.41 0.00 -0.30 0.00 0.00 42.92 40.27 3iv8 s ASP 45 CO 0.06 -0.03 1.28 0.18 -0.17 0.00 0.00 175.17 176.49 3iv8 n LEU 46 N 2.66 3.09 -3.55 -1.34 4.77 -0.35 -4.91 117.00 117.37 3iv8 n LEU 46 Ca 0.01 -3.12 -0.26 0.00 -0.03 0.00 0.00 56.01 52.61 3iv8 n LEU 46 Cb 0.49 -0.49 -0.01 0.00 -2.33 0.00 0.00 43.42 41.08 3iv8 n LEU 46 CO 0.50 0.75 -0.04 0.59 -1.33 0.00 0.00 177.39 177.86 3iv8 n ASN 47 N -1.03 -3.43 -0.24 -1.43 5.03 -1.22 -1.16 115.26 111.78 3iv8 n ASN 47 Ca 0.19 -0.51 -0.03 0.00 0.87 0.00 0.00 54.58 55.10 3iv8 n ASN 47 Cb 0.77 -2.85 -0.01 0.00 -1.02 0.00 0.00 39.78 36.67 3iv8 n ASN 47 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 3iv8 n GLY 48 N -1.18 0.63 3.94 7.41 0.00 0.13 -5.02 105.19 111.10 3iv8 n GLY 48 Ca 0.01 -0.62 -0.28 0.00 0.00 0.00 0.00 46.02 45.13 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 -2.06 2.63 0.02 4.61 0.00 -0.31 -4.58 121.76 122.07 3iv8 s ALA 49 Ca 0.00 -1.25 -0.10 0.00 0.00 0.00 0.00 51.96 50.61 3iv8 s ALA 49 Cb 0.00 -2.62 -0.05 0.00 0.00 0.00 0.00 23.12 20.45 3iv8 s ALA 49 CO 0.00 -2.11 0.33 -0.80 0.00 0.00 0.00 175.76 173.19 3iv8 s ASN 50 N -4.81 6.61 -0.09 0.00 0.02 0.21 -1.16 114.94 115.71 3iv8 s ASN 50 Ca 0.71 0.72 0.04 0.00 -1.02 0.00 0.00 52.86 53.31 3iv8 s ASN 50 Cb -0.05 -2.15 0.00 0.00 0.02 0.00 0.00 41.25 39.07 3iv8 s ASN 50 CO 0.50 0.26 -0.22 -0.22 0.02 0.00 0.00 177.10 177.44 3iv8 s LEU 51 N -1.58 2.00 0.21 0.60 2.96 0.90 -1.68 118.68 122.08 3iv8 s LEU 51 Ca 0.27 -0.51 -0.08 0.00 -0.22 0.00 0.00 54.13 53.59 3iv8 s LEU 51 Cb -0.14 -1.29 -0.02 0.00 0.50 0.00 0.00 46.19 45.24 3iv8 s LEU 51 CO 0.15 0.13 0.32 -0.94 -1.32 0.00 0.00 176.35 174.69 3iv8 s SER 52 N 0.40 0.02 0.51 3.68 1.04 -0.71 -0.39 113.70 118.25 3iv8 s SER 52 Ca -0.18 -1.03 -0.20 0.00 0.48 0.00 0.00 55.95 55.01 3iv8 s SER 52 Cb -0.18 0.48 -0.10 0.00 0.10 0.00 0.00 66.02 66.33 3iv8 s SER 52 CO 0.08 -0.98 0.65 -2.65 0.98 0.00 0.00 173.24 171.33 3iv8 n PRO 53 N -0.29 0.71 -1.71 4.02 -0.02 -1.26 0.46 135.00 136.91 3iv8 n PRO 53 Ca -0.03 0.27 -0.37 0.00 -2.02 0.00 0.00 63.50 61.35 3iv8 n PRO 53 Cb 0.63 -1.75 0.06 0.00 -0.02 0.00 0.00 33.50 32.43 3iv8 n PRO 53 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3iv8 n GLY 54 N 1.63 0.42 3.74 -1.23 0.00 -0.56 -4.16 105.19 105.04 3iv8 n GLY 54 Ca 0.11 -0.11 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 3iv8 n GLY 54 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3iv8 s PHE 55 N -1.39 3.81 -0.31 1.61 0.08 -0.64 -4.74 117.98 116.41 3iv8 s PHE 55 Ca 0.79 1.80 -0.09 0.00 0.12 0.00 0.00 56.93 59.55 3iv8 s PHE 55 Cb -0.40 -3.09 -0.00 0.00 -0.57 0.00 0.00 43.02 38.96 3iv8 s PHE 55 CO 0.43 0.07 0.15 0.42 -0.10 0.00 0.00 175.22 176.19 3iv8 s ILE 56 N -0.60 4.50 -0.44 0.64 1.01 -0.44 -1.70 121.20 124.16 3iv8 s ILE 56 Ca 0.45 -0.50 -0.09 0.00 0.00 0.00 0.00 60.65 60.50 3iv8 s ILE 56 Cb -0.26 -3.32 0.10 0.00 0.01 0.00 0.00 42.46 38.99 3iv8 s ILE 56 CO 0.33 0.04 0.30 -0.62 0.00 0.00 0.00 174.94 174.99 3iv8 s ASP 57 N 1.59 5.66 0.00 3.58 2.15 -0.89 -4.77 116.67 123.98 3iv8 s ASP 57 Ca 0.04 -1.70 0.23 0.00 0.43 0.00 0.00 52.55 51.55 3iv8 s ASP 57 Cb -0.17 -2.00 1.38 0.00 -0.30 0.00 0.00 42.92 41.84 3iv8 s ASP 57 CO 0.06 -0.61 1.89 0.18 -0.17 0.00 0.00 175.17 176.51 3iv8 n LEU 58 N 4.91 0.00 -3.48 -1.34 4.77 -1.26 -2.07 117.00 118.53 3iv8 n LEU 58 Ca -0.09 0.00 -0.17 0.00 -0.03 0.00 0.00 56.01 55.72 3iv8 n LEU 58 Cb 0.42 0.00 -0.12 0.00 -2.33 0.00 0.00 43.42 41.38 3iv8 n LEU 58 CO 0.41 0.00 -0.19 -1.58 -1.33 0.00 0.00 177.39 174.70 3iv8 s GLN 59 N -2.00 0.21 -0.19 3.23 0.74 -1.26 -4.66 119.66 115.73 3iv8 s GLN 59 Ca 0.35 0.22 -0.04 0.00 0.05 0.00 0.00 55.36 55.94 3iv8 s GLN 59 Cb 0.16 -1.14 0.09 0.00 1.10 0.00 0.00 33.01 33.22 3iv8 s GLN 59 CO 0.27 -0.66 0.29 -1.17 -0.55 0.00 0.00 175.29 173.46 3iv8 s LEU 60 N 2.35 -0.33 -0.07 3.68 2.96 -1.18 -0.02 118.68 126.05 3iv8 s LEU 60 Ca 0.07 0.25 0.08 0.00 -0.22 0.00 0.00 54.13 54.32 3iv8 s LEU 60 Cb -0.16 0.73 -0.24 0.00 0.50 0.00 0.00 46.19 47.02 3iv8 s LEU 60 CO -0.13 -0.28 0.54 0.59 -1.32 0.00 0.00 176.35 175.75 3iv8 n ASN 61 N 5.35 1.14 0.00 3.68 3.02 -1.01 -0.27 115.26 127.16 3iv8 n ASN 61 Ca -0.05 0.33 0.00 0.00 -0.03 0.00 0.00 54.58 54.83 3iv8 n ASN 61 Cb 0.50 -0.20 0.00 0.00 -0.61 0.00 0.00 39.78 39.47 3iv8 n ASN 61 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3iv8 n GLY 62 N 1.68 -0.50 0.00 7.41 0.00 -1.08 -1.67 105.19 111.03 3iv8 n GLY 62 Ca -0.22 -0.98 0.00 0.00 0.00 0.00 0.00 46.02 44.82 3iv8 n GLY 62 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3iv8 n GLY 64 N -0.51 0.81 1.50 0.00 0.00 -0.26 -2.08 105.19 104.65 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 -0.66 0.74 3.30 -0.02 0.00 0.88 -4.94 105.19 104.49 3iv8 n GLY 65 Ca -0.22 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.59 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 -2.54 1.69 -0.21 1.61 -7.23 -0.88 -4.94 120.40 107.90 3iv8 s VAL 66 Ca 0.00 -1.77 -0.00 0.00 -1.81 0.00 0.00 61.98 58.39 3iv8 s VAL 66 Cb 0.00 -1.70 0.02 0.00 0.56 0.00 0.00 36.38 35.26 3iv8 s VAL 66 CO 0.00 -0.27 -0.14 -0.04 -0.31 0.00 0.00 175.10 174.35 3iv8 s MET 67 N -2.53 2.96 0.27 4.82 1.00 -1.26 -1.27 119.30 123.29 3iv8 s MET 67 Ca 0.12 -0.87 -0.00 0.00 0.00 0.00 0.00 55.69 54.93 3iv8 s MET 67 Cb -0.07 -2.76 0.63 0.00 0.00 0.00 0.00 34.83 32.63 3iv8 s MET 67 CO 0.05 -0.28 1.66 0.35 0.00 0.00 0.00 175.02 176.80 3iv8 h PHE 68 N 7.97 0.33 -0.12 -0.03 3.57 -1.59 0.16 116.94 127.24 3iv8 h PHE 68 Ca -0.40 0.05 0.03 0.00 3.53 0.00 0.00 57.97 61.18 3iv8 h PHE 68 Cb 1.13 -0.01 -0.00 0.00 2.79 0.00 0.00 35.95 39.85 3iv8 h PHE 68 CO 0.53 -0.16 0.14 -0.91 -2.23 0.00 0.00 178.31 175.67 3iv8 h ASN 69 N 0.24 0.00 0.00 0.41 4.21 -1.84 -2.75 115.58 115.85 3iv8 h ASN 69 Ca 0.51 0.00 -0.05 0.00 1.21 0.00 0.00 56.30 57.96 3iv8 h ASN 69 Cb 0.98 0.00 -0.01 0.00 -1.12 0.00 0.00 38.32 38.17 3iv8 h ASN 69 CO -0.61 0.00 -0.41 0.44 -1.29 0.00 0.00 177.43 175.56 3iv8 h ASP 70 N 0.00 0.00 -3.83 5.81 3.32 -1.02 -3.41 116.42 117.29 3iv8 h ASP 70 Ca 0.05 -0.39 -0.71 0.00 0.02 0.00 0.00 57.03 56.00 3iv8 h ASP 70 Cb 0.33 0.00 -0.34 0.00 0.22 0.00 0.00 39.33 39.54 3iv8 h ASP 70 CO -0.00 0.93 -0.19 -1.61 -1.72 0.00 0.00 179.24 176.65 3iv8 s GLU 71 N -2.08 2.99 -1.37 3.56 0.41 -1.11 -5.01 118.70 116.10 3iv8 s GLU 71 Ca -0.15 -2.81 -0.15 0.00 -0.41 0.00 0.00 54.97 51.45 3iv8 s GLU 71 Cb 0.01 -3.92 0.00 0.00 -1.78 0.00 0.00 34.13 28.44 3iv8 s GLU 71 CO 0.38 -1.22 2.24 -0.89 -0.49 0.00 0.00 175.26 175.27 3iv8 n ILE 72 N 3.11 3.28 -4.38 -1.63 5.41 -1.04 -4.58 119.36 119.52 3iv8 n ILE 72 Ca 0.14 -2.77 -0.21 0.00 1.00 0.00 0.00 62.75 60.91 3iv8 n ILE 72 Cb 0.39 -2.57 -0.09 0.00 -0.71 0.00 0.00 39.64 36.66 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 3.38 0.38 0.21 1.39 -4.23 -1.26 -4.73 115.64 110.79 3iv8 s THR 73 Ca 0.50 -2.00 -0.07 0.00 -1.18 0.00 0.00 61.69 58.94 3iv8 s THR 73 Cb 0.14 -2.48 0.12 0.00 1.34 0.00 0.00 72.50 71.63 3iv8 s THR 73 CO -0.06 0.00 1.73 0.00 -0.54 0.00 0.00 174.62 175.75 3iv8 h ALA 74 N 2.09 0.99 -0.94 3.99 0.00 -1.91 -2.99 119.26 120.48 3iv8 h ALA 74 Ca -0.33 -0.24 0.07 0.00 0.00 0.00 0.00 54.91 54.41 3iv8 h ALA 74 Cb 1.25 -0.27 -0.06 0.00 0.00 0.00 0.00 17.79 18.71 3iv8 h ALA 74 CO 0.52 0.65 0.61 1.49 0.00 0.00 0.00 179.25 182.52 3iv8 h GLU 75 N 1.04 1.03 -0.09 0.00 4.81 -1.93 0.31 114.58 119.74 3iv8 h GLU 75 Ca 0.22 -0.06 -0.03 0.00 -0.13 0.00 0.00 59.36 59.36 3iv8 h GLU 75 Cb 0.37 -0.23 -0.00 0.00 0.63 0.00 0.00 28.75 29.51 3iv8 h GLU 75 CO 0.00 0.68 -0.05 1.15 -0.73 0.00 0.00 179.01 180.06 3iv8 h THR 76 N 1.06 1.33 -0.97 0.32 2.02 -1.78 -0.13 112.91 114.76 3iv8 h THR 76 Ca 0.41 -1.10 0.10 0.00 0.77 0.00 0.00 66.41 66.59 3iv8 h THR 76 Cb 0.23 1.87 -0.07 0.00 -1.74 0.00 0.00 68.15 68.43 3iv8 h THR 76 CO -0.16 0.31 0.62 0.40 0.37 0.00 0.00 175.52 177.06 3iv8 h ILE 77 N -0.17 0.98 -0.34 3.11 2.04 -1.35 0.40 117.51 122.17 3iv8 h ILE 77 Ca 0.02 -0.35 -0.06 0.00 1.00 0.00 0.00 64.86 65.48 3iv8 h ILE 77 Cb 0.52 -0.12 -0.01 0.00 -0.74 0.00 0.00 36.82 36.46 3iv8 h ILE 77 CO 0.02 0.19 -0.01 -0.78 0.00 0.00 0.00 178.15 177.56 3iv8 h ASP 78 N 1.01 0.59 -0.89 1.72 3.58 -0.57 -0.15 116.42 121.72 3iv8 h ASP 78 Ca 0.46 -0.31 0.01 0.00 0.42 0.00 0.00 57.03 57.60 3iv8 h ASP 78 Cb 0.38 -0.16 -0.04 0.00 1.72 0.00 0.00 39.33 41.23 3iv8 h ASP 78 CO -0.21 0.76 0.58 0.74 -2.88 0.00 0.00 179.24 178.23 3iv8 h THR 79 N 0.41 1.23 -0.29 2.25 2.02 -0.24 -2.04 112.91 116.25 3iv8 h THR 79 Ca 0.10 -0.43 -0.12 0.00 0.77 0.00 0.00 66.41 66.73 3iv8 h THR 79 Cb 0.46 -0.08 -0.00 0.00 -1.74 0.00 0.00 68.15 66.79 3iv8 h THR 79 CO 0.02 0.23 -0.28 0.24 0.37 0.00 0.00 175.52 176.09 3iv8 h MET 80 N 1.21 0.70 -0.57 6.66 2.86 -0.75 -2.57 114.93 122.47 3iv8 h MET 80 Ca 0.33 -0.37 0.06 0.00 -2.06 0.00 0.00 59.70 57.65 3iv8 h MET 80 Cb -0.13 0.01 -0.05 0.00 0.06 0.00 0.00 31.60 31.49 3iv8 h MET 80 CO -0.07 0.98 0.29 1.25 1.06 0.00 0.00 176.91 180.42 3iv8 h HIS 81 N 0.45 0.52 -0.72 -0.22 6.17 -0.78 -1.14 115.15 119.43 3iv8 h HIS 81 Ca 0.05 0.02 -0.07 0.00 0.71 0.00 0.00 60.37 61.08 3iv8 h HIS 81 Cb 0.85 -0.15 -0.03 0.00 2.52 0.00 0.00 27.41 30.60 3iv8 h HIS 81 CO 0.07 0.24 0.19 0.87 0.71 0.00 0.00 177.93 180.01 3iv8 h LYS 82 N 0.54 1.15 -0.02 5.26 6.56 -1.26 -2.55 116.57 126.25 3iv8 h LYS 82 Ca 0.26 -0.27 -0.00 0.00 -1.06 0.00 0.00 60.65 59.58 3iv8 h LYS 82 Cb 0.19 -0.15 -0.00 0.00 -0.57 0.00 0.00 32.23 31.69 3iv8 h LYS 82 CO -0.19 1.00 -0.00 0.00 -2.06 0.00 0.00 179.45 178.20 3iv8 h ALA 83 N 1.10 0.03 -0.92 3.86 0.00 -1.32 -3.02 119.26 119.00 3iv8 h ALA 83 Ca 0.23 -0.17 0.21 0.00 0.00 0.00 0.00 54.91 55.19 3iv8 h ALA 83 Cb 0.36 -0.01 -0.17 0.00 0.00 0.00 0.00 17.79 17.97 3iv8 h ALA 83 CO 0.00 -0.30 -0.12 0.09 0.00 0.00 0.00 179.25 178.92 3iv8 n ASN 84 N -4.91 -0.23 -0.36 0.00 5.03 -0.44 -1.73 115.26 112.61 3iv8 n ASN 84 Ca -0.08 1.57 0.05 0.00 0.87 0.00 0.00 54.58 57.00 3iv8 n ASN 84 Cb 0.18 -0.52 0.21 0.00 -1.02 0.00 0.00 39.78 38.64 3iv8 n ASN 84 CO 0.00 0.00 0.00 -0.07 -1.83 0.00 0.00 177.26 175.36 3iv8 h LEU 85 N 0.00 0.96 -2.16 3.41 4.07 -1.32 -0.56 115.31 119.71 3iv8 h LEU 85 Ca 0.49 0.03 0.00 0.00 0.08 0.00 0.00 57.88 58.49 3iv8 h LEU 85 Cb 0.88 -0.16 0.00 0.00 1.08 0.00 0.00 40.66 42.46 3iv8 h LEU 85 CO -0.91 0.55 0.00 0.11 -1.08 0.00 0.00 178.44 177.11 3iv8 h LYS 86 N 1.06 0.00 -0.07 1.13 1.57 -1.40 -2.22 116.57 116.64 3iv8 h LYS 86 Ca 0.47 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 59.24 3iv8 h LYS 86 Cb 0.37 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.67 3iv8 h LYS 86 CO -0.23 0.00 -0.10 -1.13 -0.57 0.00 0.00 179.45 177.42 3iv8 n SER 87 N -2.72 2.48 0.00 0.86 3.41 -0.31 -4.71 113.62 112.62 3iv8 n SER 87 Ca -0.02 -3.29 0.00 0.00 -0.26 0.00 0.00 58.87 55.31 3iv8 n SER 87 Cb 0.08 -0.48 0.00 0.00 -0.26 0.00 0.00 64.21 63.55 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 -1.21 0.72 3.55 5.00 0.00 -0.83 -2.24 105.19 110.17 3iv8 n GLY 88 Ca 0.19 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.78 