#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3igv s MET 2 N 0.00 4.58 0.19 4.33 1.00 -1.26 -1.53 119.30 126.61 3igv s MET 2 Ca 0.00 1.65 -0.12 0.00 0.00 0.00 0.00 55.69 57.22 3igv s MET 2 Cb 0.00 -3.32 0.10 0.00 0.00 0.00 0.00 34.83 31.61 3igv s MET 2 CO 0.00 0.04 1.81 0.66 0.00 0.00 0.00 175.02 177.53 3igv h SER 3 N 5.62 0.77 -4.60 3.03 4.64 -1.57 -3.39 113.55 118.05 3igv h SER 3 Ca -0.43 -0.07 -0.23 0.00 -0.47 0.00 0.00 61.79 60.59 3igv h SER 3 Cb 1.21 -0.20 -0.23 0.00 -0.31 0.00 0.00 62.40 62.88 3igv h SER 3 CO 0.74 0.62 -0.72 -0.31 -0.87 0.00 0.00 176.83 176.29 3igv s TYR 4 N -5.93 0.35 -0.07 4.77 2.02 -1.26 -1.24 117.35 115.99 3igv s TYR 4 Ca -0.13 -0.39 0.05 0.00 -0.37 0.00 0.00 57.07 56.23 3igv s TYR 4 Cb 0.13 -0.23 -0.01 0.00 -0.40 0.00 0.00 41.96 41.46 3igv s TYR 4 CO 0.77 -0.11 -0.24 0.99 -1.57 0.00 0.00 175.55 175.40 3igv s THR 5 N -1.05 2.14 -0.10 -0.71 2.01 -0.62 -4.88 115.64 112.43 3igv s THR 5 Ca -0.10 -1.02 0.00 0.00 0.31 0.00 0.00 61.69 60.88 3igv s THR 5 Cb -0.07 -1.79 -0.02 0.00 0.01 0.00 0.00 72.50 70.62 3igv s THR 5 CO -0.00 0.57 -0.10 0.26 -0.69 0.00 0.00 174.62 174.65 3igv s TRP 6 N 0.01 2.86 -0.11 4.92 0.52 -1.26 -1.03 118.94 124.84 3igv s TRP 6 Ca -0.08 -0.32 0.15 0.00 0.02 0.00 0.00 56.10 55.86 3igv s TRP 6 Cb -0.15 -1.79 0.13 0.00 -1.15 0.00 0.00 33.47 30.51 3igv s TRP 6 CO 0.05 0.03 1.47 1.79 0.02 0.00 0.00 176.95 180.32 3igv h THR 7 N 4.87 0.89 0.00 2.01 1.35 -0.55 -3.48 112.91 118.00 3igv h THR 7 Ca -0.36 -2.18 0.00 0.00 -0.55 0.00 0.00 66.41 63.32 3igv h THR 7 Cb 1.19 2.38 0.00 0.00 -1.73 0.00 0.00 68.15 69.99 3igv h THR 7 CO 0.55 0.49 0.00 0.61 -0.25 0.00 0.00 175.52 176.92 3igv n GLY 8 N 1.12 2.03 3.78 5.82 0.00 -1.26 -5.07 105.19 111.61 3igv n GLY 8 Ca 0.02 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.63 3igv n GLY 8 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3igv s ALA 9 N -2.03 3.51 0.38 4.61 0.00 -1.26 -4.97 121.76 121.99 3igv s ALA 9 Ca 0.00 1.55 -0.22 0.00 0.00 0.00 0.00 51.96 53.29 3igv s ALA 9 Cb 0.00 -3.60 -0.10 0.00 0.00 0.00 0.00 23.12 19.42 3igv s ALA 9 CO 0.00 -1.07 0.91 -0.51 0.00 0.00 0.00 175.76 175.09 3igv s LEU 10 N -2.21 4.08 -0.37 0.00 1.43 -1.26 -4.76 118.68 115.60 3igv s LEU 10 Ca 0.54 1.66 -0.28 0.00 -1.03 0.00 0.00 54.13 55.03 3igv s LEU 10 Cb -0.46 -4.29 0.02 0.00 0.03 0.00 0.00 46.19 41.49 3igv s LEU 10 CO 0.62 -0.24 1.02 -0.63 0.23 0.00 0.00 176.35 177.35 3igv s ILE 11 N -1.97 4.49 0.07 -0.59 1.01 -1.26 -4.80 121.20 118.15 3igv s ILE 11 Ca 0.57 1.43 0.01 0.00 0.00 0.00 0.00 60.65 62.66 3igv s ILE 11 Cb -0.12 -4.41 -0.04 0.00 0.01 0.00 0.00 42.46 37.89 3igv s ILE 11 CO 0.17 -0.59 0.17 0.42 0.00 0.00 0.00 174.94 175.10 3igv s THR 12 N 3.72 5.08 0.78 2.92 -4.23 -1.26 -4.82 115.64 117.82 3igv s THR 12 Ca 0.43 -0.54 -0.07 0.00 -1.18 0.00 0.00 61.69 60.32 3igv s THR 12 Cb -0.11 -3.48 0.12 0.00 1.34 0.00 0.00 72.50 70.37 3igv s THR 12 CO 0.19 0.12 1.09 -2.16 -0.54 0.00 0.00 174.62 173.32 3igv s PRO 13 N -2.51 1.63 -0.21 3.99 0.04 -1.26 -4.31 135.00 132.37 3igv s PRO 13 Ca 0.33 -0.55 -0.16 0.00 0.04 0.00 0.00 61.00 60.65 3igv s PRO 13 Cb -0.13 -2.13 -0.12 0.00 0.04 0.00 0.00 34.50 32.16 3igv s PRO 13 CO 0.26 -1.61 -0.13 0.00 0.04 0.00 0.00 177.00 175.56 3igv n ALA 15 N -3.89 0.19 -1.75 0.00 0.00 -1.26 -5.11 120.51 108.69 3igv n ALA 15 Ca -0.32 -0.52 -0.35 0.00 0.00 0.00 0.00 53.44 52.25 3igv n ALA 15 Cb 0.64 0.22 0.02 0.00 0.00 0.00 0.00 19.45 20.33 3igv n ALA 15 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3igv s ALA 16 N -2.19 2.60 -0.17 0.00 0.00 -1.26 -5.04 121.76 115.71 3igv s ALA 16 Ca 0.07 0.91 0.01 0.00 0.00 0.00 0.00 51.96 52.94 3igv s ALA 16 Cb -0.01 -3.41 0.01 0.00 0.00 0.00 0.00 23.12 19.72 3igv s ALA 16 CO 0.04 -1.00 -0.18 -1.21 0.00 0.00 0.00 175.76 173.41 3igv s GLU 17 N -3.35 3.07 -0.05 0.00 2.02 -1.26 -5.11 118.70 114.02 3igv s GLU 17 Ca 0.75 -0.81 -0.24 0.00 0.02 0.00 0.00 54.97 54.69 3igv s GLU 17 Cb -0.27 -2.58 -0.04 