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 5.66 0.79 -4.12 0.00 -2.24 -0.69 -3.02 114.28 110.66 3iv8 n THR 90 Ca -0.02 -0.70 -0.14 0.00 -2.27 0.00 0.00 64.05 60.92 3iv8 n THR 90 Cb 0.48 -0.27 -0.11 0.00 -2.10 0.00 0.00 70.33 68.33 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 -5.08 1.16 0.26 3.42 0.01 -1.20 -4.42 113.70 107.85 3iv8 s SER 91 Ca -0.09 -0.66 -0.20 0.00 1.31 0.00 0.00 55.95 56.31 3iv8 s SER 91 Cb 0.09 0.02 0.02 0.00 0.21 0.00 0.00 66.02 66.37 3iv8 s SER 91 CO 0.86 -0.22 0.65 0.72 0.41 0.00 0.00 173.24 175.67 3iv8 s PHE 92 N -1.80 -0.13 -0.38 2.43 -0.12 0.23 -2.10 117.98 116.11 3iv8 s PHE 92 Ca -0.03 -0.29 -0.07 0.00 -0.05 0.00 0.00 56.93 56.49 3iv8 s PHE 92 Cb -0.07 0.59 0.06 0.00 -0.63 0.00 0.00 43.02 42.97 3iv8 s PHE 92 CO 0.00 -1.14 0.19 -0.51 -0.05 0.00 0.00 175.22 173.71 3iv8 s LEU 93 N -2.92 4.79 0.23 -1.99 1.43 -0.88 -1.28 118.68 118.06 3iv8 s LEU 93 Ca 0.12 -1.39 -0.31 0.00 -1.03 0.00 0.00 54.13 51.52 3iv8 s LEU 93 Cb -0.04 -1.92 -0.11 0.00 0.03 0.00 0.00 46.19 44.14 3iv8 s LEU 93 CO 0.05 -0.44 1.65 -2.16 0.23 0.00 0.00 176.35 175.67 3iv8 s PRO 94 N 1.39 4.15 -0.19 1.29 0.04 -1.24 -3.13 135.00 137.31 3iv8 s PRO 94 Ca 0.01 2.54 -0.03 0.00 0.04 0.00 0.00 61.00 63.57 3iv8 s PRO 94 Cb -0.21 -3.08 -0.02 0.00 0.04 0.00 0.00 34.50 31.24 3iv8 s PRO 94 CO 0.02 -0.68 -0.05 0.99 0.04 0.00 0.00 177.00 177.32 3iv8 s THR 95 N 0.79 3.49 -0.24 1.26 2.01 0.63 -0.01 115.64 123.56 3iv8 s THR 95 Ca 0.70 -0.48 -0.08 0.00 0.31 0.00 0.00 61.69 62.14 3iv8 s THR 95 Cb -0.48 -2.55 -0.04 0.00 0.01 0.00 0.00 72.50 69.45 3iv8 s THR 95 CO 0.37 0.46 0.09 -0.22 -0.69 0.00 0.00 174.62 174.62 3iv8 s LEU 96 N 0.96 3.62 0.60 4.42 2.96 -0.46 -4.46 118.68 126.33 3iv8 s LEU 96 Ca -0.00 -0.11 -0.06 0.00 -0.22 0.00 0.00 54.13 53.73 3iv8 s LEU 96 Cb -0.15 -1.97 0.01 0.00 0.50 0.00 0.00 46.19 44.59 3iv8 s LEU 96 CO 0.01 0.01 0.92 0.27 -1.32 0.00 0.00 176.35 176.23 3iv8 s ILE 97 N 1.36 3.66 -0.35 6.68 -4.36 -1.26 -1.36 121.20 125.58 3iv8 s ILE 97 Ca 0.06 0.06 -0.40 0.00 -0.26 0.00 0.00 60.65 60.11 3iv8 s ILE 97 Cb -0.15 -3.46 -0.15 0.00 1.25 0.00 0.00 42.46 39.95 3iv8 s ILE 97 CO 0.04 -0.49 1.93 0.35 0.24 0.00 0.00 174.94 177.01 3iv8 n THR 98 N -2.62 0.21 -3.39 8.37 -2.24 -0.87 -4.91 114.28 108.82 3iv8 n THR 98 Ca 0.05 -0.10 0.00 0.00 -2.27 0.00 0.00 64.05 61.73 3iv8 n THR 98 Cb 0.57 -1.18 0.00 0.00 -2.10 0.00 0.00 70.33 67.62 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 6.89 0.00 -4.83 3.42 3.41 -1.26 -4.64 113.62 116.61 3iv8 n SER 99 Ca 0.35 -0.39 -0.29 0.00 -0.26 0.00 0.00 58.87 58.28 3iv8 n SER 99 Cb 0.12 0.00 0.10 0.00 -0.26 0.00 0.00 64.21 64.16 3iv8 n SER 99 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 3iv8 s SER 100 N 0.22 4.39 0.32 4.04 1.04 -1.26 -4.86 113.70 117.58 3iv8 s SER 100 Ca 0.00 1.08 0.03 0.00 0.48 0.00 0.00 55.95 57.54 3iv8 s SER 100 Cb 0.00 -1.74 0.54 0.00 0.10 0.00 0.00 66.02 64.93 3iv8 s SER 100 CO 0.00 -2.01 1.85 0.44 0.98 0.00 0.00 173.24 174.50 3iv8 h ASP 101 N -1.12 0.55 0.01 7.02 3.32 -1.99 -2.07 116.42 122.15 3iv8 h ASP 101 Ca -0.47 -0.11 -0.00 0.00 0.02 0.00 0.00 57.03 56.47 3iv8 h ASP 101 Cb 1.30 -0.15 0.00 0.00 0.22 0.00 0.00 39.33 40.70 3iv8 h ASP 101 CO 0.62 0.62 -0.01 -0.08 -1.72 0.00 0.00 179.24 178.67 3iv8 h GLU 102 N 0.56 -0.02 -0.80 3.56 4.57 -1.99 -1.30 114.58 119.17 3iv8 h GLU 102 Ca 0.12 0.00 0.12 0.00 -1.18 0.00 0.00 59.36 58.42 3iv8 h GLU 102 Cb 0.35 0.00 -0.08 0.00 -0.16 0.00 0.00 28.75 28.86 3iv8 h GLU 102 CO 0.01 0.01 0.42 -0.91 -1.18 0.00 0.00 179.01 177.36 3iv8 h ASN 103 N -0.04 0.53 -0.06 1.04 -0.26 -1.82 -0.04 115.58 114.92 3iv8 h ASN 103 Ca -0.00 0.08 -0.00 0.00 -0.56 0.00 0.00 56.30 55.81 3iv8 h ASN 103 Cb 0.03 -0.01 -0.00 0.00 -1.06 0.00 0.00 38.32 37.28 3iv8 h ASN 103 CO 0.00 0.26 0.04 0.24 -1.06 0.00 0.00 177.43 176.91 3iv8 h MET 104 N 0.65 0.09 -0.93 0.81 2.86 -1.20 -1.12 114.93 116.08 3iv8 h MET 104 Ca 0.42 -0.01 0.14 0.00 -2.06 0.00 0.00 59.70 58.19 3iv8 h MET 104 Cb 0.52 -0.02 -0.08 0.00 0.06 0.00 0.00 31.60 32.08 3iv8 h MET 104 CO -0.32 0.09 0.60 0.00 1.06 0.00 0.00 176.91 178.34 3iv8 h ARG 105 N 0.06 0.76 -0.46 1.72 3.08 -0.13 0.12 114.38 119.53 3iv8 h ARG 105 Ca 0.02 -0.05 -0.09 0.00 0.07 0.00 0.00 59.98 59.93 3iv8 h ARG 105 Cb 0.02 -0.17 -0.01 0.00 0.08 0.00 0.00 29.97 29.89 3iv8 h ARG 105 CO -0.00 0.51 -0.07 1.96 -1.07 0.00 0.00 179.97 181.29 3iv8 h GLN 106 N 0.79 0.86 -0.37 0.04 4.20 -0.75 -2.06 115.11 117.82 3iv8 h GLN 106 Ca 0.47 -0.31 -0.00 0.00 0.06 0.00 0.00 58.65 58.87 3iv8 h GLN 106 Cb 0.67 -0.06 -0.02 0.00 0.30 0.00 0.00 27.48 28.37 3iv8 h GLN 106 CO -0.24 0.95 0.23 0.00 -0.67 0.00 0.00 178.83 179.10 3iv8 h ALA 107 N 0.89 0.47 -0.62 3.87 0.00 0.31 0.15 119.26 124.33 3iv8 h ALA 107 Ca 0.12 -0.05 0.08 0.00 0.00 0.00 0.00 54.91 55.06 3iv8 h ALA 107 Cb 0.61 -0.15 -0.06 0.00 0.00 0.00 0.00 17.79 18.18 3iv8 h ALA 107 CO 0.04 -0.04 0.28 0.82 0.00 0.00 0.00 179.25 180.35 3iv8 h ILE 108 N 0.49 0.86 -0.30 0.00 2.04 -0.85 -0.19 117.51 119.55 3iv8 h ILE 108 Ca 0.13 -0.18 -0.10 0.00 1.00 0.00 0.00 64.86 65.71 3iv8 h ILE 108 Cb -0.01 0.30 -0.01 0.00 -0.74 0.00 0.00 36.82 36.36 3iv8 h ILE 108 CO -0.03 0.09 -0.22 0.00 0.00 0.00 0.00 178.15 178.00 3iv8 h ALA 109 N 1.38 0.43 -0.62 1.87 0.00 -0.61 -1.87 119.26 119.84 3iv8 h ALA 109 Ca 0.30 -0.37 -0.03 0.00 0.00 0.00 0.00 54.91 54.80 3iv8 h ALA 109 Cb 0.30 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 17.96 3iv8 h ALA 109 CO -0.25 0.39 0.26 0.00 0.00 0.00 0.00 179.25 179.65 3iv8 h ALA 110 N 0.73 0.81 -0.02 0.00 0.00 -0.55 -0.83 119.26 119.41 3iv8 h ALA 110 Ca 0.06 -0.16 -0.00 0.00 0.00 0.00 0.00 54.91 54.80 3iv8 h ALA 110 Cb 0.77 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 18.32 3iv8 h ALA 110 CO 0.06 0.41 0.00 0.00 0.00 0.00 0.00 179.25 179.72 3iv8 h ALA 111 N 1.10 0.02 -0.99 0.00 0.00 -1.02 -1.14 119.26 117.24 3iv8 h ALA 111 Ca 0.21 -0.12 0.18 0.00 0.00 0.00 0.00 54.91 55.18 3iv8 h ALA 111 Cb 0.19 -0.01 -0.10 0.00 0.00 0.00 0.00 17.79 17.87 3iv8 h ALA 111 CO -0.02 -0.36 0.61 -0.09 0.00 0.00 0.00 179.25 179.40 3iv8 h ARG 112 N -0.21 0.72 -0.23 0.00 2.43 -1.19 0.19 114.38 116.09 3iv8 h ARG 112 Ca 0.00 -0.04 -0.19 0.00 -0.81 0.00 0.00 59.98 58.94 3iv8 h ARG 112 Cb 0.24 -0.16 0.00 0.00 -0.42 0.00 0.00 29.97 29.63 3iv8 h ARG 112 CO 0.00 0.48 -0.61 1.49 -1.51 0.00 0.00 179.97 179.82 3iv8 h GLU 113 N 0.75 0.78 0.12 0.20 4.81 -0.94 -2.92 114.58 117.38 3iv8 h GLU 113 Ca 0.55 -0.53 -0.01 0.00 -0.13 0.00 0.00 59.36 59.24 3iv8 h GLU 113 Cb 0.87 0.08 0.00 0.00 0.63 0.00 0.00 28.75 30.33 3iv8 h GLU 113 CO -0.32 1.15 -0.06 -0.92 -0.73 0.00 0.00 179.01 178.13 3iv8 h TYR 114 N 0.58 -0.15 0.00 0.92 3.20 0.12 -3.13 116.97 118.52 3iv8 h TYR 114 Ca -0.00 -0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.86 3iv8 h TYR 114 Cb 1.21 0.05 0.00 0.00 1.54 0.00 0.00 36.73 39.52 3iv8 h TYR 114 CO 0.07 0.28 0.00 1.96 -1.64 0.00 0.00 178.16 178.83 3iv8 h GLN 115 N -0.64 0.00 0.00 1.82 4.20 -0.79 -0.57 115.11 119.13 3iv8 h GLN 115 Ca -0.02 0.00 -0.09 0.00 0.06 0.00 0.00 58.65 58.60 3iv8 h GLN 115 Cb 0.49 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.26 3iv8 h GLN 115 CO 0.03 0.00 -0.45 0.00 -0.67 0.00 0.00 178.83 177.74 3iv8 h ALA 116 N 2.08 0.84 0.09 3.87 0.00 -1.45 -3.36 119.26 121.33 3iv8 h ALA 116 Ca 0.00 -0.41 -0.36 0.00 0.00 0.00 0.00 54.91 54.14 3iv8 h ALA 116 Cb 0.20 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 17.89 3iv8 h ALA 116 CO 0.00 0.56 -2.08 1.17 0.00 0.00 0.00 179.25 178.91 3iv8 n LYS 117 N -3.41 0.73 -4.26 0.00 4.81 -0.25 -4.88 118.16 110.88 3iv8 n LYS 117 Ca 0.01 0.24 -0.25 0.00 -0.87 0.00 0.00 58.31 57.43 3iv8 n LYS 117 Cb 0.61 -1.68 -0.17 0.00 0.02 0.00 0.00 35.03 33.82 3iv8 n LYS 117 CO 0.00 0.00 0.00 0.71 1.17 0.00 0.00 177.40 179.28 3iv8 s TYR 118 N -2.55 1.39 0.43 5.64 2.02 -1.01 -5.14 117.35 118.13 3iv8 s TYR 118 Ca -0.23 -0.58 -0.02 0.00 -0.37 0.00 0.00 57.07 55.87 3iv8 s TYR 118 Cb 0.07 -1.09 -0.02 0.00 -0.40 0.00 0.00 41.96 40.52 3iv8 s TYR 118 CO 0.74 -0.36 0.68 -1.25 -1.57 0.00 0.00 175.55 173.79 3iv8 s PRO 119 N 1.12 3.33 -1.44 -1.71 0.04 -1.26 -4.45 135.00 130.63 3iv8 s PRO 119 Ca -0.06 -0.21 0.00 0.00 0.04 0.00 0.00 61.00 60.77 3iv8 s PRO 119 Cb -0.14 -2.52 0.00 0.00 0.04 0.00 0.00 34.50 31.87 3iv8 s PRO 119 CO -0.01 -0.14 0.00 0.09 0.04 0.00 0.00 177.00 176.98 3iv8 n ASN 120 N -2.07 -4.67 0.00 6.66 3.02 -1.26 -4.85 115.26 112.09 3iv8 n ASN 120 Ca -0.01 0.19 0.00 0.00 -0.03 0.00 0.00 54.58 54.73 3iv8 n ASN 120 Cb 0.56 -3.64 0.00 0.00 -0.61 0.00 0.00 39.78 36.09 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 -2.50 0.00 -2.47 3.52 6.02 -1.26 -4.42 117.38 116.26 3iv8 n GLN 121 Ca -0.16 0.00 -0.43 0.00 -0.01 0.00 0.00 57.00 56.40 3iv8 n GLN 121 Cb 0.56 0.00 -0.02 0.00 1.02 0.00 0.00 30.24 31.80 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 -1.31 6.88 0.00 1.08 0.15 -1.26 0.75 113.70 119.99 3iv8 s SER 122 Ca 0.00 1.44 0.23 0.00 0.70 0.00 0.00 55.95 58.32 3iv8 s SER 122 Cb 0.00 -2.54 0.87 0.00 -1.71 0.00 0.00 66.02 62.64 3iv8 s SER 122 CO 0.00 -0.86 1.62 0.18 1.20 0.00 0.00 173.24 175.39 3iv8 n LEU 123 N 6.91 1.56 0.00 3.45 4.77 -0.40 -4.90 117.00 128.39 3iv8 n LEU 123 Ca 0.14 -0.61 0.00 0.00 -0.03 0.00 0.00 56.01 55.51 3iv8 n LEU 123 Cb 0.46 -0.07 0.00 0.00 -2.33 0.00 0.00 43.42 41.48 3iv8 n LEU 123 CO 0.58 0.31 0.00 0.61 -1.33 0.00 0.00 177.39 177.55 3iv8 n GLY 124 N 1.14 3.27 3.81 -0.72 0.00 -1.26 -4.53 105.19 106.90 3iv8 n GLY 124 Ca 0.17 -1.75 -0.34 0.00 0.00 0.00 0.00 46.02 44.11 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 3.93 -0.24 0.99 2.96 0.26 -3.61 118.68 122.97 3iv8 s LEU 125 Ca 0.00 1.78 0.02 0.00 -0.22 0.00 0.00 54.13 55.72 3iv8 s LEU 125 Cb 0.00 -4.52 0.05 0.00 0.50 0.00 0.00 46.19 42.22 3iv8 s LEU 125 CO 0.00 -0.49 -0.12 -2.28 -1.32 0.00 0.00 176.35 172.14 3iv8 s HIS 126 N -2.08 3.06 -0.71 5.38 5.65 0.98 -0.82 115.29 126.74 3iv8 s HIS 126 Ca 0.63 -2.12 -0.18 0.00 0.25 0.00 0.00 55.06 53.64 3iv8 s HIS 126 Cb -0.12 -1.88 0.13 0.00 -1.18 0.00 0.00 32.58 29.53 3iv8 s HIS 126 CO 0.16 -0.85 0.83 -0.51 -0.65 0.00 0.00 174.74 173.71 3iv8 s LEU 127 N 1.18 5.48 -1.07 8.88 1.43 -0.33 -1.35 118.68 132.89 3iv8 s LEU 127 Ca -0.06 -1.75 -0.22 0.00 -1.03 0.00 0.00 54.13 51.07 3iv8 s LEU 127 Cb -0.19 -2.32 0.05 0.00 0.03 0.00 0.00 46.19 43.77 3iv8 s LEU 127 CO -0.07 -1.04 1.53 -0.70 0.23 0.00 0.00 176.35 176.31 3iv8 s GLU 128 N 2.36 3.62 0.00 1.70 2.12 -0.46 -1.45 118.70 126.58 3iv8 s GLU 128 Ca 0.18 -1.27 0.00 0.00 0.36 0.00 0.00 54.97 54.24 3iv8 s GLU 128 Cb -0.17 -5.38 0.00 0.00 0.26 0.00 0.00 34.13 28.84 3iv8 s GLU 128 CO 0.00 -2.29 0.00 0.41 -0.54 0.00 0.00 175.26 172.85 3iv8 n GLY 129 N 6.57 0.69 0.73 -1.50 0.00 -0.95 -2.04 105.19 108.69 3iv8 n GLY 129 Ca 0.37 -2.21 0.12 0.00 0.00 0.00 0.00 46.02 44.30 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 -0.39 1.98 -1.81 1.61 -0.04 -1.26 -4.71 135.00 130.38 3iv8 n PRO 130 Ca 0.00 -1.45 -0.42 0.00 -0.04 0.00 0.00 63.50 61.60 3iv8 n PRO 130 Cb 0.00 -1.46 -0.00 0.00 -0.04 0.00 0.00 33.50 32.00 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 0.71 3.29 -4.61 0.54 4.01 -1.26 -2.26 117.16 117.58 3iv8 n TYR 131 Ca 0.17 -2.95 -0.31 0.00 -0.16 0.00 0.00 57.90 54.65 3iv8 n TYR 131 Cb 0.45 -2.42 -0.07 0.00 -0.31 0.00 0.00 39.34 36.98 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 1.45 2.49 -0.13 7.72 1.43 -1.26 -0.91 118.68 129.46 3iv8 s LEU 132 Ca 0.48 -1.53 -0.15 0.00 -1.03 0.00 0.00 54.13 51.90 3iv8 s LEU 132 Cb 0.14 -0.85 -0.05 0.00 0.03 0.00 0.00 46.19 45.46 3iv8 s LEU 132 CO -0.07 -0.79 0.35 0.21 0.23 0.00 0.00 176.35 176.28 3iv8 s ASN 133 N -3.89 6.54 0.32 2.29 3.84 -0.87 -4.73 114.94 118.43 3iv8 s ASN 133 Ca 0.16 0.63 0.06 0.00 0.21 0.00 0.00 52.86 53.92 3iv8 s ASN 133 Cb 0.03 -2.22 0.73 0.00 -0.55 0.00 0.00 41.25 39.24 3iv8 s ASN 133 CO 0.09 0.09 1.82 1.62 -2.79 0.00 0.00 177.10 177.93 3iv8 h VAL 134 N 4.61 0.79 0.00 -5.21 3.04 -1.95 -2.61 116.25 114.92 3iv8 h VAL 134 Ca -0.42 -0.27 0.00 0.00 -1.01 0.00 0.00 66.70 65.00 3iv8 h VAL 134 Cb 1.17 -0.06 0.00 0.00 -2.01 0.00 0.00 31.29 30.39 3iv8 h VAL 134 CO 0.74 0.14 0.00 0.24 -1.01 0.00 0.00 177.57 177.69 3iv8 h MET 135 N 0.79 0.00 -1.03 4.17 2.86 -1.94 -2.55 114.93 117.24 3iv8 h MET 135 Ca 0.52 0.00 -0.52 0.00 -2.06 0.00 0.00 59.70 57.64 3iv8 h MET 135 Cb 0.77 0.00 -0.42 0.00 0.06 0.00 0.00 31.60 32.01 3iv8 h MET 135 CO -0.29 0.00 -0.85 1.17 1.06 0.00 0.00 176.91 178.00 3iv8 n LYS 136 N -2.92 3.13 0.15 1.72 3.00 -1.00 -4.91 118.16 117.34 3iv8 n LYS 136 Ca 0.00 -4.15 -0.13 0.00 -0.00 0.00 0.00 58.31 54.03 3iv8 n LYS 136 Cb 0.25 -2.11 -0.06 0.00 0.00 0.00 0.00 35.03 33.11 3iv8 n LYS 136 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 177.40 178.97 3iv8 h LYS 137 N 2.45 -0.49 0.00 1.64 2.10 -1.32 -3.42 116.57 117.52 3iv8 h LYS 137 Ca 0.25 0.03 0.00 0.00 -2.00 0.00 0.00 60.65 58.93 3iv8 h LYS 137 Cb 1.25 0.11 0.00 0.00 -0.90 0.00 0.00 32.23 32.69 3iv8 h LYS 137 CO 0.71 -0.33 0.00 0.41 -2.00 0.00 0.00 179.45 178.24 3iv8 n GLY 138 N -1.38 3.14 0.08 0.07 0.00 -1.26 -2.96 105.19 102.89 3iv8 n GLY 138 Ca -0.08 -0.29 0.08 0.00 0.00 0.00 0.00 46.02 45.73 3iv8 n GLY 138 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 3iv8 n ILE 139 N 0.00 1.22 -2.35 -0.61 -0.00 -1.26 -4.76 119.36 111.60 3iv8 n ILE 139 Ca 0.00 0.46 -0.42 0.00 -0.00 0.00 0.00 62.75 62.78 3iv8 n ILE 139 Cb 0.00 -1.39 -0.03 0.00 -0.00 0.00 0.00 39.64 38.22 3iv8 n ILE 139 CO 0.00 0.00 0.00 -1.00 -0.00 0.00 0.00 176.55 175.55 3iv8 s HIS 140 N -3.25 2.89 0.09 1.39 3.76 -1.15 -4.95 115.29 114.07 3iv8 s HIS 140 Ca 0.02 0.96 -0.31 0.00 -0.15 0.00 0.00 55.06 55.58 3iv8 s HIS 140 Cb 0.06 -3.55 -0.10 0.00 1.11 0.00 0.00 32.58 30.10 3iv8 s HIS 140 CO 0.21 -1.94 1.88 0.45 -0.85 0.00 0.00 174.74 174.49 3iv8 s SER 141 N 1.90 6.43 0.51 1.40 0.15 -1.26 -4.85 113.70 117.98 3iv8 s SER 141 Ca 0.59 2.73 0.34 0.00 0.70 0.00 0.00 55.95 60.31 3iv8 s SER 141 Cb -0.26 -2.55 1.48 0.00 -1.71 0.00 0.00 66.02 62.97 3iv8 s SER 141 CO 0.21 -1.02 1.77 0.58 1.20 0.00 0.00 173.24 175.98 3iv8 h VAL 142 N 5.02 0.38 -0.20 4.45 2.07 -1.93 -0.80 116.25 125.23 3iv8 h VAL 142 Ca -0.47 -0.03 0.00 0.00 0.82 0.00 0.00 66.70 67.02 3iv8 h VAL 142 Cb 1.22 0.29 -0.01 0.00 -1.52 0.00 0.00 31.29 31.28 3iv8 h VAL 142 CO 0.95 0.01 0.13 0.44 0.02 0.00 0.00 177.57 179.12 3iv8 h ASP 143 N 0.08 0.23 0.00 0.57 3.32 -2.00 -3.22 116.42 115.40 3iv8 h ASP 143 Ca 0.62 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.66 3iv8 h ASP 143 Cb 2.26 -0.06 0.00 0.00 0.22 0.00 0.00 39.33 41.75 3iv8 h ASP 143 CO -0.09 0.17 -0.73 0.49 -1.72 0.00 0.00 179.24 177.35 3iv8 n PHE 144 N -4.51 0.00 -2.05 4.55 3.01 -0.32 -4.94 117.46 113.19 3iv8 n PHE 144 Ca -0.00 0.00 -0.42 0.00 1.01 0.00 0.00 57.45 58.04 3iv8 n PHE 144 Cb 0.07 -0.05 -0.03 0.00 -0.01 0.00 0.00 39.48 39.47 3iv8 n PHE 144 CO 0.00 0.00 0.00 0.42 1.01 0.00 0.00 176.76 178.19 3iv8 s ILE 145 N -2.22 3.65 0.13 4.37 1.01 -1.13 -4.83 121.20 122.18 3iv8 s ILE 145 Ca 0.03 0.78 -0.02 0.00 0.00 0.00 0.00 60.65 61.44 3iv8 s ILE 145 Cb 0.08 -3.53 -0.04 0.00 0.01 0.00 0.00 42.46 38.99 3iv8 s ILE 145 CO 0.47 -0.10 0.08 0.00 0.00 0.00 0.00 174.94 175.40 3iv8 s ARG 146 N 4.10 0.94 0.66 2.79 3.03 -0.96 -4.98 118.95 124.53 3iv8 s ARG 146 Ca 0.72 -1.39 -0.15 0.00 2.03 0.00 0.00 55.73 56.93 3iv8 s ARG 146 Cb -0.31 0.26 -0.00 0.00 -1.03 0.00 0.00 34.95 33.87 3iv8 s ARG 146 CO 0.28 -0.27 1.12 -1.25 -1.13 0.00 0.00 175.30 174.05 3iv8 s PRO 147 N -4.03 2.77 0.45 3.89 0.04 -1.26 -4.01 135.00 132.84 3iv8 s PRO 147 Ca 0.22 1.46 -0.24 0.00 0.04 0.00 0.00 61.00 62.48 3iv8 s PRO 147 Cb 0.07 -1.94 -0.07 0.00 0.04 0.00 0.00 34.50 32.59 3iv8 s PRO 147 CO 0.01 -1.29 1.27 -1.54 0.04 0.00 0.00 177.00 175.49 3iv8 s SER 148 N -2.44 6.05 0.15 6.66 1.04 -1.26 -4.92 113.70 118.98 3iv8 s SER 148 Ca 0.68 2.56 0.07 0.00 0.48 0.00 0.00 55.95 59.74 3iv8 s SER 148 Cb -0.22 -2.63 -0.04 0.00 0.10 0.00 0.00 66.02 63.23 3iv8 s SER 148 CO 0.41 -1.02 -0.14 1.51 0.98 0.00 0.00 173.24 174.97 3iv8 s ASP 149 N -0.99 2.22 0.24 7.02 -4.77 -1.26 -4.82 116.67 114.32 3iv8 s ASP 149 Ca 0.62 -0.90 -0.04 0.00 -3.30 0.00 0.00 52.55 48.92 3iv8 s ASP 149 Cb -0.35 -0.09 0.39 0.00 -1.09 0.00 0.00 42.92 41.77 3iv8 s ASP 149 CO 0.44 -0.16 1.82 0.44 0.70 0.00 0.00 175.17 178.40 3iv8 h ASP 150 N 3.12 0.70 0.06 2.11 3.32 -1.99 -3.01 116.42 120.73 3iv8 h ASP 150 Ca -0.39 0.04 0.00 0.00 0.02 0.00 0.00 57.03 56.70 3iv8 h ASP 150 Cb 1.20 -0.10 -0.02 0.00 0.22 0.00 0.00 39.33 40.64 3iv8 h ASP 150 CO 0.55 0.41 -0.20 0.74 -1.72 0.00 0.00 179.24 179.03 3iv8 h THR 151 N 0.82 0.00 -0.14 0.35 2.02 -1.99 0.74 112.91 114.71 3iv8 h THR 151 Ca 0.39 0.00 -0.07 0.00 0.77 0.00 0.00 66.41 67.51 3iv8 h THR 151 Cb 0.33 0.00 -0.01 0.00 -1.74 0.00 0.00 68.15 66.73 3iv8 h THR 151 CO -0.23 0.00 -0.21 -0.03 0.37 0.00 0.00 175.52 175.41 3iv8 h MET 152 N -0.29 0.23 -0.58 6.66 1.85 -1.99 -1.32 114.93 119.48 3iv8 h MET 152 Ca -0.00 -0.07 -0.08 0.00 -0.61 0.00 0.00 59.70 58.93 3iv8 h MET 152 Cb 0.29 -0.02 -0.02 0.00 0.43 0.00 0.00 31.60 32.27 3iv8 h MET 152 CO -0.10 0.44 0.04 0.82 -0.40 0.00 0.00 176.91 177.71 3iv8 h ILE 153 N 0.21 1.26 -0.59 1.77 1.08 -1.35 0.67 117.51 120.56 3iv8 h ILE 153 Ca 0.04 -1.08 -0.10 0.00 -0.39 0.00 0.00 64.86 63.33 3iv8 h ILE 153 Cb 0.50 0.81 -0.02 0.00 -3.07 0.00 0.00 36.82 35.04 3iv8 h ILE 153 CO 0.03 0.39 -0.01 0.44 -0.69 0.00 0.00 178.15 178.32 3iv8 h ASP 154 N 0.90 1.03 -0.14 1.72 3.32 0.06 0.65 116.42 123.96 3iv8 h ASP 154 Ca 0.17 -0.31 0.04 0.00 0.02 0.00 0.00 57.03 56.95 3iv8 h ASP 154 Cb 0.50 -0.28 -0.04 0.00 0.22 0.00 0.00 39.33 39.73 3iv8 h ASP 154 CO 0.02 1.09 -0.11 0.74 -1.72 0.00 0.00 179.24 179.26 3iv8 h THR 155 N 0.95 0.68 -0.52 0.35 2.02 -1.05 -1.46 112.91 113.87 3iv8 h THR 155 Ca 0.17 0.00 0.01 0.00 0.77 0.00 0.00 66.41 67.36 3iv8 h THR 155 Cb 0.57 0.68 -0.03 0.00 -1.74 0.00 0.00 68.15 67.63 3iv8 h THR 155 CO 0.03 0.00 0.33 0.40 0.37 0.00 0.00 175.52 176.65 3iv8 h ILE 156 N -0.12 1.11 0.00 3.11 2.04 -0.53 -2.29 117.51 120.83 3iv8 h ILE 156 Ca 0.09 -0.23 -0.04 0.00 1.00 0.00 0.00 64.86 65.68 3iv8 h ILE 156 Cb 0.26 0.38 -0.01 0.00 -0.74 0.00 0.00 36.82 36.71 3iv8 h ILE 156 CO -0.22 0.12 -0.20 0.00 0.00 0.00 0.00 178.15 177.86 3iv8 n ALA 158 N -2.43 2.41 -0.77 0.00 0.00 -0.57 -3.09 120.51 116.07 3iv8 n ALA 158 Ca -0.02 -0.11 0.08 0.00 0.00 0.00 0.00 53.44 53.38 3iv8 n ALA 158 Cb 0.27 -1.44 0.20 0.00 0.00 0.00 0.00 19.45 18.48 3iv8 n ALA 158 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 3iv8 n ASN 159 N -1.55 3.29 0.22 0.00 3.02 -0.58 -4.74 115.26 114.92 3iv8 n ASN 159 Ca 0.07 -2.75 0.08 0.00 -0.03 0.00 0.00 54.58 51.95 3iv8 n ASN 159 Cb 0.35 -0.42 0.41 0.00 -0.61 0.00 0.00 39.78 39.50 3iv8 n ASN 159 CO 0.00 0.00 0.00 0.77 -2.62 0.00 0.00 177.26 175.41 3iv8 h SER 160 N 1.41 0.00 -0.04 6.41 4.64 -1.43 0.35 113.55 124.89 3iv8 h SER 160 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3iv8 h SER 160 Cb 1.15 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.24 3iv8 h SER 160 CO 0.12 0.00 0.00 -0.90 -0.87 0.00 0.00 176.83 175.18 3iv8 n ASP 161 N -2.26 0.45 0.00 4.97 3.85 -1.26 -3.58 116.55 118.72 3iv8 n ASP 161 Ca -0.01 -1.51 0.00 0.00 -0.71 0.00 0.00 54.79 52.56 3iv8 n ASP 161 Cb 0.43 -0.03 0.00 0.00 -1.35 0.00 0.00 41.12 40.17 3iv8 n ASP 161 CO 0.00 0.00 0.00 0.55 -1.01 0.00 0.00 177.20 176.74 3iv8 n VAL 162 N -0.49 0.00 -3.75 2.12 3.14 0.12 -5.01 118.33 114.47 3iv8 n VAL 162 Ca 0.14 0.00 -0.37 0.00 -2.96 0.00 0.00 64.34 61.15 3iv8 n VAL 162 Cb 0.13 1.16 -0.13 0.00 -1.06 0.00 0.00 33.84 33.95 3iv8 n VAL 162 CO 0.00 0.00 0.00 -0.63 -6.46 0.00 0.00 176.83 169.74 3iv8 s ILE 163 N 0.00 4.13 0.02 1.55 1.01 -1.04 -0.57 121.20 126.29 3iv8 s ILE 163 Ca 0.00 -0.47 -0.18 0.00 0.00 0.00 0.00 60.65 60.00 3iv8 s ILE 163 Cb 0.00 -3.05 -0.27 0.00 0.01 0.00 0.00 42.46 39.16 3iv8 s ILE 163 CO 0.00 0.18 1.07 0.00 0.00 0.00 0.00 174.94 176.20 3iv8 h ALA 164 N 8.25 0.02 -3.12 9.38 0.00 -1.21 -3.43 119.26 129.15 3iv8 h ALA 164 Ca -0.34 -0.67 -0.16 0.00 0.00 0.00 0.00 54.91 53.73 3iv8 h ALA 164 Cb 1.15 0.07 -0.26 0.00 0.00 0.00 0.00 17.79 18.76 3iv8 h ALA 164 CO 0.60 0.50 -0.42 0.21 0.00 0.00 0.00 179.25 180.14 3iv8 s LYS 165 N -3.01 0.30 -0.06 0.00 2.20 -0.77 -1.12 119.74 117.28 3iv8 s LYS 165 Ca -0.12 0.35 0.05 0.00 -0.36 0.00 0.00 55.97 55.90 3iv8 s LYS 165 Cb 0.04 0.14 -0.01 0.00 -1.51 0.00 0.00 37.83 36.50 3iv8 s LYS 165 CO 0.87 -0.04 -0.23 0.08 -0.36 0.00 0.00 175.35 175.68 3iv8 s VAL 166 N 0.14 1.87 -0.20 4.02 1.01 -0.33 -1.18 120.40 125.73 3iv8 s VAL 166 Ca -0.00 -0.96 -0.06 0.00 0.00 0.00 0.00 61.98 60.95 3iv8 s VAL 166 Cb -0.02 -1.59 -0.03 0.00 0.00 0.00 0.00 36.38 34.74 3iv8 s VAL 166 CO 0.00 0.52 0.04 -0.89 0.00 0.00 0.00 175.10 174.78 3iv8 s THR 167 N -0.08 4.42 0.07 3.92 2.01 -0.53 -0.14 115.64 125.32 3iv8 s THR 167 Ca -0.04 -0.16 -0.11 0.00 0.31 0.00 0.00 61.69 61.69 3iv8 s THR 167 Cb -0.13 -3.00 0.01 0.00 0.01 0.00 0.00 72.50 69.38 3iv8 s THR 167 CO 0.03 0.43 0.24 -1.48 -0.69 0.00 0.00 174.62 173.16 3iv8 s LEU 168 N 0.74 1.17 -0.35 4.42 0.05 0.42 -2.24 118.68 122.88 3iv8 s LEU 168 Ca 0.02 -0.44 -0.20 0.00 0.05 0.00 0.00 54.13 53.57 3iv8 s LEU 168 Cb -0.14 1.18 -0.00 0.00 -2.05 0.00 0.00 46.19 45.18 3iv8 s LEU 168 CO 0.02 -0.67 0.60 0.00 -0.55 0.00 0.00 176.35 175.74 3iv8 s ALA 169 N -3.23 3.47 -0.54 1.48 0.00 -0.09 -2.34 121.76 120.51 3iv8 s ALA 169 Ca -0.00 -0.89 0.24 0.00 0.00 0.00 0.00 51.96 51.31 3iv8 s ALA 169 Cb 0.02 -3.12 0.27 0.00 0.00 0.00 0.00 23.12 20.28 3iv8 s ALA 169 CO -0.08 -1.28 1.27 -1.00 0.00 0.00 0.00 175.76 174.67 3iv8 h PRO 170 N 8.44 0.00 -1.00 0.00 0.13 -1.89 -3.38 132.00 134.31 3iv8 h PRO 170 Ca -0.27 0.00 0.15 0.00 -0.87 0.00 0.00 66.00 65.01 3iv8 h PRO 170 Cb 1.12 0.00 -0.09 0.00 0.13 0.00 0.00 31.00 32.15 3iv8 h PRO 170 CO 0.81 0.00 0.62 1.05 -0.23 0.00 0.00 178.00 180.26 3iv8 h GLU 171 N 0.00 0.87 -0.02 0.86 9.09 -1.93 -1.16 114.58 122.28 3iv8 h GLU 171 