0.00 0.10 0.00 0.00 34.13 31.34 3igv s GLU 17 CO 0.31 -0.12 0.72 -1.21 0.02 0.00 0.00 175.26 174.98 3igv s GLU 18 N 1.11 4.45 -0.09 1.61 2.02 -1.26 -4.94 118.70 121.60 3igv s GLU 18 Ca 0.00 0.93 0.16 0.00 0.02 0.00 0.00 54.97 56.08 3igv s GLU 18 Cb -0.14 -3.44 -0.23 0.00 0.10 0.00 0.00 34.13 30.42 3igv s GLU 18 CO -0.07 0.09 0.21 -1.13 0.02 0.00 0.00 175.26 174.37 3igv n SER 19 N 3.66 1.10 -4.76 -0.19 3.41 -1.26 -4.49 113.62 111.09 3igv n SER 19 Ca -0.01 0.00 -0.39 0.00 -0.26 0.00 0.00 58.87 58.21 3igv n SER 19 Cb 0.51 1.32 -0.06 0.00 -0.26 0.00 0.00 64.21 65.73 3igv n SER 19 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 3igv s LYS 20 N -2.77 4.29 -0.16 4.33 -0.14 -1.26 -1.54 119.74 122.48 3igv s LYS 20 Ca -0.07 0.67 -0.36 0.00 -1.36 0.00 0.00 55.97 54.86 3igv s LYS 20 Cb 0.08 -3.34 -0.12 0.00 -1.68 0.00 0.00 37.83 32.76 3igv s LYS 20 CO 0.68 0.37 1.89 -0.11 -0.76 0.00 0.00 175.35 177.41 3igv n LEU 21 N 2.76 3.10 -4.77 3.17 7.94 -1.25 -4.92 117.00 123.03 3igv n LEU 21 Ca -0.07 0.93 -0.38 0.00 -1.11 0.00 0.00 56.01 55.38 3igv n LEU 21 Cb 0.51 -1.31 -0.02 0.00 0.53 0.00 0.00 43.42 43.13 3igv n LEU 21 CO 0.43 -0.21 0.85 -2.84 -1.11 0.00 0.00 177.39 174.52 3igv s PRO 22 N 4.21 4.03 -0.12 1.96 0.02 -1.26 -5.03 135.00 138.80 3igv s PRO 22 Ca 0.96 1.87 0.03 0.00 0.02 0.00 0.00 61.00 63.88 3igv s PRO 22 Cb -0.79 -2.67 0.00 0.00 0.02 0.00 0.00 34.50 31.06 3igv s PRO 22 CO 0.55 -0.35 -0.21 0.42 -0.33 0.00 0.00 177.00 177.07 3igv s ILE 23 N -1.40 2.21 0.02 2.83 -1.09 -1.26 -4.67 121.20 117.84 3igv s ILE 23 Ca 0.57 -0.95 0.00 0.00 -2.23 0.00 0.00 60.65 58.05 3igv s ILE 23 Cb -0.31 -1.87 -0.00 0.00 -1.58 0.00 0.00 42.46 38.69 3igv s ILE 23 CO 0.40 0.55 0.01 -0.46 -1.23 0.00 0.00 174.94 174.20 3igv n ASN 24 N 3.79 0.92 0.29 3.58 6.94 -1.26 -5.04 115.26 124.50 3igv n ASN 24 Ca -0.19 -1.12 0.16 0.00 -0.02 0.00 0.00 54.58 53.41 3igv n ASN 24 Cb 0.52 0.06 0.91 0.00 -2.36 0.00 0.00 39.78 38.91 3igv n ASN 24 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 3igv h ALA 25 N 1.04 1.35 0.00 -2.53 0.00 -2.00 -2.88 119.26 114.25 3igv h ALA 25 Ca -0.02 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.86 3igv h ALA 25 Cb 0.07 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.85 3igv h ALA 25 CO 0.03 0.04 -1.06 1.28 0.00 0.00 0.00 179.25 179.54 3igv n LEU 26 N -3.63 0.63 0.28 0.00 4.77 -1.26 -4.55 117.00 113.23 3igv n LEU 26 Ca -0.03 0.11 -0.18 0.00 -0.03 0.00 0.00 56.01 55.89 3igv n LEU 26 Cb 0.13 -0.09 -0.09 0.00 -2.33 0.00 0.00 43.42 41.04 3igv n LEU 26 CO 0.27 -0.04 0.56 0.28 -1.33 0.00 0.00 177.39 177.13 3igv h SER 27 N 0.00 -1.28 -0.76 -1.43 0.02 -1.85 -2.94 113.55 105.33 3igv h SER 27 Ca 0.00 0.10 0.15 0.00 -0.84 0.00 0.00 61.79 61.21 3igv h SER 27 Cb 0.83 0.42 -0.05 0.00 0.14 0.00 0.00 62.40 63.74 3igv h SER 27 CO 0.00 -0.63 0.51 0.78 -1.14 0.00 0.00 176.83 176.35 3igv h ASN 28 N -0.94 0.36 0.35 3.07 2.35 -1.78 0.18 115.58 119.17 3igv h ASN 28 Ca -0.05 0.02 0.00 0.00 -0.55 0.00 0.00 56.30 55.72 3igv h ASN 28 Cb 0.83 -0.05 0.00 0.00 0.05 0.00 0.00 38.32 39.15 3igv h ASN 28 CO -0.06 0.18 0.00 0.77 -1.65 0.00 0.00 177.43 176.67 3igv h SER 29 N 0.38 0.00 0.00 5.81 4.64 -1.80 -3.13 113.55 119.45 3igv h SER 29 Ca 0.37 0.00 -0.33 0.00 -0.47 0.00 0.00 61.79 61.36 3igv h SER 29 Cb 0.90 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 62.93 3igv h SER 29 CO -0.11 0.00 -2.25 -0.11 -0.87 0.00 0.00 176.83 173.48 3igv n LEU 30 N -3.01 2.89 -3.67 5.97 7.94 0.52 -4.63 117.00 123.01 3igv n LEU 30 Ca -0.02 -0.09 -0.08 0.00 -1.11 0.00 0.00 56.01 54.71 3igv n LEU 30 Cb 0.15 -0.76 -0.09 0.00 0.53 0.00 0.00 43.42 43.24 3igv n LEU 30 CO 0.22 0.84 0.10 -0.22 -1.11 0.00 0.00 177.39 177.22 3igv s LEU 31 N -6.35 -0.51 -0.16 -1.96 0.20 -0.55 -4.17 118.68 105.19 3igv s LEU 31 Ca -0.30 1.07 -0.20 0.00 0.69 0.00 0.00 54.13 55.40 3igv s LEU 31 Cb 0.08 1.57 -0.23 0.00 -0.43 0.00 0.00 46.19 47.18 3igv s LEU 31 CO 0.50 -0.22 0.41 0.03 -0.29 0.00 0.00 176.35 