Ca 0.00 -0.05 0.00 0.00 0.05 0.00 0.00 59.36 59.36 3iv8 h GLU 171 Cb 0.81 -0.20 0.00 0.00 -1.65 0.00 0.00 28.75 27.72 3iv8 h GLU 171 CO 0.00 0.57 -0.08 0.09 0.05 0.00 0.00 179.01 179.64 3iv8 n ASN 172 N -4.66 2.38 -4.94 3.06 5.03 -1.26 -5.01 115.26 109.86 3iv8 n ASN 172 Ca 0.20 -1.69 -0.24 0.00 0.87 0.00 0.00 54.58 53.72 3iv8 n ASN 172 Cb 0.44 0.10 0.01 0.00 -1.02 0.00 0.00 39.78 39.31 3iv8 n ASN 172 CO 0.00 0.00 0.00 0.20 -1.83 0.00 0.00 177.26 175.63 3iv8 s ASN 173 N -1.67 5.88 -0.09 6.41 0.01 -0.44 -4.99 114.94 120.05 3iv8 s ASN 173 Ca 0.20 0.41 -0.29 0.00 -0.71 0.00 0.00 52.86 52.47 3iv8 s ASN 173 Cb 0.15 -1.66 -0.05 0.00 0.41 0.00 0.00 41.25 40.10 3iv8 s ASN 173 CO 0.28 -0.70 1.72 -0.54 -1.51 0.00 0.00 177.10 176.35 3iv8 s LYS 174 N -4.60 4.03 0.23 -0.60 1.02 -1.26 -4.91 119.74 113.66 3iv8 s LYS 174 Ca 0.48 2.13 -0.08 0.00 0.02 0.00 0.00 55.97 58.52 3iv8 s LYS 174 Cb -0.10 -4.04 0.39 0.00 -0.52 0.00 0.00 37.83 33.56 3iv8 s LYS 174 CO 0.39 -1.03 1.65 -1.35 -0.92 0.00 0.00 175.35 174.09 3iv8 h PRO 175 N 10.25 0.11 -0.10 -1.68 0.11 -1.96 -0.47 132.00 138.25 3iv8 h PRO 175 Ca -0.40 -0.01 0.03 0.00 0.11 0.00 0.00 66.00 65.74 3iv8 h PRO 175 Cb 1.18 -0.03 -0.00 0.00 0.11 0.00 0.00 31.00 32.26 3iv8 h PRO 175 CO 0.96 0.08 0.43 0.93 -0.21 0.00 0.00 178.00 180.19 3iv8 h GLU 176 N 0.12 0.00 -0.01 1.05 3.07 -1.98 -0.33 114.58 116.50 3iv8 h GLU 176 Ca 0.38 0.00 -0.24 0.00 -0.50 0.00 0.00 59.36 59.00 3iv8 h GLU 176 Cb 0.65 0.00 0.02 0.00 -0.84 0.00 0.00 28.75 28.58 3iv8 h GLU 176 CO -0.61 0.00 -0.93 0.45 -1.40 0.00 0.00 179.01 176.52 3iv8 h HIS 177 N 0.00 0.95 -0.54 4.33 3.86 -1.47 -0.59 115.15 121.69 3iv8 h HIS 177 Ca 0.05 -0.51 -0.02 0.00 -1.16 0.00 0.00 60.37 58.73 3iv8 h HIS 177 Cb 0.91 -0.11 -0.02 0.00 1.06 0.00 0.00 27.41 29.25 3iv8 h HIS 177 CO 0.00 1.35 0.27 0.82 0.86 0.00 0.00 177.93 181.22 3iv8 h ILE 178 N 0.29 1.20 -0.49 2.45 2.04 -1.17 -2.40 117.51 119.43 3iv8 h ILE 178 Ca -0.11 -0.55 0.08 0.00 1.00 0.00 0.00 64.86 65.28 3iv8 h ILE 178 Cb 1.60 0.57 -0.07 0.00 -0.74 0.00 0.00 36.82 38.17 3iv8 h ILE 178 CO 0.18 0.22 0.09 -0.33 0.00 0.00 0.00 178.15 178.31 3iv8 h GLU 179 N 0.73 0.21 -0.32 2.37 5.08 -1.17 -1.44 114.58 120.03 3iv8 h GLU 179 Ca 0.19 -0.01 -0.10 0.00 -1.00 0.00 0.00 59.36 58.43 3iv8 h GLU 179 Cb 0.11 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.30 3iv8 h GLU 179 CO -0.02 0.14 -0.23 0.87 -1.00 0.00 0.00 179.01 178.76 3iv8 h LYS 180 N 0.22 0.62 -0.14 2.33 1.57 -1.01 -2.63 116.57 117.53 3iv8 h LYS 180 Ca 0.24 -0.24 -0.17 0.00 -1.87 0.00 0.00 60.65 58.62 3iv8 h LYS 180 Cb 0.33 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.60 3iv8 h LYS 180 CO -0.33 0.80 -0.62 -0.07 -0.57 0.00 0.00 179.45 178.67 3iv8 h LEU 181 N 0.55 0.55 -0.12 2.94 3.38 -1.05 -1.34 115.31 120.20 3iv8 h LEU 181 Ca 0.08 -0.31 -0.05 0.00 0.09 0.00 0.00 57.88 57.69 3iv8 h LEU 181 Cb 0.69 -0.16 -0.00 0.00 0.09 0.00 0.00 40.66 41.28 3iv8 h LEU 181 CO 0.05 1.03 -0.10 0.58 0.09 0.00 0.00 178.44 180.09 3iv8 h VAL 182 N 0.35 1.34 0.00 1.22 2.07 -1.21 -1.31 116.25 118.71 3iv8 h VAL 182 Ca -0.01 -1.21 -0.03 0.00 0.82 0.00 0.00 66.70 66.26 3iv8 h VAL 182 Cb 1.17 1.87 -0.00 0.00 -1.52 0.00 0.00 31.29 32.80 3iv8 h VAL 182 CO 0.11 0.35 -0.16 0.50 0.02 0.00 0.00 177.57 178.39 3iv8 h LYS 183 N -0.09 0.00 0.00 1.57 3.64 -1.49 0.21 116.57 120.42 3iv8 h LYS 183 Ca 0.02 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.40 3iv8 h LYS 183 Cb 0.60 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.42 3iv8 h LYS 183 CO 0.03 0.16 0.00 0.00 -2.27 0.00 0.00 179.45 177.36 3iv8 n ALA 184 N -2.44 1.84 -0.65 5.00 0.00 -0.51 -4.91 120.51 118.85 3iv8 n ALA 184 Ca -0.02 -0.06 0.00 0.00 0.00 0.00 0.00 53.44 53.35 3iv8 n ALA 184 Cb 0.24 -1.29 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 0.35 0.63 3.81 0.00 0.00 0.74 -4.74 105.19 105.98 3iv8 n GLY 185 Ca 0.05 -0.45 -0.37 0.00 0.00 0.00 0.00 46.02 45.25 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 -2.00 5.31 -0.01 -0.61 1.01 -0.52 -4.97 121.20 119.41 3iv8 s ILE 186 Ca 0.00 0.48 -0.30 0.00 0.00 0.00 0.00 60.65 60.83 3iv8 s ILE 186 Cb 0.00 -3.56 -0.04 0.00 0.01 0.00 0.00 42.46 38.87 3iv8 s ILE 186 CO 0.00 0.53 1.18 -0.69 0.00 0.00 0.00 174.94 175.96 3iv8 s VAL 187 N -0.52 4.24 -0.25 2.92 1.01 -0.27 -4.04 120.40 123.49 3iv8 s VAL 187 Ca 0.17 1.59 -0.09 0.00 0.00 0.00 0.00 61.98 63.66 3iv8 s VAL 187 Cb -0.14 -4.02 -0.04 0.00 0.00 0.00 0.00 36.38 32.19 3iv8 s VAL 187 CO 0.06 0.06 0.11 -0.69 0.00 0.00 0.00 175.10 174.64 3iv8 s VAL 188 N 1.68 4.75 -0.06 2.92 1.01 -1.26 -1.19 120.40 128.24 3iv8 s VAL 188 Ca 0.56 -0.03 0.03 0.00 0.00 0.00 0.00 61.98 62.55 3iv8 s VAL 188 Cb -0.26 -3.22 -0.02 0.00 0.00 0.00 0.00 36.38 32.88 3iv8 s VAL 188 CO 0.25 0.33 -0.16 -0.55 0.00 0.00 0.00 175.10 174.97 3iv8 s SER 189 N 1.47 3.86 0.05 3.32 0.15 0.81 -1.77 113.70 121.58 3iv8 s SER 189 Ca 0.06 -0.27 -0.26 0.00 0.70 0.00 0.00 55.95 56.18 3iv8 s SER 189 Cb -0.15 -0.95 -0.05 0.00 -1.71 0.00 0.00 66.02 63.15 3iv8 s SER 189 CO 0.06 0.30 0.79 -0.51 1.20 0.00 0.00 173.24 175.08 3iv8 s ILE 190 N -0.47 4.71 0.09 6.45 2.07 0.35 -0.44 121.20 133.97 3iv8 s ILE 190 Ca 0.06 1.69 -0.27 0.00 -1.41 0.00 0.00 60.65 60.72 3iv8 s ILE 190 Cb -0.12 -4.14 0.09 0.00 0.13 0.00 0.00 42.46 38.42 3iv8 s ILE 190 CO 0.02 0.35 1.10 -0.83 -1.91 0.00 0.00 174.94 173.67 3iv8 s GLY 191 N -0.01 -0.23 -1.50 1.50 0.00 -0.99 -0.07 107.32 106.01 3iv8 s GLY 191 Ca 0.40 0.24 -0.02 0.00 0.00 0.00 0.00 44.72 45.34 3iv8 s GLY 191 CO 0.24 0.75 0.26 1.42 0.00 0.00 0.00 173.10 175.77 3iv8 n HIS 192 N -0.54 -1.46 -4.21 1.90 8.25 -0.47 -3.50 115.22 115.19 3iv8 n HIS 192 Ca -0.06 0.69 -0.20 0.00 -0.26 0.00 0.00 57.72 57.89 3iv8 n HIS 192 Cb 0.61 -3.22 -0.12 0.00 1.12 0.00 0.00 29.99 28.38 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 -4.09 1.31 -0.30 1.59 -1.32 -0.91 -2.05 115.64 109.86 3iv8 s THR 193 Ca 0.07 -1.41 0.09 0.00 -1.21 0.00 0.00 61.69 59.23 3iv8 s THR 193 Cb -0.04 -1.25 0.54 0.00 -1.51 0.00 0.00 72.50 70.24 3iv8 s THR 193 CO 0.95 -0.19 1.54 -3.20 -2.21 0.00 0.00 174.62 171.50 3iv8 n ASN 194 N 1.16 2.88 -4.79 8.08 5.15 -1.26 -2.99 115.26 123.50 3iv8 n ASN 194 Ca -0.20 -3.65 -0.33 0.00 -0.60 0.00 0.00 54.58 49.80 3iv8 n ASN 194 Cb 0.54 -0.66 0.02 0.00 -0.53 0.00 0.00 39.78 39.15 3iv8 n ASN 194 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3iv8 s ALA 195 N -3.20 2.65 0.93 5.20 0.00 -1.26 -4.93 121.76 121.16 3iv8 s ALA 195 Ca 0.46 0.47 -0.14 0.00 0.00 0.00 0.00 51.96 52.75 3iv8 s ALA 195 Cb 0.41 -3.27 0.20 0.00 0.00 0.00 0.00 23.12 20.46 3iv8 s ALA 195 CO 0.03 -0.96 1.28 0.95 0.00 0.00 0.00 175.76 177.06 3iv8 s THR 196 N -2.38 2.01 0.11 0.00 -4.23 -1.26 -4.18 115.64 105.71 3iv8 s THR 196 Ca 0.65 -0.10 -0.23 0.00 -1.18 0.00 0.00 61.69 60.84 3iv8 s THR 196 Cb -0.18 -2.92 -0.09 0.00 1.34 0.00 0.00 72.50 70.65 3iv8 s THR 196 CO 0.38 0.00 1.71 0.22 -0.54 0.00 0.00 174.62 176.38 3iv8 h TYR 197 N -1.50 -0.17 -0.41 3.99 3.20 -1.90 -1.16 116.97 119.02 3iv8 h TYR 197 Ca -0.43 0.01 0.08 0.00 3.14 0.00 0.00 58.73 61.53 3iv8 h TYR 197 Cb 1.23 0.08 -0.09 0.00 1.54 0.00 0.00 36.73 39.50 3iv8 h TYR 197 CO -1.09 -0.11 -0.23 0.77 -1.64 0.00 0.00 178.16 175.86 3iv8 h SER 198 N -0.10 -0.78 -0.49 -2.11 0.02 -1.94 0.23 113.55 108.38 3iv8 h SER 198 Ca 0.04 0.17 -0.08 0.00 -0.84 0.00 0.00 61.79 61.07 3iv8 h SER 198 Cb 0.16 0.40 -0.02 0.00 0.14 0.00 0.00 62.40 63.08 3iv8 h SER 198 CO -0.10 -0.26 0.01 -0.33 -1.14 0.00 0.00 176.83 175.02 3iv8 h GLU 199 N -0.16 0.91 -0.34 3.45 5.08 -1.92 -1.28 114.58 120.32 3iv8 h GLU 199 Ca 0.19 -0.26 -0.04 0.00 -1.00 0.00 0.00 59.36 58.25 3iv8 h GLU 199 Cb 0.46 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.60 3iv8 h GLU 199 CO -0.50 0.90 0.04 0.00 -1.00 0.00 0.00 179.01 178.45 3iv8 h ALA 200 N 1.16 0.46 -0.80 3.43 0.00 -0.42 -1.16 119.26 121.93 3iv8 h ALA 200 Ca 0.16 -0.21 0.02 0.00 0.00 0.00 0.00 54.91 54.88 3iv8 h ALA 200 Cb 0.49 -0.13 -0.05 0.00 0.00 0.00 0.00 17.79 18.10 3iv8 h ALA 200 CO 0.02 0.17 0.52 0.00 0.00 0.00 0.00 179.25 179.96 3iv8 h ARG 201 N 0.40 1.00 -0.56 0.00 3.08 -0.87 -1.46 114.38 115.97 3iv8 h ARG 201 Ca 0.10 -0.06 0.05 0.00 0.07 0.00 0.00 59.98 60.14 3iv8 h ARG 201 Cb 0.38 -0.22 -0.05 0.00 0.08 0.00 0.00 29.97 30.16 3iv8 h ARG 201 CO 0.01 0.66 0.30 0.87 -1.07 0.00 0.00 179.97 180.74 3iv8 h LYS 202 N 1.03 0.56 0.00 0.04 1.57 -0.93 -1.71 116.57 117.12 3iv8 h LYS 202 Ca 0.31 -0.03 -0.02 0.00 -1.87 0.00 0.00 60.65 59.03 3iv8 h LYS 202 Cb -0.04 -0.13 -0.00 0.00 0.08 0.00 0.00 32.23 32.14 3iv8 h LYS 202 CO -0.09 0.37 -0.11 0.66 -0.57 0.00 0.00 179.45 179.70 3iv8 h SER 203 N 0.57 0.00 -0.15 0.86 4.64 -0.48 -0.90 113.55 118.09 3iv8 h SER 203 Ca 0.24 0.00 -0.17 0.00 -0.47 0.00 0.00 61.79 61.39 3iv8 h SER 203 Cb 0.13 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.22 3iv8 h SER 203 CO -0.15 0.11 -0.55 -0.26 -0.87 0.00 0.00 176.83 175.11 3iv8 h PHE 204 N 0.00 0.92 -0.44 4.77 0.04 -0.42 -1.65 116.94 120.16 3iv8 h PHE 204 Ca -0.00 -0.33 -0.04 0.00 2.80 0.00 0.00 57.97 60.40 3iv8 h PHE 204 Cb 0.34 -0.17 -0.02 0.00 2.20 0.00 0.00 35.95 38.29 3iv8 h PHE 204 CO 0.00 1.12 0.10 0.93 -0.60 0.00 0.00 178.31 179.85 3iv8 h GLU 205 N 0.57 0.67 0.00 1.51 4.39 -0.58 -0.96 114.58 120.18 3iv8 h GLU 205 Ca 0.01 -0.13 0.00 0.00 0.34 0.00 0.00 59.36 59.59 3iv8 h GLU 205 Cb 1.13 -0.11 0.00 0.00 -0.10 0.00 0.00 28.75 29.67 3iv8 h GLU 205 CO 0.11 0.62 0.00 0.43 -1.16 0.00 0.00 179.01 179.01 3iv8 n SER 206 N -4.30 0.61 0.00 1.42 7.64 -0.46 -4.91 113.62 113.62 3iv8 n SER 206 Ca 0.03 0.61 0.00 0.00 1.01 0.00 0.00 58.87 60.52 3iv8 n SER 206 Cb 0.21 -0.76 0.00 0.00 -1.01 0.00 0.00 64.21 62.66 3iv8 n SER 206 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3iv8 n GLY 207 N 0.51 0.77 3.69 0.23 0.00 -0.36 -3.98 105.19 106.04 3iv8 n GLY 207 Ca 0.04 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.61 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 0.28 -0.86 -0.61 5.41 -0.66 -4.61 119.36 118.31 3iv8 n ILE 208 Ca 0.00 -0.05 0.03 0.00 1.00 0.00 0.00 62.75 63.73 3iv8 n ILE 208 Cb 0.00 -1.93 0.05 0.00 -0.71 0.00 0.00 39.64 37.05 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 4.40 0.96 -3.64 1.39 -2.24 -0.73 -4.50 114.28 109.92 3iv8 n THR 209 Ca 0.18 -1.09 -0.15 0.00 -2.27 0.00 0.00 64.05 60.73 3iv8 n THR 209 Cb 0.34 0.34 -0.07 0.00 -2.10 0.00 0.00 70.33 68.83 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 -1.29 -0.37 -0.09 4.78 5.36 -1.23 -1.09 117.98 124.04 3iv8 s PHE 210 Ca 0.11 0.53 0.01 0.00 -0.96 0.00 0.00 56.93 56.62 3iv8 s PHE 210 Cb 0.09 0.25 0.02 0.00 -0.34 0.00 0.00 43.02 43.04 3iv8 s PHE 210 CO 0.01 -0.53 -0.09 0.00 -1.46 0.00 0.00 175.22 173.15 3iv8 s ALA 211 N -1.70 1.21 0.05 11.12 0.00 -0.14 -0.49 121.76 131.81 3iv8 s ALA 211 Ca -0.10 -0.43 -0.29 0.00 0.00 0.00 0.00 51.96 51.14 3iv8 s ALA 211 Cb -0.02 -0.73 -0.05 0.00 0.00 0.00 0.00 23.12 22.32 3iv8 s ALA 211 CO 0.04 -0.19 0.91 0.99 0.00 0.00 0.00 175.76 177.51 3iv8 s THR 212 N 1.27 4.70 -0.14 0.00 2.01 0.90 -1.65 115.64 122.72 3iv8 s THR 212 Ca -0.04 1.94 -0.12 0.00 0.31 0.00 0.00 61.69 63.78 3iv8 s THR 212 Cb -0.14 -4.26 0.02 0.00 0.01 0.00 0.00 72.50 68.13 3iv8 s THR 212 CO -0.03 0.27 0.20 0.00 -0.69 0.00 0.00 174.62 174.37 3iv8 n HIS 213 N 3.21 -0.81 -1.54 4.92 1.44 -1.22 -4.77 115.22 116.44 3iv8 n HIS 213 Ca 0.02 0.34 -0.55 0.00 -2.01 0.00 0.00 57.72 55.52 3iv8 n HIS 213 Cb 0.50 -0.53 -0.07 0.00 0.12 0.00 0.00 29.99 30.02 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 -0.05 0.81 0.00 2.39 7.94 0.70 -1.93 117.00 126.87 3iv8 n LEU 214 Ca -0.03 1.14 0.00 0.00 -1.11 0.00 0.00 56.01 56.01 3iv8 n LEU 214 Cb 0.21 -1.06 0.00 0.00 0.53 0.00 0.00 43.42 43.10 3iv8 n LEU 214 CO 0.17 -1.50 0.00 0.49 -1.11 0.00 0.00 177.39 175.43 3iv8 n PHE 215 N 1.93 0.00 -3.21 1.96 3.72 -1.26 -4.80 117.46 115.81 3iv8 n PHE 215 Ca 0.19 0.00 -0.39 0.00 -0.05 0.00 0.00 57.45 57.20 3iv8 n PHE 215 Cb 0.14 0.00 -0.06 0.00 -0.94 0.00 0.00 39.48 38.63 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 0.38 7.03 -1.31 4.37 -0.87 -0.81 -4.43 114.94 119.30 3iv8 s ASN 216 Ca 0.00 1.22 -0.01 0.00 -1.57 0.00 0.00 52.86 52.50 3iv8 s ASN 216 Cb 0.00 -2.37 -0.00 0.00 -0.02 0.00 0.00 41.25 38.86 3iv8 s ASN 216 CO 0.00 0.15 0.67 0.00 -2.57 0.00 0.00 177.10 175.36 3iv8 n ALA 217 N 2.39 -2.04 -3.50 0.60 0.00 -1.26 -4.64 120.51 112.06 3iv8 n ALA 217 Ca -0.08 -0.18 -0.15 0.00 0.00 0.00 0.00 53.44 53.03 3iv8 n ALA 217 Cb 0.51 -2.02 -0.07 0.00 0.00 0.00 0.00 19.45 17.86 3iv8 n ALA 217 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 177.50 178.91 3iv8 s MET 218 N -6.01 0.86 0.09 0.00 0.00 -1.26 -1.36 119.30 111.61 3iv8 s MET 218 Ca 0.03 0.53 -0.31 0.00 0.00 0.00 0.00 55.69 55.94 3iv8 s MET 218 Cb -0.01 0.41 -0.07 0.00 0.00 0.00 0.00 34.83 35.16 3iv8 s MET 218 CO 0.82 -0.19 1.33 -0.08 0.00 0.00 0.00 175.02 176.90 3iv8 s THR 219 N -0.43 3.57 0.66 10.11 -1.32 -1.16 -4.94 115.64 122.12 3iv8 s THR 219 Ca -0.06 1.11 -0.03 0.00 -1.21 0.00 0.00 61.69 61.50 3iv8 s THR 219 Cb -0.03 -3.71 0.07 0.00 -1.51 0.00 0.00 72.50 67.32 3iv8 s THR 219 CO 0.05 0.08 0.94 -2.16 -2.21 0.00 0.00 174.62 171.31 3iv8 s PRO 220 N 1.22 2.19 -0.52 7.08 0.04 -1.26 -1.61 135.00 142.14 3iv8 s PRO 220 Ca 0.63 -0.57 -0.26 0.00 0.04 0.00 0.00 61.00 60.84 3iv8 s PRO 220 Cb -0.34 -2.30 0.03 0.00 0.04 0.00 0.00 34.50 31.94 3iv8 s PRO 220 CO 0.29 -1.12 0.99 1.41 0.04 0.00 0.00 177.00 178.62 3iv8 s MET 221 N -5.08 3.46 0.31 4.56 1.75 -1.23 -3.67 119.30 119.39 3iv8 s MET 221 Ca 0.60 0.03 0.10 0.00 -1.25 0.00 0.00 55.69 55.18 3iv8 s MET 221 Cb -0.10 -3.99 -0.05 0.00 2.84 0.00 0.00 34.83 33.53 3iv8 s MET 221 CO 0.43 -1.42 -0.09 0.14 -0.65 0.00 0.00 175.02 173.43 3iv8 s VAL 222 N 4.10 2.65 0.18 10.11 -7.23 -0.79 -4.98 120.40 124.43 3iv8 s VAL 222 Ca 0.36 -2.16 -0.27 0.00 -1.81 0.00 0.00 61.98 58.11 3iv8 s VAL 222 Cb -0.10 -2.60 0.03 0.00 0.56 0.00 0.00 36.38 34.26 3iv8 s VAL 222 CO 0.24 -0.30 1.55 1.23 -0.31 0.00 0.00 175.10 177.51 3iv8 h GLY 223 N 2.02 -0.55 -1.48 2.32 0.00 -1.98 0.11 103.07 103.51 3iv8 h GLY 223 Ca -0.42 0.68 0.00 0.00 0.00 0.00 0.00 47.33 47.59 3iv8 h GLY 223 CO 0.64 -0.07 0.00 0.54 0.00 0.00 0.00 176.54 177.65 3iv8 n ARG 224 N -5.35 2.11 -3.37 4.80 1.74 -1.26 -4.68 116.66 110.65 3iv8 n ARG 224 Ca 0.03 -1.64 -0.18 0.00 -0.77 0.00 0.00 57.85 55.30 3iv8 n ARG 224 Cb 0.32 -1.46 -0.08 0.00 -1.02 0.00 0.00 32.46 30.22 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 -1.81 0.63 0.65 5.56 2.56 0.02 -5.02 118.70 121.30 3iv8 s GLU 225 Ca 0.34 -0.89 0.40 0.00 0.00 0.00 0.00 54.97 54.82 3iv8 s GLU 225 Cb 0.20 -0.76 2.24 0.00 2.00 0.00 0.00 34.13 37.82 3iv8 s GLU 225 CO 0.30 -1.20 2.31 -1.35 -0.56 0.00 0.00 175.26 174.77 3iv8 h PRO 226 N 7.06 0.00 0.00 4.30 0.11 -1.82 -2.11 132.00 139.53 3iv8 h PRO 226 Ca 0.05 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.16 3iv8 h PRO 226 Cb 1.05 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.16 3iv8 h PRO 226 CO 0.20 0.00 0.00 0.41 -0.21 0.00 0.00 178.00 178.40 3iv8 n GLY 227 N -1.15 0.12 0.15 -0.55 0.00 -1.24 -0.83 105.19 101.69 3iv8 n GLY 227 Ca -0.03 -0.98 -0.18 0.00 0.00 0.00 0.00 46.02 44.83 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 0.00 1.41 -0.58 1.61 2.07 -1.47 -1.95 116.25 117.34 3iv8 h VAL 228 Ca 0.00 -2.15 0.10 0.00 0.82 0.00 0.00 66.70 65.46 3iv8 h VAL 228 Cb 0.00 2.62 -0.08 0.00 -1.52 0.00 0.00 31.29 32.31 3iv8 h VAL 228 CO 0.00 0.63 0.17 0.58 0.02 0.00 0.00 177.57 178.97 3iv8 h VAL 229 N -0.04 0.72 -0.26 2.57 2.07 -1.63 0.47 116.25 120.14 3iv8 h VAL 229 Ca -0.09 -0.11 -0.05 0.00 0.82 0.00 0.00 66.70 67.27 3iv8 h VAL 229 Cb 1.42 0.37 -0.01 0.00 -1.52 0.00 0.00 31.29 31.54 3iv8 h VAL 229 CO 0.14 0.06 -0.02 1.23 0.02 0.00 0.00 177.57 178.99 3iv8 h GLY 230 N 0.32 0.51 -0.09 2.17 0.00 -1.01 -1.78 103.07 103.20 3iv8 h GLY 230 Ca 0.30 -0.39 0.19 0.00 0.00 0.00 0.00 47.33 47.43 3iv8 h GLY 230 CO -0.34 0.36 0.34 0.00 0.00 0.00 0.00 176.54 176.90 3iv8 h ALA 231 N 0.79 1.28 -0.26 3.60 0.00 -0.76 -1.40 119.26 122.51 3iv8 h ALA 231 Ca 0.07 0.15 -0.15 0.00 0.00 0.00 0.00 54.91 54.98 3iv8 h ALA 231 Cb 0.46 0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.38 3iv8 h ALA 231 CO 0.02 -0.29 -0.44 0.82 0.00 0.00 0.00 179.25 179.36 3iv8 h ILE 232 N 0.41 1.30 0.00 0.00 2.04 -0.60 -2.57 117.51 118.08 3iv8 h ILE 232 Ca 0.50 -1.62 -0.02 0.00 1.00 0.00 0.00 64.86 64.72 3iv8 h ILE 232 Cb 0.90 1.57 -0.00 0.00 -0.74 0.00 0.00 36.82 38.54 3iv8 h ILE 232 CO -0.49 0.52 -0.10 1.88 0.00 0.00 0.00 178.15 179.95 3iv8 h TYR 233 N 0.52 0.00 -0.04 1.37 0.99 -0.58 -2.92 116.97 116.30 3iv8 h TYR 233 Ca 0.04 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.77 3iv8 h TYR 233 Cb 0.97 0.00 0.00 0.00 1.00 0.00 0.00 36.73 38.70 3iv8 h TYR 233 CO 0.04 0.10 0.00 -3.47 -0.00 0.00 0.00 178.16 174.84 3iv8 n ASP 234 N -3.51 2.85 -3.94 3.88 2.03 -0.60 -4.83 116.55 112.44 3iv8 n ASP 234 Ca -0.02 -1.92 -0.30 0.00 0.52 0.00 0.00 54.79 53.07 3iv8 n ASP 234 Cb 0.24 -0.01 -0.15 0.00 -0.72 0.00 0.00 41.12 40.48 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 -1.81 2.05 0.57 5.18 2.01 -1.03 -4.99 115.64 117.63 3iv8 s THR 235 Ca 0.26 -2.42 0.27 0.00 0.31 0.00 0.00 61.69 60.12 3iv8 s THR 235 Cb 0.18 -2.50 0.35 0.00 0.01 0.00 0.00 72.50 70.55 3iv8 s THR 235 CO 0.28 -0.68 2.11 -0.65 -0.69 0.00 0.00 174.62 174.99 3iv8 h PRO 236 N 7.39 0.00 0.00 4.92 0.11 -1.88 -2.03 132.00 140.51 3iv8 h PRO 236 Ca -0.06 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.05 3iv8 h PRO 236 Cb 0.99 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.10 3iv8 h PRO 236 CO 0.54 0.00 0.00 0.39 -0.21 0.00 0.00 178.00 178.72 3iv8 n GLU 237 N -3.96 0.15 -3.51 1.05 4.71 -1.26 -4.83 120.64 112.99 3iv8 n GLU 237 Ca 0.01 0.16 -0.38 0.00 -0.01 0.00 0.00 57.16 56.94 3iv8 n GLU 237 Cb 0.30 -1.69 -0.10 0.00 -1.01 0.00 0.00 31.44 28.93 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 -3.08 5.26 0.59 2.62 1.01 -0.77 -4.87 120.40 121.17 3iv8 s VAL 238 Ca 0.11 0.32 -0.16 0.00 0.00 0.00 0.00 61.98 62.26 3iv8 s VAL 238 Cb 0.14 -3.59 -0.04 0.00 0.00 0.00 0.00 36.38 32.89 3iv8 s VAL 238 CO 0.54 0.22 1.05 -0.31 0.00 0.00 0.00 175.10 176.60 3iv8 s TYR 239 N 1.87 3.01 -0.04 5.22 2.02 -0.25 -4.90 117.35 124.28 3iv8 s TYR 239 Ca 0.10 1.51 -0.01 0.00 -0.37 0.00 0.00 57.07 58.30 3iv8 s TYR 239 Cb -0.16 -3.00 0.03 0.00 -0.40 0.00 0.00 41.96 38.44 3iv8 s TYR 239 CO 0.11 -1.09 0.06 0.00 -1.57 0.00 0.00 175.55 173.06 3iv8 s ALA 240 N -2.48 0.07 0.15 3.71 0.00 0.07 -0.97 121.76 122.31 3iv8 s ALA 240 Ca 0.63 0.34 -0.15 0.00 0.00 0.00 0.00 51.96 52.78 3iv8 s ALA 240 Cb -0.16 -0.43 -0.07 0.00 0.00 0.00 0.00 23.12 22.47 3iv8 s ALA 240 CO 0.37 -0.26 0.56 0.20 0.00 0.00 0.00 175.76 176.63 3iv8 s GLY 241 N 1.51 2.47 -0.07 0.00 0.00 -0.66 -0.40 107.32 110.17 3iv8 s GLY 241 Ca -0.04 -0.11 -0.06 0.00 0.00 0.00 0.00 44.72 44.51 3iv8 s GLY 241 CO -0.04 0.18 0.19 -1.50 0.00 0.00 0.00 173.10 171.93 3iv8 s ILE 242 N -1.47 -0.01 -0.37 0.90 2.07 0.60 -0.21 121.20 122.71 3iv8 s ILE 242 Ca 0.38 0.02 -0.15 0.00 -1.41 0.00 0.00 60.65 59.50 3iv8 s ILE 242 Cb -0.15 -0.27 -0.00 0.00 0.13 0.00 0.00 42.46 42.16 3iv8 s ILE 242 CO 0.19 0.01 0.33 -0.63 -1.91 0.00 0.00 174.94 172.93 3iv8 s ILE 243 N 0.27 5.20 -0.89 2.00 1.01 -1.26 -2.12 121.20 125.41 3iv8 s ILE 243 Ca -0.01 -0.21 0.00 0.00 0.00 0.00 0.00 60.65 60.43 3iv8 s ILE 243 Cb -0.03 -3.84 0.31 0.00 0.01 0.00 0.00 42.46 38.90 3iv8 s ILE 243 CO -0.01 -0.16 1.35 0.00 0.00 0.00 0.00 174.94 176.12 3iv8 n ALA 244 N 5.30 5.14 0.61 9.38 0.00 -1.26 -4.20 120.51 135.48 3iv8 n ALA 244 Ca -0.10 -4.73 0.07 0.00 0.00 0.00 0.00 53.44 48.67 3iv8 n ALA 244 Cb 0.49 -1.74 -0.03 0.00 0.00 0.00 0.00 19.45 18.17 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 0.56 1.17 0.00 0.00 5.68 -1.26 -4.53 116.55 118.17 3iv8 n ASP 245 Ca 0.34 -1.08 0.00 0.00 -0.50 0.00 0.00 54.79 53.54 3iv8 n ASP 245 Cb 0.34 0.65 0.00 0.00 -1.14 0.00 0.00 41.12 40.97 3iv8 n ASP 245 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3iv8 n GLY 246 N 1.14 2.75 0.12 6.12 0.00 -1.26 -4.85 105.19 109.20 3iv8 n GLY 246 Ca 0.05 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.91 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 0.08 1.61 3.72 -1.26 -4.66 117.46 114.95 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 -0.89 -0.04 0.00 -0.94 0.00 0.00 39.48 37.60 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 0.00 0.12 -2.95 1.38 3.86 -1.89 -3.44 115.15 112.24 3iv8 h HIS 248 Ca -0.52 -0.08 -0.20 0.00 -1.16 0.00 0.00 60.37 58.42 3iv8 h HIS 248 Cb 1.82 -0.01 -0.30 0.00 1.06 0.00 0.00 27.41 29.98 3iv8 h HIS 248 CO 0.03 0.95 -0.48 0.08 0.86 0.00 0.00 177.93 179.36 3iv8 s VAL 249 N -3.00 -0.15 0.15 2.45 1.01 -1.26 -4.82 120.40 114.79 3iv8 s VAL 249 Ca -0.01 0.18 -0.34 0.00 0.00 0.00 0.00 61.98 61.81 3iv8 s VAL 249 Cb 0.10 -0.42 -0.15 0.00 0.00 0.00 0.00 36.38 35.92 3iv8 s VAL 249 CO 0.82 0.08 1.38 -0.67 0.00 0.00 0.00 175.10 176.70 3iv8 n ASP 250 N 4.56 2.18 -0.24 3.32 -0.08 -1.26 -4.40 116.55 120.63 3iv8 n ASP 250 Ca -0.20 1.12 0.13 0.00 -1.51 0.00 0.00 54.79 54.33 3iv8 n ASP 250 Cb 0.52 -1.30 0.41 0.00 2.34 0.00 0.00 41.12 43.09 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 4.61 0.73 -0.65 -0.67 0.05 -1.94 0.85 116.97 119.93 3iv8 h TYR 251 Ca -0.45 0.02 0.01 0.00 0.05 0.00 0.00 58.73 58.36 3iv8 h TYR 251 Cb 1.30 -0.23 -0.03 0.00 1.01 0.00 0.00 36.73 38.78 3iv8 h TYR 251 CO 0.59 0.27 0.43 0.00 -1.05 0.00 0.00 178.16 178.40 3iv8 h ALA 252 N 1.61 1.55 0.00 3.88 0.00 -1.89 -1.58 119.26 122.83 3iv8 h ALA 252 Ca 0.42 -0.04 -0.07 0.00 0.00 0.00 0.00 54.91 55.22 3iv8 h ALA 252 Cb 0.75 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 3iv8 h ALA 252 CO -0.18 0.41 -0.33 -0.91 0.00 0.00 0.00 179.25 178.25 3iv8 h ASN 253 N 0.87 0.00 0.00 0.00 2.35 -1.19 -1.81 115.58 115.80 3iv8 h ASN 253 Ca 0.24 0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 55.99 3iv8 h ASN 253 Cb -0.08 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.29 