176.79 3igv h ARG 32 N 7.59 0.09 -4.90 1.98 2.47 -1.03 -3.36 114.38 117.22 3igv h ARG 32 Ca -0.26 -0.16 -0.71 0.00 -1.26 0.00 0.00 59.98 57.59 3igv h ARG 32 Cb 1.15 0.06 -0.10 0.00 -1.65 0.00 0.00 29.97 29.44 3igv h ARG 32 CO 0.19 1.08 2.25 0.72 0.56 0.00 0.00 179.97 184.77 3igv n HIS 33 N -4.23 4.24 0.23 3.04 8.25 -0.83 -4.79 115.22 121.14 3igv n HIS 33 Ca -0.27 -2.97 0.10 0.00 -0.26 0.00 0.00 57.72 54.32 3igv n HIS 33 Cb 0.75 -2.45 0.56 0.00 1.12 0.00 0.00 29.99 29.96 3igv n HIS 33 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 3igv h HIS 34 N 6.88 0.00 0.00 4.41 3.86 -1.86 -2.55 115.15 125.89 3igv h HIS 34 Ca 0.45 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.66 3igv h HIS 34 Cb 0.78 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.25 3igv h HIS 34 CO 1.35 0.21 0.00 -2.95 0.86 0.00 0.00 177.93 177.41 3igv h ASN 35 N 0.00 0.00 1.56 2.45 -1.07 -1.98 -2.93 115.58 113.62 3igv h ASN 35 Ca -0.00 0.00 -0.01 0.00 0.07 0.00 0.00 56.30 56.35 3igv h ASN 35 Cb 0.56 0.00 -0.00 0.00 -2.07 0.00 0.00 38.32 36.81 3igv h ASN 35 CO 0.03 0.00 -0.07 0.24 0.07 0.00 0.00 177.43 177.70 3igv h MET 36 N 0.00 0.00 -5.58 4.14 2.86 -1.86 -3.45 114.93 111.03 3igv h MET 36 Ca 0.00 0.00 -0.65 0.00 -2.06 0.00 0.00 59.70 56.99 3igv h MET 36 Cb 0.32 0.00 -0.12 0.00 0.06 0.00 0.00 31.60 31.87 3igv h MET 36 CO 0.00 0.07 -0.53 0.08 1.06 0.00 0.00 176.91 177.59 3igv s VAL 37 N -3.36 5.06 0.05 -2.22 1.01 -1.11 -1.16 120.40 118.67 3igv s VAL 37 Ca 0.04 0.05 -0.15 0.00 0.00 0.00 0.00 61.98 61.92 3igv s VAL 37 Cb 0.07 -3.22 0.03 0.00 0.00 0.00 0.00 36.38 33.25 3igv s VAL 37 CO 0.64 0.56 0.35 -0.72 0.00 0.00 0.00 175.10 175.92 3igv s TYR 38 N -0.50 -0.16 -0.09 5.22 1.13 -0.94 -3.91 117.35 118.11 3igv s TYR 38 Ca 0.11 0.05 0.02 0.00 -1.41 0.00 0.00 57.07 55.84 3igv s TYR 38 Cb -0.12 0.15 -0.02 0.00 -1.10 0.00 0.00 41.96 40.87 3igv s TYR 38 CO 0.02 -0.54 -0.16 0.00 -2.51 0.00 0.00 175.55 172.36 3igv s ALA 39 N -2.62 2.52 0.61 9.51 0.00 -0.59 -1.28 121.76 129.91 3igv s ALA 39 Ca -0.04 -0.95 -0.19 0.00 0.00 0.00 0.00 51.96 50.78 3igv s ALA 39 Cb -0.01 -1.02 -0.03 0.00 0.00 0.00 0.00 23.12 22.07 3igv s ALA 39 CO -0.04 0.37 1.28 0.95 0.00 0.00 0.00 175.76 178.32 3igv s THR 40 N -0.04 2.24 0.31 0.00 -4.23 -0.57 -4.29 115.64 109.06 3igv s THR 40 Ca -0.04 0.15 0.03 0.00 -1.18 0.00 0.00 61.69 60.65 3igv s THR 40 Cb -0.14 -3.06 -0.05 0.00 1.34 0.00 0.00 72.50 70.59 3igv s THR 40 CO 0.04 -0.03 0.11 0.42 -0.54 0.00 0.00 174.62 174.62 3igv s THR 41 N -1.44 0.67 -0.33 3.99 -4.23 -1.26 -4.18 115.64 108.85 3igv s THR 41 Ca 0.79 -2.00 0.21 0.00 -1.18 0.00 0.00 61.69 59.51 3igv s THR 41 Cb -0.36 -2.60 0.21 0.00 1.34 0.00 0.00 72.50 71.10 3igv s THR 41 CO 0.39 0.00 1.64 -1.54 -0.54 0.00 0.00 174.62 174.56 3igv n SER 42 N -0.77 0.55 0.06 3.99 3.41 -1.26 -2.16 113.62 117.44 3igv n SER 42 Ca -0.01 0.72 0.10 0.00 -0.26 0.00 0.00 58.87 59.42 3igv n SER 42 Cb 0.66 -0.80 0.43 0.00 -0.26 0.00 0.00 64.21 64.23 3igv n SER 42 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 3igv n ARG 43 N -2.20 0.10 -0.35 4.33 3.00 -1.26 -2.38 116.66 117.90 3igv n ARG 43 Ca -0.00 0.27 0.09 0.00 -0.01 0.00 0.00 57.85 58.20 3igv n ARG 43 Cb 0.09 -1.67 0.26 0.00 0.00 0.00 0.00 32.46 31.14 3igv n ARG 43 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.63 176.50 3igv n SER 44 N -1.86 3.72 0.02 0.55 3.41 -0.92 -4.60 113.62 113.94 3igv n SER 44 Ca 0.04 -2.17 -0.04 0.00 -0.26 0.00 0.00 58.87 56.43 3igv n SER 44 Cb 0.25 -0.41 0.18 0.00 -0.26 0.00 0.00 64.21 63.96 3igv n SER 44 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3igv h ALA 45 N 3.17 1.03 -0.67 7.33 0.00 -1.63 -2.84 119.26 125.65 3igv h ALA 45 Ca 0.00 -0.38 0.11 0.00 0.00 0.00 0.00 54.91 54.64 3igv h ALA 45 Cb 1.02 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 18.66 3igv h ALA 45 CO 0.06 0.59 0.45 0.78 0.00 0.00 0.00 179.25 181.13 3igv h GLY 46 N 1.06 0.65 1.69 0.00 0.00 -1.81 0.57 103.07 105.24 3igv h GLY 46 Ca 0.05 -0.18 -0.19 0.00 0.00 0.00 0.00 47.33 47.01 3igv h GLY 46 CO 0.06 0.09 -0.79 1.41 0.00 0.00 0.00 176.54 177.31 3igv h LEU 47 N 0.44 0.36 -0.22 3.11 3.38 -1.85 -3.07 115.31 117.45 3igv h LEU 47 Ca 0.31 -0.26 -0.16 0.00 0.09 0.00 0.00 57.88 57.86 3igv h LEU 47 Cb 0.64 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 41.28 3igv h LEU 47 CO -0.09 1.01 -0.50 -0.09 0.09 0.00 0.00 178.44 178.86 3igv h ARG 48 N 0.19 0.73 -0.70 1.13 9.65 -1.19 -3.03 114.38 121.16 3igv h ARG 48 Ca -0.04 -0.49 0.10 0.00 -1.10 0.00 0.00 59.98 58.45 3igv h ARG 48 Cb 1.38 0.07 -0.07 0.00 -1.39 0.00 0.00 29.97 29.95 3igv h ARG 48 CO 0.13 1.11 0.33 1.96 2.80 0.00 0.00 179.97 186.30 3igv h GLN 49 N 0.46 0.53 -0.57 0.20 4.20 -0.98 -1.94 115.11 117.00 3igv h GLN 49 Ca 0.00 -0.03 0.01 0.00 0.06 0.00 0.00 58.65 58.69 3igv h GLN 49 Cb 1.11 -0.12 -0.03 0.00 0.30 0.00 0.00 27.48 28.74 3igv h GLN 49 CO 0.11 0.35 0.38 -0.22 -0.67 0.00 0.00 178.83 178.78 3igv h LYS 50 N 0.55 0.75 -0.35 1.46 3.64 -1.53 -2.95 116.57 118.15 3igv h LYS 50 Ca 0.35 -0.05 -0.03 0.00 -1.27 0.00 0.00 60.65 59.66 3igv h LYS 50 Cb 0.41 -0.17 -0.01 0.00 -0.41 0.00 0.00 32.23 32.05 3igv h LYS 50 CO -0.29 0.50 0.11 0.87 -2.27 0.00 0.00 179.45 178.37 3igv h LYS 51 N 0.77 0.54 -0.13 1.90 1.57 -1.26 -3.23 116.57 116.74 3igv h LYS 51 Ca 0.21 -0.11 0.00 0.00 -1.87 0.00 0.00 60.65 58.88 3igv h LYS 51 Cb -0.09 -0.08 0.00 0.00 0.08 0.00 0.00 32.23 32.14 3igv h LYS 51 CO -0.05 0.56 0.00 1.33 -0.57 0.00 0.00 179.45 180.73 3igv n VAL 52 N -4.65 0.16 -3.57 0.50 0.24 -0.80 -4.77 118.33 105.44 3igv n VAL 52 Ca -0.01 -0.38 -0.41 0.00 -2.04 0.00 0.00 64.34 61.50 3igv n VAL 52 Cb 0.17 0.59 -0.09 0.00 -1.47 0.00 0.00 33.84 33.03 3igv n VAL 52 CO 0.00 0.00 0.00 -0.89 -2.14 0.00 0.00 176.83 173.80 3igv s THR 53 N -1.84 4.31 0.19 3.34 2.01 -1.12 -4.68 115.64 117.86 3igv s THR 53 Ca 0.34 -1.47 -0.13 0.00 0.31 0.00 0.00 61.69 60.74 3igv s THR 53 Cb 0.19 -3.69 0.01 0.00 0.01 0.00 0.00 72.50 69.03 3igv s THR 53 CO 0.30 -0.58 0.42 0.72 -0.69 0.00 0.00 174.62 174.78 3igv s PHE 54 N 1.43 0.16 0.22 4.92 -0.71 -1.26 -4.96 117.98 117.78 3igv s PHE 54 Ca 0.04 -0.52 -0.28 0.00 -1.04 0.00 0.00 56.93 55.13 3igv s PHE 54 Cb -0.24 0.18 -0.09 0.00 -1.21 0.00 0.00 43.02 41.67 3igv s PHE 54 CO 0.02 -0.85 0.89 0.34 -1.34 0.00 0.00 175.22 174.28 3igv s ASP 55 N -2.93 7.55 -0.14 1.98 2.15 -1.26 -1.46 116.67 122.55 3igv s ASP 55 Ca 0.14 1.85 -0.01 0.00 0.43 0.00 0.00 52.55 54.96 3igv s ASP 55 Cb 0.01 -2.57 -0.02 0.00 -0.30 0.00 0.00 42.92 40.04 3igv s ASP 55 CO 0.00 0.16 -0.11 -0.13 -0.17 0.00 0.00 175.17 174.93 3igv s ARG 56 N -1.23 3.46 -0.08 4.34 3.00 -0.58 -4.96 118.95 122.89 3igv s ARG 56 Ca 0.40 -0.64 0.01 0.00 0.00 0.00 0.00 55.73 55.50 3igv s ARG 56 Cb -0.25 -2.71 -0.02 0.00 0.00 0.00 0.00 34.95 31.97 3igv s ARG 56 CO 0.30 0.22 -0.11 -0.51 0.00 0.00 0.00 175.30 175.19 3igv s LEU 57 N 0.36 2.87 -0.05 2.53 1.43 -1.26 -3.09 118.68 121.47 3igv s LEU 57 Ca -0.09 -0.18 0.02 0.00 -1.03 0.00 0.00 54.13 52.85 3igv s LEU 57 Cb -0.15 -1.62 0.01 0.00 0.03 0.00 0.00 46.19 44.46 3igv s LEU 57 CO 0.05 0.29 -0.10 -1.58 0.23 0.00 0.00 176.35 175.24 3igv s GLN 58 N -0.39 1.38 -0.31 1.70 0.74 -1.26 -3.93 119.66 117.59 3igv s GLN 58 Ca 0.05 -0.32 -0.00 0.00 0.05 0.00 0.00 55.36 55.13 3igv s GLN 58 Cb -0.12 -1.19 0.10 0.00 1.10 0.00 0.00 33.01 32.89 3igv s GLN 58 CO 0.02 0.02 0.09 0.08 -0.55 0.00 0.00 175.29 174.95 3igv s VAL 59 N 0.65 1.06 -0.28 1.34 1.01 -0.24 -5.02 120.40 118.92 3igv s VAL 59 Ca -0.12 -1.52 -0.11 0.00 0.00 0.00 0.00 61.98 60.22 3igv s VAL 59 Cb -0.14 -1.80 -0.05 0.00 0.00 0.00 0.00 36.38 34.39 3igv s VAL 59 CO 0.02 -0.67 0.20 -0.76 0.00 0.00 0.00 175.10 173.90 3igv s LEU 60 N 1.52 4.02 0.00 3.92 1.43 -1.26 -4.42 118.68 123.90 3igv s LEU 60 Ca 0.10 0.01 0.01 0.00 -1.03 0.00 0.00 54.13 53.23 3igv s LEU 60 Cb -0.17 -2.14 0.01 0.00 0.03 0.00 0.00 46.19 43.92 3igv s LEU 60 CO -0.23 -0.06 0.10 -0.90 0.23 0.00 0.00 176.35 175.50 3igv n ASP 61 N 5.06 0.86 -0.25 2.29 5.75 -1.26 -4.99 116.55 124.01 3igv n ASP 61 Ca -0.14 -1.30 -0.06 0.00 -0.01 0.00 0.00 54.79 53.29 3igv n ASP 61 Cb 0.52 -0.04 0.08 0.00 -1.03 0.00 0.00 41.12 40.65 3igv n ASP 61 CO 0.00 0.00 0.00 0.44 -0.11 0.00 0.00 177.20 177.53 3igv h ASP 62 N 0.07 1.04 -0.74 -1.12 3.32 -2.00 -2.66 116.42 114.33 3igv h ASP 62 Ca -0.05 -0.19 0.08 0.00 0.02 0.00 0.00 57.03 56.88 3igv h ASP 62 Cb 0.22 -0.27 -0.06 0.00 0.22 0.00 0.00 39.33 39.43 3igv h ASP 62 CO 0.08 0.97 0.41 0.45 -1.72 0.00 0.00 179.24 179.43 3igv h HIS 63 N 1.07 0.75 -0.44 4.55 3.86 -1.96 -0.25 115.15 122.73 3igv h HIS 63 Ca 0.23 0.03 0.02 0.00 -1.16 0.00 0.00 60.37 59.49 3igv h HIS 63 Cb 0.31 -0.23 -0.03 0.00 1.06 0.00 0.00 27.41 28.52 3igv h HIS 63 CO 0.02 0.33 0.25 -0.92 0.86 0.00 0.00 177.93 178.48 3igv h TYR 64 N 0.73 0.47 -0.11 2.45 3.20 -1.79 -2.30 116.97 119.62 3igv h TYR 64 Ca 0.35 0.02 -0.20 0.00 3.14 0.00 0.00 58.73 62.04 3igv h TYR 64 Cb 0.28 -0.15 0.00 0.00 1.54 0.00 0.00 36.73 38.40 3igv h TYR 64 CO -0.07 0.26 -0.74 0.00 -1.64 0.00 0.00 178.16 175.97 3igv h ARG 65 N 0.50 0.54 0.01 1.82 3.08 -1.26 -2.55 114.38 116.52 3igv h ARG 65 Ca 0.18 -0.44 0.02 0.00 0.07 0.00 0.00 59.98 59.80 3igv h ARG 65 Cb 0.03 0.09 -0.02 0.00 0.08 0.00 0.00 29.97 30.15 3igv h ARG 65 CO -0.09 1.07 -0.10 -0.44 -1.07 0.00 0.00 179.97 179.34 3igv h ASP 66 N 0.37 -0.28 -0.45 7.04 3.32 -0.94 0.61 116.42 126.08 3igv h ASP 66 Ca -0.04 0.04 0.00 0.00 0.02 0.00 0.00 57.03 57.06 3igv h ASP 66 Cb 1.34 0.12 -0.02 0.00 0.22 0.00 0.00 39.33 40.98 3igv h ASP 66 CO 0.14 -0.14 0.29 0.58 -1.72 0.00 0.00 179.24 178.39 3igv h VAL 67 N -0.18 1.12 -0.37 -1.35 2.07 -1.44 -1.77 116.25 114.33 3igv h VAL 67 Ca 0.03 -0.23 0.06 0.00 0.82 0.00 0.00 66.70 67.39 3igv h VAL 67 Cb 0.22 0.47 -0.06 0.00 -1.52 0.00 0.00 31.29 30.40 3igv h VAL 67 CO -0.09 0.12 0.03 0.25 0.02 0.00 0.00 177.57 177.89 3igv h LEU 68 N 0.61 -0.09 -0.63 2.57 5.85 -1.23 -0.01 115.31 122.38 3igv h LEU 68 Ca 0.16 0.08 0.08 0.00 0.84 0.00 0.00 57.88 59.04 3igv h LEU 68 Cb -0.06 0.13 -0.06 0.00 0.37 0.00 0.00 40.66 41.04 3igv h LEU 68 CO -0.03 -0.01 0.30 0.50 -0.34 0.00 0.00 178.44 178.85 3igv h LYS 69 N 0.14 0.52 -0.77 1.25 3.64 -0.48 -0.24 116.57 120.63 3igv h LYS 69 Ca 0.18 -0.03 -0.01 0.00 -1.27 0.00 0.00 60.65 59.52 3igv h LYS 69 Cb 0.24 -0.12 -0.04 0.00 -0.41 0.00 0.00 32.23 31.91 3igv h LYS 69 CO -0.28 0.35 0.44 0.93 -2.27 0.00 0.00 179.45 178.62 3igv h GLU 70 N 0.54 1.06 -0.80 1.90 5.08 -0.62 -2.02 114.58 119.72 3igv h GLU 70 Ca 0.30 -0.11 -0.04 0.00 -1.00 0.00 0.00 59.36 58.51 3igv h GLU 70 Cb 0.29 -0.21 -0.04 0.00 0.50 0.00 0.00 28.75 29.29 3igv h GLU 70 CO -0.24 0.77 0.33 0.52 -1.00 0.00 0.00 179.01 179.39 3igv h MET 71 N 1.06 1.19 -0.29 2.33 2.86 -0.22 -2.99 114.93 118.87 3igv h MET 71 Ca 0.27 -0.21 -0.13 0.00 -2.06 0.00 0.00 59.70 57.58 3igv h MET 71 Cb 0.00 -0.20 -0.01 0.00 0.06 0.00 0.00 31.60 31.45 3igv h MET 71 CO -0.05 0.95 -0.34 0.87 1.06 0.00 0.00 176.91 179.40 3igv h LYS 72 N 1.16 0.63 -0.94 1.72 1.57 -0.79 -1.56 116.57 118.37 3igv h LYS 72 Ca 0.27 -0.30 0.02 0.00 -1.87 0.00 0.00 60.65 58.77 3igv h LYS 72 Cb 0.20 -0.01 -0.05 0.00 0.08 0.00 0.00 32.23 32.46 3igv h LYS 72 CO -0.02 0.89 0.62 0.00 -0.57 0.00 0.00 179.45 180.36 3igv h ALA 73 N 1.09 1.36 0.19 3.86 0.00 -1.23 -1.53 119.26 123.00 3igv h ALA 73 Ca 0.06 -0.06 -0.31 0.00 0.00 0.00 0.00 54.91 54.60 3igv h ALA 73 Cb 0.84 -0.36 0.02 0.00 0.00 0.00 0.00 17.79 18.29 3igv h ALA 73 CO 0.07 0.58 -1.39 0.87 0.00 0.00 0.00 179.25 179.38 3igv h LYS 74 N 1.23 0.40 -0.18 0.00 1.57 -1.42 -3.30 116.57 114.87 3igv h LYS 74 Ca 0.35 -0.68 0.00 0.00 -1.87 0.00 0.00 60.65 58.46 3igv h LYS 74 Cb -0.08 0.25 -0.01 0.00 0.08 0.00 0.00 32.23 32.47 3igv h LYS 74 CO -0.09 1.32 0.11 0.00 -0.57 0.00 0.00 179.45 180.22 3igv h ALA 75 N 0.37 1.86 0.00 3.86 0.00 -1.08 -0.85 119.26 123.42 3igv h ALA 75 Ca -0.20 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.69 3igv h ALA 