3iv8 h ASN 253 CO -0.05 0.33 -0.00 0.40 -1.65 0.00 0.00 177.43 176.45 3iv8 h ILE 254 N 0.00 1.46 -0.62 2.81 2.04 -1.17 0.16 117.51 122.18 3iv8 h ILE 254 Ca -0.00 -1.36 0.11 0.00 1.00 0.00 0.00 64.86 64.61 3iv8 h ILE 254 Cb 0.64 2.38 -0.12 0.00 -0.74 0.00 0.00 36.82 38.98 3iv8 h ILE 254 CO 0.04 0.35 -0.29 -0.09 0.00 0.00 0.00 178.15 178.16 3iv8 h ARG 255 N -0.58 -0.12 -0.54 2.37 2.43 -1.14 0.52 114.38 117.33 3iv8 h ARG 255 Ca -0.00 0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.18 3iv8 h ARG 255 Cb 0.58 0.03 -0.03 0.00 -0.42 0.00 0.00 29.97 30.13 3iv8 h ARG 255 CO 0.00 -0.08 0.34 0.82 -1.51 0.00 0.00 179.97 179.55 3iv8 h ILE 256 N -0.12 1.15 -0.49 1.20 2.04 -1.26 -1.70 117.51 118.32 3iv8 h ILE 256 Ca 0.26 -0.29 0.05 0.00 1.00 0.00 0.00 64.86 65.87 3iv8 h ILE 256 Cb 0.54 0.38 -0.04 0.00 -0.74 0.00 0.00 36.82 36.96 3iv8 h ILE 256 CO -0.69 0.15 0.24 0.00 0.00 0.00 0.00 178.15 177.84 3iv8 h ALA 257 N 1.18 0.63 -0.61 1.87 0.00 0.11 -2.34 119.26 120.09 3iv8 h ALA 257 Ca 0.20 0.03 -0.08 0.00 0.00 0.00 0.00 54.91 55.05 3iv8 h ALA 257 Cb -0.06 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 17.66 3iv8 h ALA 257 CO -0.04 -0.12 0.06 1.25 0.00 0.00 0.00 179.25 180.41 3iv8 h HIS 258 N 0.47 1.11 0.00 0.00 -0.00 0.46 0.98 115.15 118.17 3iv8 h HIS 258 Ca 0.22 -0.17 -0.04 0.00 -0.00 0.00 0.00 60.37 60.38 3iv8 h HIS 258 Cb 0.15 -0.30 -0.01 0.00 -0.00 0.00 0.00 27.41 27.25 3iv8 h HIS 258 CO -0.11 0.96 -0.19 0.87 -0.00 0.00 0.00 177.93 179.47 3iv8 h LYS 259 N 0.94 0.00 0.18 5.26 1.57 -1.02 0.47 116.57 123.97 3iv8 h LYS 259 Ca 0.18 0.00 -0.28 0.00 -1.87 0.00 0.00 60.65 58.68 3iv8 h LYS 259 Cb 0.48 0.00 0.02 0.00 0.08 0.00 0.00 32.23 32.80 3iv8 h LYS 259 CO 0.02 0.19 -1.31 0.82 -0.57 0.00 0.00 179.45 178.60 3iv8 h ILE 260 N 0.00 1.23 0.00 1.86 2.04 -0.84 -3.41 117.51 118.39 3iv8 h ILE 260 Ca -0.00 -2.55 -0.16 0.00 1.00 0.00 0.00 64.86 63.15 3iv8 h ILE 260 Cb 0.44 2.97 -0.03 0.00 -0.74 0.00 0.00 36.82 39.46 3iv8 h ILE 260 CO 0.02 0.76 -2.16 0.29 0.00 0.00 0.00 178.15 177.07 3iv8 n LYS 261 N -3.87 0.67 0.00 2.37 4.76 0.27 -5.04 118.16 117.33 3iv8 n LYS 261 Ca -0.19 -0.11 0.00 0.00 -2.87 0.00 0.00 58.31 55.14 3iv8 n LYS 261 Cb 0.97 -1.52 0.00 0.00 -1.84 0.00 0.00 35.03 32.63 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 1.47 3.63 0.00 0.72 0.00 0.16 -0.76 105.19 110.42 3iv8 n GLY 262 Ca -0.17 0.12 0.03 0.00 0.00 0.00 0.00 46.02 46.01 3iv8 n GLY 262 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 3iv8 n GLU 263 N 14.00 0.03 0.00 1.61 0.28 -1.26 -2.26 120.64 133.04 3iv8 n GLU 263 Ca 0.00 0.33 0.14 0.00 -0.16 0.00 0.00 57.16 57.47 3iv8 n GLU 263 Cb 0.00 -1.50 0.57 0.00 1.43 0.00 0.00 31.44 31.94 3iv8 n GLU 263 CO 0.00 0.00 0.00 1.63 -0.16 0.00 0.00 177.13 178.60 3iv8 n LYS 264 N -1.42 0.95 -3.48 3.44 4.01 0.06 -4.80 118.16 116.93 3iv8 n LYS 264 Ca 0.02 -0.42 -0.38 0.00 -0.51 0.00 0.00 58.31 57.03 3iv8 n LYS 264 Cb 0.07 -1.49 -0.08 0.00 -0.51 0.00 0.00 35.03 33.01 3iv8 n LYS 264 CO 0.00 0.00 0.00 -1.17 -1.11 0.00 0.00 177.40 175.12 3iv8 s LEU 265 N -2.34 4.12 -0.10 -0.35 2.96 -0.96 -0.75 118.68 121.26 3iv8 s LEU 265 Ca 0.31 0.34 0.04 0.00 -0.22 0.00 0.00 54.13 54.60 3iv8 s LEU 265 Cb 0.20 -2.36 0.00 0.00 0.50 0.00 0.00 46.19 44.53 3iv8 s LEU 265 CO 0.45 -0.05 -0.23 -0.69 -1.32 0.00 0.00 176.35 174.51 3iv8 s VAL 266 N 1.37 1.98 -0.11 1.68 1.01 0.47 -4.74 120.40 122.05 3iv8 s VAL 266 Ca 0.14 -0.97 -0.23 0.00 0.00 0.00 0.00 61.98 60.92 3iv8 s VAL 266 Cb -0.15 -1.71 -0.03 0.00 0.00 0.00 0.00 36.38 34.49 3iv8 s VAL 266 CO 0.07 0.54 0.71 -0.76 0.00 0.00 0.00 175.10 175.67 3iv8 s LEU 267 N 0.38 4.26 0.32 3.92 1.43 -0.78 -0.29 118.68 127.91 3iv8 s LEU 267 Ca -0.18 1.12 0.10 0.00 -1.03 0.00 0.00 54.13 54.14 3iv8 s LEU 267 Cb -0.18 -3.08 -0.06 0.00 0.03 0.00 0.00 46.19 42.91 3iv8 s LEU 267 CO 0.08 -0.20 -0.11 0.68 0.23 0.00 0.00 176.35 177.04 3iv8 s VAL 268 N 1.26 2.43 -0.17 -1.59 -7.23 -0.90 -4.71 120.40 109.48 3iv8 s VAL 268 Ca 0.36 -2.22 0.03 0.00 -1.81 0.00 0.00 61.98 58.33 3iv8 s VAL 268 Cb -0.17 -2.57 -0.22 0.00 0.56 0.00 0.00 36.38 33.98 3iv8 s VAL 268 CO 0.16 -0.27 0.17 0.35 -0.31 0.00 0.00 175.10 175.19 3iv8 n THR 269 N -0.77 1.60 -2.42 5.32 -2.24 -1.25 -4.34 114.28 110.18 3iv8 n THR 269 Ca -0.05 -0.68 -0.13 0.00 -2.27 0.00 0.00 64.05 60.92 3iv8 n THR 269 Cb 0.62 -1.34 -0.01 0.00 -2.10 0.00 0.00 70.33 67.50 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 -3.24 -4.17 -4.62 3.42 2.03 0.97 -4.52 116.55 106.42 3iv8 n ASP 270 Ca -0.35 0.17 -0.29 0.00 0.52 0.00 0.00 54.79 54.84 3iv8 n ASP 270 Cb 1.05 -3.54 0.19 0.00 -0.72 0.00 0.00 41.12 38.10 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 -2.67 0.72 0.33 -1.67 0.00 -1.25 -4.25 121.76 112.97 3iv8 s ALA 271 Ca 0.00 0.09 0.03 0.00 0.00 0.00 0.00 51.96 52.08 3iv8 s ALA 271 Cb 0.00 -3.28 -0.04 0.00 0.00 0.00 0.00 23.12 19.80 3iv8 s ALA 271 CO 0.00 -3.07 0.14 0.95 0.00 0.00 0.00 175.76 173.78 3iv8 s THR 272 N -2.67 0.50 0.20 0.00 -4.23 -0.77 -2.40 115.64 106.26 3iv8 s THR 272 Ca 0.66 -2.00 0.01 0.00 -1.18 0.00 0.00 61.69 59.18 3iv8 s THR 272 Cb -0.22 -2.52 0.27 0.00 1.34 0.00 0.00 72.50 71.38 3iv8 s THR 272 CO 0.60 0.00 1.00 0.00 -0.54 0.00 0.00 174.62 175.68 3iv8 n ALA 273 N -0.66 0.31 0.26 3.99 0.00 -1.24 -1.25 120.51 121.92 3iv8 n ALA 273 Ca -0.01 0.69 0.12 0.00 0.00 0.00 0.00 53.44 54.23 3iv8 n ALA 273 Cb 0.65 -0.49 0.72 0.00 0.00 0.00 0.00 19.45 20.33 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 -6.17 0.00 0.13 -1.91 0.25 132.00 124.31 3iv8 h PRO 274 Ca 0.38 0.00 -0.68 0.00 -0.87 0.00 0.00 66.00 64.82 3iv8 h PRO 274 Cb 0.76 0.00 0.01 0.00 0.13 0.00 0.00 31.00 31.91 3iv8 h PRO 274 CO -0.61 0.11 1.05 0.00 -0.23 0.00 0.00 178.00 178.32 3iv8 n ALA 275 N -2.33 0.38 -2.82 -0.56 0.00 -0.38 -1.44 120.51 113.36 3iv8 n ALA 275 Ca -0.02 0.29 -0.16 0.00 0.00 0.00 0.00 53.44 53.54 3iv8 n ALA 275 Cb 0.21 -2.37 0.03 0.00 0.00 0.00 0.00 19.45 17.31 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 4.59 -0.19 3.33 0.00 0.00 -1.26 -1.10 105.19 110.56 3iv8 n GLY 276 Ca 0.27 -0.12 -0.10 0.00 0.00 0.00 0.00 46.02 46.07 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 -3.01 0.06 -0.29 4.61 0.00 -0.52 -4.18 121.76 118.43 3iv8 s ALA 277 Ca 0.22 -0.93 0.03 0.00 0.00 0.00 0.00 51.96 51.29 3iv8 s ALA 277 Cb -0.10 0.87 0.08 0.00 0.00 0.00 0.00 23.12 23.97 3iv8 s ALA 277 CO 0.28 -0.64 -0.04 -1.21 0.00 0.00 0.00 175.76 174.15 3iv8 s GLU 278 N -3.97 1.88 0.32 0.00 2.02 -1.26 -4.93 118.70 112.76 3iv8 s GLU 278 Ca 0.18 -1.56 0.04 0.00 0.02 0.00 0.00 54.97 53.65 3iv8 s GLU 278 Cb 0.04 -3.00 -0.02 0.00 0.10 0.00 0.00 34.13 31.24 3iv8 s GLU 278 CO 0.00 -0.73 0.32 0.00 0.02 0.00 0.00 175.26 174.87 3iv8 s MET 279 N 1.03 1.75 -0.15 1.61 0.23 -1.26 -5.09 119.30 117.43 3iv8 s MET 279 Ca -0.00 -1.91 0.08 0.00 -1.03 0.00 0.00 55.69 52.83 3iv8 s MET 279 Cb -0.20 0.35 -0.15 0.00 -1.53 0.00 0.00 34.83 33.31 3iv8 s MET 279 CO -0.07 -0.67 -0.03 -3.47 -2.03 0.00 0.00 175.02 168.76 3iv8 n ASP 280 N -1.40 1.97 -3.71 -1.18 2.03 -1.26 -4.77 116.55 108.23 3iv8 n ASP 280 Ca 0.05 -0.03 0.02 0.00 0.52 0.00 0.00 54.79 55.34 3iv8 n ASP 280 Cb 0.62 0.43 0.01 0.00 -0.72 0.00 0.00 41.12 41.46 3iv8 n ASP 280 CO 0.00 0.00 0.00 -0.72 -1.92 0.00 0.00 177.20 174.56 3iv8 s TYR 281 N -2.34 0.01 0.24 -0.67 1.13 -1.26 -1.60 117.35 112.86 3iv8 s TYR 281 Ca -0.13 -0.16 -0.18 0.00 -1.41 0.00 0.00 57.07 55.19 3iv8 s TYR 281 Cb 0.05 0.57 0.02 0.00 -1.10 0.00 0.00 41.96 41.50 3iv8 s TYR 281 CO 0.51 -0.36 0.61 -0.59 -2.51 0.00 0.00 175.55 173.21 3iv8 s PHE 282 N -2.17 -0.06 -0.06 -3.49 -0.12 -0.58 -4.93 117.98 106.58 3iv8 s PHE 282 Ca 0.24 -0.33 -0.17 0.00 -0.05 0.00 0.00 56.93 56.62 3iv8 s PHE 282 Cb 0.01 0.50 -0.05 0.00 -0.63 0.00 0.00 43.02 42.84 3iv8 s PHE 282 CO -0.01 -1.08 0.47 0.42 -0.05 0.00 0.00 175.22 174.97 3iv8 s ILE 283 N -3.92 5.08 -0.01 -4.49 1.09 -1.26 -1.19 121.20 116.50 3iv8 s ILE 283 Ca 0.13 0.95 -0.00 0.00 -1.10 0.00 0.00 60.65 60.63 3iv8 s ILE 283 Cb -0.03 -3.80 -0.00 0.00 -1.06 0.00 0.00 42.46 37.57 3iv8 s ILE 283 CO 0.04 0.43 -0.01 0.15 -0.10 0.00 0.00 174.94 175.46 3iv8 h PHE 284 N 5.81 0.00 -1.22 3.97 3.04 -1.61 -3.44 116.94 123.50 3iv8 h PHE 284 Ca -0.45 0.00 -0.38 0.00 3.98 0.00 0.00 57.97 61.11 3iv8 h PHE 284 Cb 1.20 0.00 -0.35 0.00 2.56 0.00 0.00 35.95 39.35 3iv8 h PHE 284 CO 0.65 0.00 -1.05 0.28 -2.02 0.00 0.00 178.31 176.17 3iv8 n VAL 285 N -2.32 0.34 0.00 1.41 0.31 -1.26 -4.88 118.33 111.93 3iv8 n VAL 285 Ca -0.00 -3.39 0.00 0.00 -0.01 0.00 0.00 64.34 60.94 3iv8 n VAL 285 Cb 0.01 0.40 0.00 0.00 -0.91 0.00 0.00 33.84 33.34 3iv8 n VAL 285 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3iv8 n GLY 286 N 0.07 3.16 3.75 2.92 0.00 -1.26 -5.09 105.19 108.73 3iv8 n GLY 286 Ca 0.14 -0.74 -0.41 0.00 0.00 0.00 0.00 46.02 45.02 3iv8 n GLY 286 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3iv8 s LYS 287 N 0.00 4.53 0.18 1.61 -2.85 -1.26 -4.94 119.74 117.01 3iv8 s LYS 287 Ca 0.00 1.90 -0.29 0.00 -1.00 0.00 0.00 55.97 56.58 3iv8 s LYS 287 Cb 0.00 -3.19 -0.08 0.00 -2.06 0.00 0.00 37.83 32.50 3iv8 s LYS 287 CO 0.00 0.01 0.92 0.21 0.10 0.00 0.00 175.35 176.59 3iv8 s LYS 288 N -0.92 4.75 -0.12 1.78 2.20 -1.26 -1.39 119.74 124.78 3iv8 s LYS 288 Ca 0.49 1.42 0.00 0.00 -0.36 0.00 0.00 55.97 57.52 3iv8 s LYS 288 Cb -0.34 -3.32 0.02 0.00 -1.51 0.00 0.00 37.83 32.69 3iv8 s LYS 288 CO 0.41 0.41 -0.11 0.08 -0.36 0.00 0.00 175.35 175.78 3iv8 s VAL 289 N -0.70 1.26 0.33 4.02 1.01 -0.33 -3.89 120.40 122.10 3iv8 s VAL 289 Ca 0.42 -0.44 -0.25 0.00 0.00 0.00 0.00 61.98 61.71 3iv8 s VAL 289 Cb -0.24 -1.22 -0.10 0.00 0.00 0.00 0.00 36.38 34.81 3iv8 s VAL 289 CO 0.30 0.41 0.94 -0.31 0.00 0.00 0.00 175.10 176.43 3iv8 s TYR 290 N 1.55 3.64 -0.17 5.22 2.02 0.98 -1.53 117.35 129.05 3iv8 s TYR 290 Ca 0.04 1.75 0.01 0.00 -0.37 0.00 0.00 57.07 58.49 3iv8 s TYR 290 Cb -0.13 -2.90 0.01 0.00 -0.40 0.00 0.00 41.96 38.54 3iv8 s TYR 290 CO -0.08 0.18 -0.17 -0.47 -1.57 0.00 0.00 175.55 173.43 3iv8 s TYR 291 N -1.68 2.78 -0.21 2.71 5.04 -0.63 -0.25 117.35 125.11 3iv8 s TYR 291 Ca 0.51 -1.35 -0.04 0.00 -2.44 0.00 0.00 57.07 53.75 3iv8 s TYR 291 Cb -0.17 -1.91 0.10 0.00 0.35 0.00 0.00 41.96 40.33 3iv8 s TYR 291 CO 0.22 -0.66 0.26 1.03 -1.34 0.00 0.00 175.55 175.07 3iv8 s ARG 292 N 1.10 0.23 -1.15 4.97 3.00 0.44 -4.73 118.95 122.80 3iv8 s ARG 292 Ca 0.00 0.33 -0.13 0.00 0.00 0.00 0.00 55.73 55.94 3iv8 s ARG 292 Cb -0.14 -0.93 -0.02 0.00 0.00 0.00 0.00 34.95 33.85 3iv8 s ARG 292 CO -0.06 -0.62 0.80 -0.25 0.00 0.00 0.00 175.30 175.17 3iv8 n ASP 293 N 5.33 -4.79 0.00 0.23 9.92 -1.26 -1.39 116.55 124.59 3iv8 n ASP 293 Ca -0.05 -0.90 0.00 0.00 -0.53 0.00 0.00 54.79 53.31 3iv8 n ASP 293 Cb 0.50 -4.00 0.00 0.00 -0.64 0.00 0.00 41.12 36.98 3iv8 n ASP 293 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 3iv8 n GLY 294 N -1.55 0.23 3.41 0.44 0.00 -1.26 -5.01 105.19 101.45 3iv8 n GLY 294 Ca -0.13 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.56 3iv8 n GLY 294 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3iv8 s LYS 295 N -1.10 3.19 -0.20 1.61 2.20 -0.49 -4.62 119.74 120.32 3iv8 s LYS 295 Ca 0.00 -0.67 -0.12 0.00 -0.36 0.00 0.00 55.97 54.82 3iv8 s LYS 295 Cb 0.00 -2.59 -0.05 0.00 -1.51 0.00 0.00 37.83 33.68 3iv8 s LYS 295 CO 0.00 0.32 0.22 0.00 -0.36 0.00 0.00 175.35 175.53 3iv8 s VAL 297 N 0.72 -0.01 1.07 0.00 -7.23 0.65 -1.07 120.40 114.53 3iv8 s VAL 297 Ca 0.12 0.05 -0.16 0.00 -1.81 0.00 0.00 61.98 60.18 3iv8 s VAL 297 Cb -0.13 -0.07 0.23 0.00 0.56 0.00 0.00 36.38 36.97 3iv8 s VAL 297 CO 0.03 0.02 1.14 1.51 -0.31 0.00 0.00 175.10 177.49 3iv8 s ASP 298 N 0.28 2.06 0.00 4.85 -4.77 -0.12 -0.02 116.67 118.95 3iv8 s ASP 298 Ca -0.02 0.75 0.09 0.00 -3.30 0.00 0.00 52.55 50.07 3iv8 s ASP 298 Cb -0.03 -1.12 0.45 0.00 -1.09 0.00 0.00 42.92 41.13 3iv8 s ASP 298 CO -0.01 -3.43 1.19 -1.84 0.70 0.00 0.00 175.17 171.78 3iv8 n GLU 299 N -4.32 0.11 0.00 2.11 0.28 -1.25 -1.01 120.64 116.57 3iv8 n GLU 299 Ca 0.10 0.22 0.09 0.00 -0.16 0.00 0.00 57.16 57.42 3iv8 n GLU 299 Cb 0.59 -1.50 -0.02 0.00 1.43 0.00 0.00 31.44 31.94 3iv8 n GLU 299 CO 0.00 0.00 0.00 0.09 -0.16 0.00 0.00 177.13 177.06 3iv8 n ASN 300 N -1.31 1.69 0.00 -1.84 5.03 -1.26 -4.96 115.26 112.60 3iv8 n ASN 300 Ca 0.04 -1.35 0.00 0.00 0.87 0.00 0.00 54.58 54.15 3iv8 n ASN 300 Cb 0.08 0.55 0.00 0.00 -1.02 0.00 0.00 39.78 39.39 3iv8 n ASN 300 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 3iv8 n GLY 301 N 1.31 0.46 3.74 7.41 0.00 -0.18 -5.05 105.19 112.88 3iv8 n GLY 301 Ca 0.07 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.69 3iv8 n GLY 301 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3iv8 s THR 302 N -2.18 3.80 -0.44 2.61 2.01 -1.26 -4.76 115.64 115.41 3iv8 s THR 302 Ca 0.00 1.62 -0.45 0.00 0.31 0.00 0.00 61.69 63.16 3iv8 s THR 302 Cb 0.00 -4.03 -0.19 0.00 0.01 0.00 0.00 72.50 68.29 3iv8 s THR 302 CO 0.00 0.31 1.62 -0.11 -0.69 0.00 0.00 174.62 175.75 3iv8 n LEU 303 N 2.07 1.42 -0.64 4.42 7.94 -1.26 -0.95 117.00 130.01 3iv8 n LEU 303 Ca 0.02 1.17 0.08 0.00 -1.11 0.00 0.00 56.01 56.17 3iv8 n LEU 303 Cb 0.46 -0.93 0.06 0.00 0.53 0.00 0.00 43.42 43.54 3iv8 n LEU 303 CO 0.54 -0.78 0.49 0.61 -1.11 0.00 0.00 177.39 177.13 3iv8 n GLY 304 N 3.99 0.21 0.00 -3.96 0.00 -0.23 -4.71 105.19 100.48 3iv8 n GLY 304 Ca 0.30 -0.48 0.00 0.00 0.00 0.00 0.00 46.02 45.84 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 0.96 -1.00 3.68 -0.02 0.00 -1.26 -4.90 105.19 102.65 3iv8 n GLY 305 Ca 0.09 -1.59 -0.31 0.00 0.00 0.00 0.00 46.02 44.22 3iv8 n GLY 305 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3iv8 s SER 306 N -0.84 4.99 -0.11 1.61 0.15 -1.26 -4.34 113.70 113.89 3iv8 s SER 306 Ca 0.00 -0.15 0.15 0.00 0.70 0.00 0.00 55.95 56.65 3iv8 s SER 306 Cb 0.00 -1.20 0.33 0.00 -1.71 0.00 0.00 66.02 63.44 3iv8 s SER 306 CO 0.00 0.20 1.16 0.00 1.20 0.00 0.00 173.24 175.80 3iv8 n ALA 307 N 0.79 2.78 -1.76 5.45 0.00 -1.26 -1.85 120.51 124.66 3iv8 n ALA 307 Ca -0.12 -2.57 -0.39 0.00 0.00 0.00 0.00 53.44 50.36 3iv8 n ALA 307 Cb 0.52 -0.48 -0.05 0.00 0.00 0.00 0.00 19.45 19.45 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 -1.84 4.48 0.29 0.00 2.96 -1.26 -4.40 118.68 118.91 3iv8 s LEU 308 Ca 0.30 2.17 0.06 0.00 -0.22 0.00 0.00 54.13 56.44 3iv8 s LEU 308 Cb 0.30 -3.74 -0.02 0.00 0.50 0.00 0.00 46.19 43.23 3iv8 s LEU 308 CO -0.06 -0.16 0.37 0.42 -1.32 0.00 0.00 176.35 175.59 3iv8 s THR 309 N -1.27 4.50 0.17 3.68 -4.23 -1.26 -4.59 115.64 112.64 3iv8 s THR 309 Ca 0.47 -1.09 -0.10 0.00 -1.18 0.00 0.00 61.69 59.79 3iv8 s THR 309 Cb -0.29 -3.55 0.04 0.00 1.34 0.00 0.00 72.50 70.04 3iv8 s THR 309 CO 0.37 -0.25 1.60 -0.03 -0.54 0.00 0.00 174.62 175.76 3iv8 h MET 310 N 1.12 1.05 -0.47 3.99 4.05 -1.94 -1.95 114.93 120.78 3iv8 h MET 310 Ca -0.48 -0.38 -0.05 0.00 -0.28 0.00 0.00 59.70 58.50 3iv8 h MET 310 Cb 1.24 -0.07 -0.02 0.00 -0.80 0.00 0.00 31.60 31.95 3iv8 h MET 310 CO 0.58 1.08 0.09 0.97 0.23 0.00 0.00 176.91 179.85 3iv8 h ILE 311 N 0.93 1.21 -0.29 1.77 6.09 -1.83 -2.88 117.51 122.51 3iv8 h ILE 311 Ca 0.14 -0.80 -0.15 0.00 -1.37 0.00 0.00 64.86 62.69 3iv8 h ILE 311 Cb 0.67 0.76 -0.01 0.00 0.47 0.00 0.00 36.82 38.72 3iv8 h ILE 311 CO 0.05 0.29 -0.42 -0.33 -3.07 0.00 0.00 178.15 174.66 3iv8 h GLU 312 N 0.70 0.73 -0.78 2.19 5.08 -1.77 -2.29 114.58 118.43 3iv8 h GLU 312 Ca 0.15 -0.39 0.11 0.00 -1.00 0.00 0.00 59.36 58.23 3iv8 h GLU 312 Cb 0.30 0.02 -0.08 0.00 0.50 0.00 0.00 28.75 29.49 3iv8 h GLU 312 CO 0.00 1.01 0.41 0.00 -1.00 0.00 0.00 179.01 179.44 3iv8 h ALA 313 N 0.93 1.12 0.46 3.43 0.00 -1.21 0.17 119.26 124.16 3iv8 h ALA 313 Ca 0.04 0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.98 3iv8 h ALA 313 Cb 0.97 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.70 3iv8 h ALA 313 CO 0.09 -0.00 -0.22 0.28 0.00 0.00 0.00 179.25 179.39 3iv8 h VAL 314 N 0.67 0.50 -0.54 0.00 2.07 -1.28 -1.00 116.25 116.68 3iv8 h VAL 314 Ca 0.39 -0.32 0.11 0.00 0.82 0.00 0.00 66.70 67.70 3iv8 h VAL 314 Cb 0.43 0.64 -0.09 0.00 -1.52 0.00 0.00 31.29 30.75 3iv8 h VAL 314 CO -0.28 0.05 -0.03 -0.61 0.02 0.00 0.00 177.57 176.72 3iv8 h GLN 315 N -0.83 0.09 -0.65 1.57 4.15 -1.15 0.19 115.11 118.48 3iv8 h GLN 315 Ca -0.06 -0.01 -0.00 0.00 0.77 0.00 0.00 58.65 59.35 3iv8 h GLN 315 Cb 0.56 -0.02 -0.03 0.00 0.21 0.00 0.00 27.48 28.20 3iv8 h GLN 315 CO 0.10 0.06 0.40 -0.91 -1.93 0.00 0.00 178.83 176.55 3iv8 h ASN 316 N 0.09 0.77 -0.73 -0.69 4.21 -0.56 0.37 115.58 119.04 3iv8 h ASN 316 Ca 0.27 -0.05 -0.00 0.00 1.21 0.00 0.00 56.30 57.73 3iv8 h ASN 316 Cb 0.42 -0.19 -0.04 0.00 -1.12 0.00 0.00 38.32 37.40 3iv8 h ASN 316 CO -0.48 0.60 0.45 0.74 -1.29 0.00 0.00 177.43 177.45 3iv8 h THR 317 N 0.88 1.20 -0.23 2.81 2.02 -0.30 0.37 112.91 119.66 3iv8 h THR 317 Ca 0.23 -0.43 -0.06 0.00 0.77 0.00 0.00 66.41 66.92 3iv8 h THR 317 Cb -0.04 0.18 -0.01 0.00 -1.74 0.00 0.00 68.15 66.54 3iv8 h THR 317 CO -0.04 0.21 -0.10 0.58 0.37 0.00 0.00 175.52 176.53 3iv8 h VAL 318 N 0.99 1.30 0.08 3.16 2.07 0.15 -2.14 116.25 121.86 3iv8 h VAL 318 Ca 0.26 -1.16 -0.32 0.00 0.82 0.00 0.00 66.70 66.30 3iv8 h VAL 318 Cb -0.05 1.58 -0.02 0.00 -1.52 0.00 0.00 31.29 31.27 3iv8 h VAL 318 CO -0.05 0.36 -1.74 -0.33 0.02 0.00 0.00 177.57 175.82 3iv8 h GLU 319 N 0.18 0.17 0.00 1.57 5.08 -0.03 -3.12 114.58 118.44 3iv8 h GLU 319 Ca 0.05 -0.29 -0.24 0.00 -1.00 0.00 0.00 59.36 57.88 3iv8 h GLU 319 Cb 0.59 0.11 -0.04 0.00 0.50 0.00 0.00 28.75 29.90 3iv8 h GLU 319 CO 0.03 0.95 -1.91 0.72 -1.00 0.00 0.00 179.01 177.79 3iv8 n HIS 320 N -3.33 0.00 0.12 4.33 8.25 0.13 -4.54 115.22 120.18 3iv8 n HIS 320 Ca -0.22 0.00 0.01 0.00 -0.26 0.00 0.00 57.72 57.26 3iv8 n HIS 320 Cb 1.05 -0.64 -0.00 0.00 1.12 0.00 0.00 29.99 31.51 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 0.89 -0.26 1.59 2.07 -1.32 -3.47 116.25 115.75 3iv8 h VAL 321 Ca -0.36 -2.29 -0.00 0.00 0.82 0.00 0.00 66.70 64.86 3iv8 h VAL 321 Cb 1.70 2.41 0.00 0.00 -1.52 0.00 0.00 31.29 33.88 3iv8 h VAL 321 CO -0.01 0.51 -0.01 0.61 0.02 0.00 0.00 177.57 178.69 3iv8 n GLY 322 N 1.26 0.50 3.87 2.17 0.00 -0.82 -4.69 105.19 107.48 3iv8 n GLY 322 Ca 0.00 -0.83 -0.37 0.00 0.00 0.00 0.00 46.02 44.82 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 -2.24 5.41 0.47 -0.61 1.01 -1.11 -5.05 121.20 119.08 3iv8 s ILE 323 Ca 0.00 0.30 -0.25 0.00 0.00 0.00 0.00 60.65 60.71 3iv8 s ILE 323 Cb -0.00 -3.47 -0.08 0.00 0.01 0.00 0.00 42.46 38.92 3iv8 s ILE 323 CO 0.00 0.58 1.41 0.00 0.00 0.00 0.00 174.94 176.93 3iv8 n ALA 324 N 1.85 1.91 -0.19 9.38 0.00 -1.26 -4.19 120.51 128.01 3iv8 n ALA 324 Ca -0.18 0.23 -0.01 0.00 0.00 0.00 0.00 53.44 53.48 3iv8 n ALA 324 Cb 0.54 -2.38 0.09 0.00 0.00 0.00 0.00 19.45 17.71 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 2.12 0.20 -1.60 0.00 5.85 -1.96 0.10 115.31 120.02 3iv8 h LEU 325 Ca -0.51 0.07 -0.04 0.00 0.84 0.00 0.00 57.88 58.24 3iv8 h LEU 325 Cb 1.28 0.06 -0.01 0.00 0.37 0.00 0.00 40.66 42.36 3iv8 h LEU 325 CO 0.60 0.13 -0.21 -2.24 -0.34 0.00 0.00 178.44 176.38 3iv8 h ASP 326 N 0.39 0.00 0.09 1.25 2.03 -1.99 0.11 116.42 118.29 3iv8 h ASP 326 Ca 0.29 0.00 -0.24 0.00 -0.73 0.00 0.00 57.03 56.34 3iv8 h ASP 326 Cb 0.34 0.00 0.02 0.00 -0.83 0.00 0.00 39.33 38.86 3iv8 h ASP 326 CO -0.29 0.21 -1.01 -0.08 -1.03 0.00 0.00 179.24 177.04 3iv8 h GLU 327 N 0.00 0.53 -0.40 4.15 4.57 -1.66 -2.71 114.58 119.06 3iv8 h GLU 327 Ca -0.00 -0.69 -0.03 0.00 -1.18 0.00 0.00 59.36 57.46 3iv8 h GLU 327 Cb 0.48 0.22 -0.02 0.00 -0.16 0.00 0.00 28.75 29.27 3iv8 h GLU 327 CO 0.03 1.29 0.13 0.00 -1.18 0.00 0.00 179.01 179.28 3iv8 h ALA 328 N 0.26 1.49 -0.08 2.92 0.00 -0.30 -1.95 119.26 121.61 3iv8 h ALA 328 Ca -0.15 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 54.62 3iv8 h ALA 328 Cb 1.72 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 19.34 3iv8 h ALA 328 CO 0.19 0.39 0.02 -0.07 0.00 0.00 0.00 179.25 179.78 3iv8 h LEU 329 N 0.57 0.11 -1.08 0.00 3.38 -0.84 -2.47 115.31 114.98 3iv8 h LEU 329 Ca 0.14 -0.21 0.23 0.00 0.09 0.00 0.00 57.88 58.13 3iv8 h LEU 329 Cb 0.16 -0.03 -0.11 0.00 0.09 0.00 0.00 40.66 40.77 3iv8 h LEU 329 CO -0.01 0.30 0.61 0.03 0.09 0.00 0.00 178.44 179.46 3iv8 h ARG 330 N -0.08 0.58 0.00 1.13 3.08 -1.11 -0.85 114.38 117.13 3iv8 h ARG 330 Ca 0.02 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 60.04 3iv8 h ARG 330 Cb 0.22 -0.13 0.00 0.00 0.08 0.00 0.00 29.97 30.14 3iv8 h ARG 330 CO -0.00 0.38 0.00 0.52 -1.07 0.00 0.00 179.97 179.80 3iv8 h MET 331 N 0.60 0.00 -0.14 0.04 2.86 -0.89 -0.50 114.93 116.89 3iv8 h MET 331 Ca 0.62 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 58.26 3iv8 h MET 331 Cb 1.19 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.85 3iv8 h MET 331 CO -0.41 0.00 0.00 0.00 1.06 0.00 0.00 176.91 177.56 3iv8 n ALA 332 N -2.02 2.39 -1.01 6.32 0.00 -0.37 -1.87 120.51 123.95 3iv8 n ALA 332 Ca -0.00 -0.79 0.00 0.00 0.00 0.00 0.00 53.44 52.65 3iv8 n ALA 332 Cb 0.22 -0.46 0.00 0.00 0.00 0.00 0.00 19.45 19.21 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 0.71 0.00 0.05 0.00 -2.24 -0.80 -1.32 114.28 110.68 3iv8 n THR 333 Ca 0.10 0.00 -0.11 0.00 -2.27 0.00 0.00 64.05 61.77 3iv8 n THR 333 Cb 0.37 -0.07 -0.04 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 -0.51 -0.20 3.22 6.46 -1.34 -1.74 115.31 121.21 3iv8 h LEU 334 Ca 0.00 0.07 -0.01 0.00 -0.12 0.00 0.00 57.88 57.82 3iv8 h LEU 334 Cb 0.00 0.21 -0.01 0.00 -0.73 0.00 0.00 40.66 40.13 3iv8 h LEU 334 CO 0.00 -0.23 0.08 1.88 -0.62 0.00 0.00 178.44 179.54 3iv8 h TYR 335 N -0.28 0.31 -0.78 1.25 0.05 -1.42 -0.58 116.97 115.52 3iv8 h TYR 335 Ca 0.06 -0.03 0.04 0.00 0.05 0.00 0.00 58.73 58.85 3iv8 h TYR 335 Cb 0.35 -0.09 -0.05 0.00 1.01 0.00 0.00 36.73 37.95 3iv8 h TYR 335 CO -0.23 0.36 0.49 -1.00 -1.05 0.00 0.00 178.16 176.74 3iv8 h PRO 336 N 0.17 0.91 -0.58 4.88 0.13 -1.78 0.85 132.00 136.58 3iv8 h PRO 336 Ca 0.07 -0.05 0.09 0.00 -0.87 0.00 0.00 66.00 65.24 3iv8 h PRO 336 Cb 0.19 -0.21 -0.07 0.00 0.13 0.00 0.00 31.00 31.04 3iv8 h PRO 336 CO -0.00 