75 Cb 2.07 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.79 3igv h ALA 75 CO 0.23 0.13 0.00 -1.13 0.00 0.00 0.00 179.25 178.48 3igv n SER 76 N -4.51 0.00 0.03 0.00 3.41 -0.59 -1.78 113.62 110.17 3igv n SER 76 Ca -0.00 -0.46 0.12 0.00 -0.26 0.00 0.00 58.87 58.26 3igv n SER 76 Cb 0.08 -0.12 0.24 0.00 -0.26 0.00 0.00 64.21 64.15 3igv n SER 76 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 3igv n THR 77 N -1.12 0.15 -2.92 6.66 -2.24 -0.32 -4.70 114.28 109.79 3igv n THR 77 Ca 0.15 -0.12 -0.40 0.00 -2.27 0.00 0.00 64.05 61.41 3igv n THR 77 Cb 0.13 0.04 -0.05 0.00 -2.10 0.00 0.00 70.33 68.34 3igv n THR 77 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 3igv s VAL 78 N -3.08 4.47 -0.19 2.28 1.01 -0.74 -4.96 120.40 119.20 3igv s VAL 78 Ca 0.09 1.77 -0.01 0.00 0.00 0.00 0.00 61.98 63.83 3igv s VAL 78 Cb 0.16 -4.18 0.01 0.00 0.00 0.00 0.00 36.38 32.37 3igv s VAL 78 CO 0.70 0.44 -0.14 -0.75 0.00 0.00 0.00 175.10 175.35 3igv s LYS 79 N -0.65 3.16 0.06 2.72 2.20 -1.26 -0.29 119.74 125.67 3igv s LYS 79 Ca 0.39 -0.75 0.08 0.00 -0.36 0.00 0.00 55.97 55.32 3igv s LYS 79 Cb -0.23 -2.72 -0.03 0.00 -1.51 0.00 0.00 37.83 33.34 3igv s LYS 79 CO 0.26 -0.16 -0.19 0.00 -0.36 0.00 0.00 175.35 174.90 3igv s ALA 80 N 1.26 2.59 -0.02 3.13 0.00 -0.77 -4.97 121.76 122.98 3igv s ALA 80 Ca 0.03 -1.25 -0.02 0.00 0.00 0.00 0.00 51.96 50.73 3igv s ALA 80 Cb -0.14 -0.69 -0.04 0.00 0.00 0.00 0.00 23.12 22.25 3igv s ALA 80 CO -0.07 0.57 0.10 -1.59 0.00 0.00 0.00 175.76 174.77 3igv s LYS 81 N -1.63 3.17 -0.08 0.00 -2.85 -1.26 -4.49 119.74 112.60 3igv s LYS 81 Ca 0.15 -0.41 -0.30 0.00 -1.00 0.00 0.00 55.97 54.41 3igv s LYS 81 Cb -0.10 -2.93 -0.04 0.00 -2.06 0.00 0.00 37.83 32.70 3igv s LYS 81 CO 0.06 0.67 1.34 -1.17 0.10 0.00 0.00 175.35 176.35 3igv s LEU 82 N -1.64 4.26 0.39 2.77 2.96 -1.26 -4.55 118.68 121.61 3igv s LEU 82 Ca 0.22 1.91 -0.24 0.00 -0.22 0.00 0.00 54.13 55.81 3igv s LEU 82 Cb -0.12 -3.55 -0.09 0.00 0.50 0.00 0.00 46.19 42.93 3igv s LEU 82 CO 0.13 -0.73 1.01 -0.76 -1.32 0.00 0.00 176.35 174.68 3igv s LEU 83 N 2.97 4.13 0.70 -0.68 1.02 -0.04 -5.04 118.68 121.74 3igv s LEU 83 Ca 0.60 1.92 -0.11 0.00 0.02 0.00 0.00 54.13 56.56 3igv s LEU 83 Cb -0.27 -4.24 0.01 0.00 0.02 0.00 0.00 46.19 41.72 3igv s LEU 83 CO 0.22 -0.40 1.06 -0.94 0.02 0.00 0.00 176.35 176.31 3igv s SER 84 N -1.72 5.37 0.14 2.29 1.04 -1.26 -4.65 113.70 114.91 3igv s SER 84 Ca 0.58 1.52 -0.22 0.00 0.48 0.00 0.00 55.95 58.31 3igv s SER 84 Cb -0.19 -2.40 0.01 0.00 0.10 0.00 0.00 66.02 63.55 3igv s SER 84 CO 0.24 -1.44 1.65 0.58 0.98 0.00 0.00 173.24 175.25 3igv h VAL 85 N -0.72 0.52 -0.14 5.02 2.07 -1.97 -1.88 116.25 119.15 3igv h VAL 85 Ca -0.44 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.12 3igv h VAL 85 Cb 1.22 0.52 -0.07 0.00 -1.52 0.00 0.00 31.29 31.44 3igv h VAL 85 CO 0.58 0.00 -0.38 -0.33 0.02 0.00 0.00 177.57 177.46 3igv h GLU 86 N -0.20 -0.44 -0.84 1.57 3.07 -1.99 -0.30 114.58 115.46 3igv h GLU 86 Ca 0.12 0.03 0.07 0.00 -0.50 0.00 0.00 59.36 59.08 3igv h GLU 86 Cb 0.37 0.10 -0.06 0.00 -0.84 0.00 0.00 28.75 28.32 3igv h GLU 86 CO -0.31 -0.29 0.51 0.93 -1.40 0.00 0.00 179.01 178.45 3igv h GLU 87 N -0.45 0.88 -0.32 2.33 5.08 -1.90 -1.34 114.58 118.86 3igv h GLU 87 Ca 0.09 -0.05 -0.11 0.00 -1.00 0.00 0.00 59.36 58.28 3igv h GLU 87 Cb 0.60 -0.20 -0.01 0.00 0.50 0.00 0.00 28.75 29.64 3igv h GLU 87 CO -0.39 0.59 -0.26 0.00 -1.00 0.00 0.00 179.01 177.94 3igv h ALA 88 N 1.42 0.94 -0.45 3.43 0.00 -0.89 -2.92 119.26 120.79 3igv h ALA 88 Ca 0.38 -0.37 -0.08 0.00 0.00 0.00 0.00 54.91 54.83 3igv h ALA 88 Cb 0.23 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.87 3igv h ALA 88 CO -0.19 0.61 -0.06 0.00 0.00 0.00 0.00 179.25 179.61 3igv n LYS 90 N -4.19 0.19 0.00 0.00 4.76 -0.59 -2.05 118.16 116.28 3igv n LYS 90 Ca 0.02 0.48 0.13 0.00 -2.87 0.00 0.00 58.31 56.06 3igv n LYS 90 Cb 0.34 -1.91 0.30 0.00 -1.84 0.00 0.00 35.03 31.92 3igv n LYS 90 CO 0.00 0.00 0.00 1.28 -1.37 0.00 0.00 177.40 177.31 3igv n LEU 91 N -2.27 1.45 -4.69 -0.35 4.77 -0.96 -4.87 117.00 110.08 3igv n LEU 91 Ca 0.01 -0.46 -0.41 0.00 -0.03 0.00 0.00 56.01 55.12 3igv n LEU 91 Cb 0.19 -0.07 -0.04 0.00 -2.33 0.00 0.00 43.42 41.17 3igv n LEU 91 CO 0.18 0.26 0.58 -0.89 -1.33 0.00 0.00 177.39 176.19 3igv s THR 92 N -2.39 4.92 0.42 -5.08 2.01 -0.87 -1.15 115.64 113.51 3igv s THR 92 Ca 0.25 1.71 -0.25 0.00 0.31 0.00 0.00 61.69 63.71 3igv s THR 92 Cb 0.19 -4.16 -0.10 0.00 0.01 0.00 0.00 72.50 68.44 3igv s THR 92 CO 0.49 0.12 1.22 -2.65 -0.69 0.00 0.00 174.62 173.11 3igv n PRO 93 N 4.47 1.80 0.24 4.92 -0.02 -1.26 -4.81 135.00 140.33 3igv n PRO 93 Ca 0.03 0.64 0.09 0.00 -2.02 0.00 0.00 63.50 62.25 3igv n PRO 93 Cb 0.50 -2.31 0.58 0.00 -0.02 0.00 0.00 33.50 32.25 3igv n PRO 93 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 3igv h PRO 94 N 1.97 0.00 -0.65 0.52 0.11 -1.96 -2.50 132.00 129.49 3igv h PRO 94 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 3igv h PRO 94 Cb 1.30 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.41 3igv h PRO 94 CO 0.59 0.20 0.00 -2.39 -0.21 0.00 0.00 178.00 176.19 3igv n HIS 95 N -3.78 1.17 -1.93 0.65 1.44 -1.26 -4.45 115.22 107.05 3igv n HIS 95 Ca -0.02 -0.50 -0.35 0.00 -2.01 0.00 0.00 57.72 54.85 3igv n HIS 95 Cb 0.30 -0.14 0.04 0.00 0.12 0.00 0.00 29.99 30.31 3igv n HIS 95 CO 0.00 0.00 0.00 0.45 -2.81 0.00 0.00 176.34 173.98 3igv s SER 96 N -0.90 5.18 0.17 4.39 0.15 -0.94 -4.94 113.70 116.81 3igv s SER 96 Ca 0.45 2.21 -0.32 0.00 0.70 0.00 0.00 55.95 58.99 3igv s SER 96 Cb 0.27 -2.58 -0.11 0.00 -1.71 0.00 0.00 66.02 61.89 3igv s SER 96 CO 0.25 -1.59 1.70 0.00 1.20 0.00 0.00 173.24 174.81 3igv s ALA 97 N -1.92 3.84 0.75 5.45 0.00 -1.26 -4.31 121.76 124.31 3igv s ALA 97 Ca 0.73 1.48 -0.15 0.00 0.00 0.00 0.00 51.96 54.01 3igv s ALA 97 Cb -0.25 -3.69 0.03 0.00 0.00 0.00 0.00 23.12 19.21 3igv s ALA 97 CO 0.35 -0.97 1.10 0.36 0.00 0.00 0.00 175.76 176.61 3igv n LYS 98 N 4.49 0.48 -2.44 0.00 2.85 -1.26 -4.55 118.16 117.72 3igv n LYS 98 Ca 0.16 0.23 -0.32 0.00 -1.05 0.00 0.00 58.31 57.32 3igv n LYS 98 Cb 0.37 -2.35 -0.04 0.00 -0.65 0.00 0.00 35.03 32.36 3igv n LYS 98 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 177.40 177.80 3igv s SER 99 N -1.78 6.56 0.00 -5.58 0.15 -0.03 -4.65 113.70 108.37 3igv s SER 99 Ca 0.75 1.65 0.27 0.00 0.70 0.00 0.00 55.95 59.31 3igv s SER 99 Cb -0.33 -2.52 1.40 0.00 -1.71 0.00 0.00 66.02 62.86 3igv s SER 99 CO 0.49 -0.63 1.91 0.29 1.20 0.00 0.00 173.24 176.50 3igv n LYS 100 N -1.43 0.50 -0.89 5.44 5.02 -1.26 -3.82 118.16 121.72 3igv n LYS 100 Ca 0.07 0.03 -0.08 0.00 -2.02 0.00 0.00 58.31 56.31 3igv n LYS 100 Cb 0.54 -1.50 0.20 0.00 -0.02 0.00 0.00 35.03 34.25 3igv n LYS 100 CO 0.00 0.00 0.00 1.19 -0.52 0.00 0.00 177.40 178.07 3igv n PHE 101 N -1.21 1.52 -0.07 2.13 3.72 -1.26 -4.95 117.46 117.33 3igv n PHE 101 Ca 0.15 -1.62 0.00 0.00 -0.05 0.00 0.00 57.45 55.92 3igv n PHE 101 Cb 0.18 -0.58 0.00 0.00 -0.94 0.00 0.00 39.48 38.13 3igv n PHE 101 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3igv n GLY 102 N -1.09 0.52 3.35 1.37 0.00 -1.25 -5.06 105.19 103.04 3igv n GLY 102 Ca 0.38 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 46.22 3igv n GLY 102 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3igv s TYR 103 N -2.23 1.70 0.23 1.61 -0.85 -1.26 -5.03 117.35 111.51 3igv s TYR 103 Ca 0.00 -0.63 0.01 0.00 -0.52 0.00 0.00 57.07 55.93 3igv s TYR 103 Cb 0.00 -0.84 -0.00 0.00 0.38 0.00 0.00 41.96 41.50 3igv s TYR 103 CO 0.00 0.30 0.04 0.41 -1.52 0.00 0.00 175.55 174.78 3igv n GLY 104 N -0.40 3.78 0.20 5.49 0.00 -1.26 -0.85 105.19 112.16 3igv n GLY 104 Ca -0.08 -2.16 -0.05 0.00 0.00 0.00 0.00 46.02 43.73 3igv n GLY 104 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3igv h ALA 105 N 1.23 0.64 0.00 4.61 0.00 -1.84 -1.44 119.26 122.45 3igv h ALA 105 Ca -0.18 0.01 -0.11 0.00 0.00 0.00 0.00 54.91 54.63 3igv h ALA 105 Cb 0.62 