0.60 0.19 0.00 -0.23 0.00 0.00 178.00 178.55 3iv8 h ALA 337 N 1.35 0.72 -0.22 -0.56 0.00 -0.69 -1.04 119.26 118.82 3iv8 h ALA 337 Ca 0.32 0.09 -0.13 0.00 0.00 0.00 0.00 54.91 55.20 3iv8 h ALA 337 Cb 0.06 0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 3iv8 h ALA 337 CO -0.13 -0.23 -0.42 0.87 0.00 0.00 0.00 179.25 179.34 3iv8 h LYS 338 N 0.35 0.51 -0.79 0.00 1.57 -0.65 0.18 116.57 117.74 3iv8 h LYS 338 Ca 0.29 -0.26 -0.01 0.00 -1.87 0.00 0.00 60.65 58.80 3iv8 h LYS 338 Cb 0.38 0.01 -0.04 0.00 0.08 0.00 0.00 32.23 32.66 3iv8 h LYS 338 CO -0.32 0.84 0.45 0.00 -0.57 0.00 0.00 179.45 179.84 3iv8 h ALA 339 N 1.13 1.29 -0.53 3.86 0.00 0.41 -2.43 119.26 123.00 3iv8 h ALA 339 Ca 0.03 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.83 3iv8 h ALA 339 Cb 0.90 -0.32 0.00 0.00 0.00 0.00 0.00 17.79 18.37 3iv8 h ALA 339 CO 0.08 0.59 0.00 0.44 0.00 0.00 0.00 179.25 180.35 3iv8 n ILE 340 N -4.36 0.82 -2.86 0.00 -5.35 -0.69 -5.01 119.36 101.91 3iv8 n ILE 340 Ca 0.08 -0.91 -0.11 0.00 -0.27 0.00 0.00 62.75 61.54 3iv8 n ILE 340 Cb 0.09 0.67 0.06 0.00 -1.74 0.00 0.00 39.64 38.71 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 1.32 -0.33 0.24 3.28 0.00 -0.39 -4.95 105.19 104.36 3iv8 n GLY 341 Ca 0.20 0.13 0.04 0.00 0.00 0.00 0.00 46.02 46.38 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 -2.95 0.79 0.32 1.61 0.24 0.49 -4.87 118.33 113.96 3iv8 n VAL 342 Ca -0.13 -0.93 0.10 0.00 -2.04 0.00 0.00 64.34 61.34 3iv8 n VAL 342 Cb 0.60 0.29 0.43 0.00 -1.47 0.00 0.00 33.84 33.69 3iv8 n VAL 342 CO 0.00 0.00 0.00 -0.90 -2.14 0.00 0.00 176.83 173.79 3iv8 n ASP 343 N -0.58 0.46 -0.08 -1.34 5.68 -1.17 -0.20 116.55 119.32 3iv8 n ASP 343 Ca 0.06 0.64 -0.14 0.00 -0.50 0.00 0.00 54.79 54.85 3iv8 n ASP 343 Cb 0.61 -0.73 -0.05 0.00 -1.14 0.00 0.00 41.12 39.81 3iv8 n ASP 343 CO 0.00 0.00 0.00 -0.33 -1.33 0.00 0.00 177.20 175.54 3iv8 h GLU 344 N 0.00 0.73 0.00 0.11 3.07 -1.92 -3.39 114.58 113.18 3iv8 h GLU 344 Ca 0.00 -0.44 -0.21 0.00 -0.50 0.00 0.00 59.36 58.20 3iv8 h GLU 344 Cb 0.22 0.05 -0.04 0.00 -0.84 0.00 0.00 28.75 28.14 3iv8 h GLU 344 CO 0.00 1.07 -2.01 0.36 -1.40 0.00 0.00 179.01 177.03 3iv8 n LYS 345 N -4.18 1.15 -4.17 2.33 2.85 -1.00 -4.72 118.16 110.42 3iv8 n LYS 345 Ca -0.05 -0.05 -0.14 0.00 -1.05 0.00 0.00 58.31 57.02 3iv8 n LYS 345 Cb 0.55 -1.41 -0.11 0.00 -0.65 0.00 0.00 35.03 33.41 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 -4.90 2.41 0.00 -5.58 1.43 0.71 -0.76 118.68 111.99 3iv8 s LEU 346 Ca -0.07 -0.81 0.00 0.00 -1.03 0.00 0.00 54.13 52.21 3iv8 s LEU 346 Cb 0.06 -0.29 0.00 0.00 0.03 0.00 0.00 46.19 46.00 3iv8 s LEU 346 CO 0.67 -0.27 0.00 0.61 0.23 0.00 0.00 176.35 177.59 3iv8 n GLY 347 N 0.56 0.63 3.18 -3.19 0.00 -1.26 -3.93 105.19 101.17 3iv8 n GLY 347 Ca -0.16 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.76 3iv8 n GLY 347 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 3iv8 s ARG 348 N -0.73 0.69 -0.84 1.61 1.70 -1.26 -3.50 118.95 116.62 3iv8 s ARG 348 Ca 0.00 -0.65 -0.18 0.00 -0.47 0.00 0.00 55.73 54.42 3iv8 s ARG 348 Cb 0.00 0.29 0.13 0.00 -0.57 0.00 0.00 34.95 34.80 3iv8 s ARG 348 CO 0.00 -0.20 1.00 0.42 -1.08 0.00 0.00 175.30 175.45 3iv8 s ILE 349 N -2.61 4.83 0.13 4.99 1.01 -1.00 -4.91 121.20 123.64 3iv8 s ILE 349 Ca -0.05 -1.51 -0.14 0.00 0.00 0.00 0.00 60.65 58.95 3iv8 s ILE 349 Cb -0.01 -4.69 0.02 0.00 0.01 0.00 0.00 42.46 37.80 3iv8 s ILE 349 CO -0.04 -1.39 0.37 -1.59 0.00 0.00 0.00 174.94 172.29 3iv8 s LYS 350 N 2.46 1.07 0.30 2.79 -2.85 -1.26 -4.81 119.74 117.44 3iv8 s LYS 350 Ca 0.27 -0.81 -0.29 0.00 -1.00 0.00 0.00 55.97 54.14 3iv8 s LYS 350 Cb -0.09 0.44 -0.13 0.00 -2.06 0.00 0.00 37.83 35.99 3iv8 s LYS 350 CO -0.05 -0.41 1.26 1.63 0.10 0.00 0.00 175.35 177.88 3iv8 n LYS 351 N -0.21 1.95 -1.00 1.78 5.02 -1.26 -3.00 118.16 121.43 3iv8 n LYS 351 Ca -0.14 0.68 -0.00 0.00 -2.02 0.00 0.00 58.31 56.83 3iv8 n LYS 351 Cb 0.63 -2.24 -0.00 0.00 -0.02 0.00 0.00 35.03 33.40 3iv8 n LYS 351 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3iv8 n GLY 352 N 1.20 0.45 3.82 0.72 0.00 0.14 -4.95 105.19 106.57 3iv8 n GLY 352 Ca 0.07 -0.06 -0.31 0.00 0.00 0.00 0.00 46.02 45.72 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 -0.38 3.10 0.28 1.61 -1.94 -1.16 -4.87 119.30 115.94 3iv8 s MET 353 Ca 0.00 -0.55 -0.30 0.00 -1.71 0.00 0.00 55.69 53.12 3iv8 s MET 353 Cb 0.00 -2.86 -0.12 0.00 2.01 0.00 0.00 34.83 33.86 3iv8 s MET 353 CO 0.00 0.60 1.52 -0.89 -0.01 0.00 0.00 175.02 176.25 3iv8 n ILE 354 N 0.62 1.07 -1.61 2.53 -0.00 0.06 -1.98 119.36 120.06 3iv8 n ILE 354 Ca -0.09 -0.27 -0.41 0.00 -0.00 0.00 0.00 62.75 61.98 3iv8 n ILE 354 Cb 0.52 -1.80 -0.01 0.00 -0.00 0.00 0.00 39.64 38.35 3iv8 n ILE 354 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.55 176.55 3iv8 n ALA 355 N 1.94 6.21 -2.53 -1.39 0.00 -0.77 -4.79 120.51 119.18 3iv8 n ALA 355 Ca 0.09 -3.78 -0.40 0.00 0.00 0.00 0.00 53.44 49.35 3iv8 n ALA 355 Cb 0.35 -3.47 -0.10 0.00 0.00 0.00 0.00 19.45 16.22 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 2.81 6.08 0.17 0.00 0.01 -1.25 -2.02 114.94 120.73 3iv8 s ASN 356 Ca 0.54 -0.40 0.02 0.00 -0.71 0.00 0.00 52.86 52.32 3iv8 s ASN 356 Cb 0.15 -2.15 -0.05 0.00 0.41 0.00 0.00 41.25 39.62 3iv8 s ASN 356 CO -0.08 -0.25 -0.00 -0.76 -1.51 0.00 0.00 177.10 174.50 3iv8 s LEU 357 N 1.76 2.15 -0.04 0.60 2.01 0.44 -1.49 118.68 124.11 3iv8 s LEU 357 Ca 0.07 -1.16 0.01 0.00 0.01 0.00 0.00 54.13 53.06 3iv8 s LEU 357 Cb -0.17 -0.06 0.02 0.00 0.01 0.00 0.00 46.19 45.99 3iv8 s LEU 357 CO 0.11 -0.56 -0.04 -0.89 1.01 0.00 0.00 176.35 175.98 3iv8 s THR 358 N -3.65 0.48 -0.17 5.49 2.01 0.17 -0.50 115.64 119.47 3iv8 s THR 358 Ca 0.23 -0.08 -0.08 0.00 0.31 0.00 0.00 61.69 62.06 3iv8 s THR 358 Cb 0.06 -0.52 -0.04 0.00 0.01 0.00 0.00 72.50 72.01 3iv8 s THR 358 CO 0.03 0.21 0.11 -0.69 -0.69 0.00 0.00 174.62 173.59 3iv8 s VAL 359 N 0.96 5.20 -0.07 3.82 1.01 -0.77 -1.74 120.40 128.82 3iv8 s VAL 359 Ca -0.10 0.11 -0.12 0.00 0.00 0.00 0.00 61.98 61.87 3iv8 s VAL 359 Cb -0.14 -3.34 0.02 0.00 0.00 0.00 0.00 36.38 32.93 3iv8 s VAL 359 CO -0.00 0.49 0.29 0.72 0.00 0.00 0.00 175.10 176.60 3iv8 s PHE 360 N 0.02 -0.25 0.04 5.22 -0.12 -0.68 -1.23 117.98 120.98 3iv8 s PHE 360 Ca 0.08 0.55 -0.00 0.00 -0.05 0.00 0.00 56.93 57.51 3iv8 s PHE 360 Cb -0.12 0.09 0.01 0.00 -0.63 0.00 0.00 43.02 42.37 3iv8 s PHE 360 CO -0.00 -0.25 0.05 -0.40 -0.05 0.00 0.00 175.22 174.57 3iv8 n ASP 361 N 2.25 0.02 0.26 1.98 5.68 -0.83 -0.62 116.55 125.29 3iv8 n ASP 361 Ca -0.17 -1.03 0.14 0.00 -0.50 0.00 0.00 54.79 53.24 3iv8 n ASP 361 Cb 0.57 -0.04 0.68 0.00 -1.14 0.00 0.00 41.12 41.19 3iv8 n ASP 361 CO 0.00 0.00 0.00 0.08 -1.33 0.00 0.00 177.20 175.95 3iv8 h ARG 362 N 0.00 0.00 -0.14 0.11 0.11 -1.92 -2.47 114.38 110.07 3iv8 h ARG 362 Ca -0.02 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.06 3iv8 h ARG 362 Cb 0.05 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.13 3iv8 h ARG 362 CO 0.01 0.10 0.00 -0.25 0.10 0.00 0.00 179.97 179.93 3iv8 n ASP 363 N -3.31 2.07 -0.72 0.08 8.00 -1.26 -4.93 116.55 116.48 3iv8 n ASP 363 Ca -0.00 -1.73 -0.08 0.00 0.71 0.00 0.00 54.79 53.68 3iv8 n ASP 363 Cb 0.31 -0.09 -0.03 0.00 -0.02 0.00 0.00 41.12 41.29 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 0.59 -0.11 -2.68 1.24 3.72 -0.93 -5.02 117.46 114.28 3iv8 n PHE 364 Ca 0.17 0.00 -0.43 0.00 -0.05 0.00 0.00 57.45 57.14 3iv8 n PHE 364 Cb 0.41 -1.82 -0.02 0.00 -0.94 0.00 0.00 39.48 37.11 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 -2.84 6.97 -0.01 4.37 0.01 -1.26 -4.88 114.94 117.31 3iv8 s ASN 365 Ca 0.00 1.14 -0.30 0.00 -0.71 0.00 0.00 52.86 52.99 3iv8 s ASN 365 Cb 0.00 -2.53 -0.06 0.00 0.41 0.00 0.00 41.25 39.07 3iv8 s ASN 365 CO 0.00 -0.77 1.61 -0.69 -1.51 0.00 0.00 177.10 175.74 3iv8 s VAL 366 N 3.40 3.44 -0.16 1.60 1.01 -1.26 -1.97 120.40 126.45 3iv8 s VAL 366 Ca 0.43 0.71 0.15 0.00 0.00 0.00 0.00 61.98 63.27 3iv8 s VAL 366 Cb -0.13 -3.46 -0.21 0.00 0.00 0.00 0.00 36.38 32.58 3iv8 s VAL 366 CO 0.11 -0.03 0.08 0.29 0.00 0.00 0.00 175.10 175.55 3iv8 n LYS 367 N 6.32 1.26 -3.86 2.72 4.76 -0.36 -4.82 118.16 124.18 3iv8 n LYS 367 Ca 0.16 -0.02 -0.07 0.00 -2.87 0.00 0.00 58.31 55.51 3iv8 n LYS 367 Cb 0.42 -1.42 -0.02 0.00 -1.84 0.00 0.00 35.03 32.17 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 -2.45 -1.18 0.02 7.82 0.00 -1.19 -3.46 121.76 121.32 3iv8 s ALA 368 Ca -0.08 -0.35 -0.02 0.00 0.00 0.00 0.00 51.96 51.52 3iv8 s ALA 368 Cb 0.05 0.83 -0.02 0.00 0.00 0.00 0.00 23.12 23.99 3iv8 s ALA 368 CO 0.68 -1.04 0.00 0.95 0.00 0.00 0.00 175.76 176.36 3iv8 s THR 369 N -3.78 0.12 -0.14 0.00 -4.23 0.20 -1.85 115.64 105.96 3iv8 s THR 369 Ca 0.11 -1.03 0.01 0.00 -1.18 0.00 0.00 61.69 59.61 3iv8 s THR 369 Cb -0.06 -0.52 0.00 0.00 1.34 0.00 0.00 72.50 73.26 3iv8 s THR 369 CO 0.07 -0.56 -0.18 -0.69 -0.54 0.00 0.00 174.62 172.72 3iv8 s VAL 370 N -1.91 2.48 -0.19 2.29 1.01 0.35 -1.23 120.40 123.19 3iv8 s VAL 370 Ca -0.12 -0.84 0.00 0.00 0.00 0.00 0.00 61.98 61.02 3iv8 s VAL 370 Cb -0.06 -2.02 0.04 0.00 0.00 0.00 0.00 36.38 34.34 3iv8 s VAL 370 CO -0.02 0.53 -0.08 -0.69 0.00 0.00 0.00 175.10 174.84 3iv8 s VAL 371 N 0.73 1.40 -1.48 2.92 1.01 -0.74 -0.42 120.40 123.82 3iv8 s VAL 371 Ca -0.08 -0.86 -0.12 0.00 0.00 0.00 0.00 61.98 60.93 3iv8 s VAL 371 Cb -0.16 -1.53 0.08 0.00 0.00 0.00 0.00 36.38 34.77 3iv8 s VAL 371 CO 0.01 0.13 0.80 0.59 0.00 0.00 0.00 175.10 176.63 3iv8 n ASN 372 N 4.77 -4.62 0.00 3.32 3.02 -1.16 -1.94 115.26 118.65 3iv8 n ASN 372 Ca -0.13 -0.62 0.00 0.00 -0.03 0.00 0.00 54.58 53.80 3iv8 n ASN 372 Cb 0.47 -3.73 0.00 0.00 -0.61 0.00 0.00 39.78 35.91 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 -1.51 1.73 3.49 7.41 0.00 -0.86 -3.99 105.19 111.46 3iv8 n GLY 373 Ca 0.01 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.60 3iv8 n GLY 373 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3iv8 s GLN 374 N -0.41 3.17 0.49 1.61 0.74 -0.82 -4.93 119.66 119.51 3iv8 s GLN 374 Ca 0.00 -0.64 -0.23 0.00 0.05 0.00 0.00 55.36 54.54 3iv8 s GLN 374 Cb 0.00 -3.99 -0.07 0.00 1.10 0.00 0.00 33.01 30.05 3iv8 s GLN 374 CO 0.00 -0.99 1.24 -0.47 -0.55 0.00 0.00 175.29 174.51 3iv8 s TYR 375 N 2.50 2.67 -0.30 1.67 6.14 -1.26 -1.79 117.35 126.98 3iv8 s TYR 375 Ca 0.17 1.47 -0.09 0.00 0.64 0.00 0.00 57.07 59.26 3iv8 s TYR 375 Cb -0.16 -3.54 0.16 0.00 0.42 0.00 0.00 41.96 38.83 3iv8 s TYR 375 CO 0.15 -2.02 0.76 -2.00 0.64 0.00 0.00 175.55 173.09 3iv8 s GLU 376 N -2.74 0.47 0.41 4.97 2.12 -0.37 -4.97 118.70 118.59 3iv8 s GLU 376 Ca 0.66 1.07 -0.23 0.00 0.36 0.00 0.00 54.97 56.82 3iv8 s GLU 376 Cb -0.33 0.63 -0.09 0.00 0.26 0.00 0.00 34.13 34.60 3iv8 s GLU 376 CO 0.40 -0.27 1.04 -0.65 -0.54 0.00 0.00 175.26 175.24 3iv8 s GLN 377 N 2.78 4.12 0.00 4.30 -0.21 -1.26 -0.63 119.66 128.77 3iv8 s GLN 377 Ca 0.02 1.47 0.19 0.00 0.02 0.00 0.00 55.36 57.06 3iv8 s GLN 377 Cb -0.11 -2.47 0.15 0.00 1.00 0.00 0.00 33.01 31.58 3iv8 s GLN 377 CO -0.18 -0.17 1.10 0.27 -2.12 0.00 0.00 175.29 174.19