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.29 3igv h ALA 105 CO 0.30 -0.05 -0.50 0.87 0.00 0.00 0.00 179.25 179.87 3igv h LYS 106 N 0.54 0.00 -0.44 0.00 1.57 -1.88 0.03 116.57 116.40 3igv h LYS 106 Ca 0.21 0.00 -0.05 0.00 -1.87 0.00 0.00 60.65 58.94 3igv h LYS 106 Cb 0.08 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.37 3igv h LYS 106 CO -0.12 0.50 0.07 -0.44 -0.57 0.00 0.00 179.45 178.89 3igv h ASP 107 N 0.00 0.70 0.03 0.86 3.32 -1.84 -2.32 116.42 117.17 3igv h ASP 107 Ca -0.01 -0.26 -0.00 0.00 0.02 0.00 0.00 57.03 56.78 3igv h ASP 107 Cb 0.93 -0.18 0.00 0.00 0.22 0.00 0.00 39.33 40.30 3igv h ASP 107 CO 0.07 0.78 -0.01 0.58 -1.72 0.00 0.00 179.24 178.93 3igv h VAL 108 N 0.59 1.06 -0.51 -1.35 2.07 -0.97 -1.30 116.25 115.82 3igv h VAL 108 Ca 0.13 -0.26 0.07 0.00 0.82 0.00 0.00 66.70 67.46 3igv h VAL 108 Cb 0.38 1.23 -0.06 0.00 -1.52 0.00 0.00 31.29 31.33 3igv h VAL 108 CO 0.01 0.07 0.19 0.03 0.02 0.00 0.00 177.57 177.89 3igv h ARG 109 N -0.15 0.36 -0.46 1.57 3.08 -0.90 -1.15 114.38 116.73 3igv h ARG 109 Ca -0.00 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.02 3igv h ARG 109 Cb 0.14 -0.08 0.00 0.00 0.08 0.00 0.00 29.97 30.11 3igv h ARG 109 CO 0.01 0.24 0.00 0.27 -1.07 0.00 0.00 179.97 179.42 3igv n ASN 110 N -4.99 2.41 -2.94 7.04 2.04 -0.88 -4.71 115.26 113.22 3igv n ASN 110 Ca 0.05 -2.07 -0.17 0.00 -0.44 0.00 0.00 54.58 51.96 3igv n ASN 110 Cb 0.20 -0.32 0.07 0.00 -2.53 0.00 0.00 39.78 37.20 3igv n ASN 110 CO 0.00 0.00 0.00 0.18 -0.44 0.00 0.00 177.26 177.00 3igv n LEU 111 N 0.67 -3.33 -4.75 -4.53 4.77 -0.43 -4.98 117.00 104.42 3igv n LEU 111 Ca 0.14 -0.45 -0.36 0.00 -0.03 0.00 0.00 56.01 55.30 3igv n LEU 111 Cb 0.41 -2.54 0.04 0.00 -2.33 0.00 0.00 43.42 38.99 3igv n LEU 111 CO 0.11 0.43 0.87 -0.94 -1.33 0.00 0.00 177.39 176.52 3igv s SER 112 N -3.60 5.13 0.42 -1.43 1.04 -0.52 -4.79 113.70 109.95 3igv s SER 112 Ca 0.27 2.47 0.09 0.00 0.48 0.00 0.00 55.95 59.26 3igv s SER 112 Cb -0.12 -2.61 0.88 0.00 0.10 0.00 0.00 66.02 64.28 3igv s SER 112 CO 0.58 -1.64 2.00 0.77 0.98 0.00 0.00 173.24 175.93 3igv h SER 113 N 0.94 0.29 -0.43 7.02 4.64 -1.94 -0.83 113.55 123.23 3igv h SER 113 Ca -0.51 -0.03 -0.02 0.00 -0.47 0.00 0.00 61.79 60.76 3igv h SER 113 Cb 1.30 -0.07 -0.02 0.00 -0.31 0.00 0.00 62.40 63.30 3igv h SER 113 CO 0.55 0.31 0.19 0.50 -0.87 0.00 0.00 176.83 177.51 3igv h LYS 114 N 0.32 0.64 0.14 4.77 3.64 -1.95 -0.76 116.57 123.36 3igv h LYS 114 Ca 0.08 -0.10 -0.01 0.00 -1.27 0.00 0.00 60.65 59.35 3igv h LYS 114 Cb 0.15 -0.11 0.00 0.00 -0.41 0.00 0.00 32.23 31.87 3igv h LYS 114 CO -0.00 0.57 -0.07 0.00 -2.27 0.00 0.00 179.45 177.68 3igv h ALA 115 N 1.04 -0.19 -1.01 5.00 0.00 -1.73 -3.09 119.26 119.29 3igv h ALA 115 Ca 0.15 -0.20 0.02 0.00 0.00 0.00 0.00 54.91 54.88 3igv h ALA 115 Cb 0.16 0.07 -0.05 0.00 0.00 0.00 0.00 17.79 17.96 3igv h ALA 115 CO -0.02 -0.40 0.67 0.28 0.00 0.00 0.00 179.25 179.78 3igv h VAL 116 N -0.59 1.23 -0.43 0.00 2.07 -1.15 -2.48 116.25 114.90 3igv h VAL 116 Ca -0.02 -0.46 -0.14 0.00 0.82 0.00 0.00 66.70 66.90 3igv h VAL 116 Cb 0.46 -0.22 -0.01 0.00 -1.52 0.00 0.00 31.29 29.99 3igv h VAL 116 CO 0.03 0.24 -0.28 0.78 0.02 0.00 0.00 177.57 178.36 3igv h ASN 117 N 1.34 0.97 -0.10 0.57 -0.26 -1.21 -2.37 115.58 114.51 3igv h ASN 117 Ca 0.38 -0.39 -0.11 0.00 -0.56 0.00 0.00 56.30 55.62 3igv h ASN 117 Cb -0.10 -0.27 -0.01 0.00 -1.06 0.00 0.00 38.32 36.88 3igv h ASN 117 CO -0.10 1.17 -0.28 -0.74 -1.06 0.00 0.00 177.43 176.42 3igv h HIS 118 N 0.79 0.64 -0.70 1.19 2.76 -1.43 -2.71 115.15 115.68 3igv h HIS 118 Ca 0.09 -0.15 -0.05 0.00 -2.20 0.00 0.00 60.37 58.06 3igv h HIS 118 Cb 0.86 -0.15 -0.03 0.00 1.55 0.00 0.00 27.41 29.63 3igv h HIS 118 CO 0.05 0.79 0.26 0.82 -1.30 0.00 0.00 177.93 178.55 3igv h ILE 119 N 0.49 1.25 -0.74 6.26 2.04 -1.33 -1.36 117.51 124.11 3igv h ILE 119 Ca 0.06 -0.80 -0.06 0.00 1.00 0.00 0.00 64.86 65.06 3igv h ILE 119 Cb 0.74 0.43 -0.03 0.00 -0.74 0.00 0.00 36.82 37.22 3igv h ILE 119 CO 0.06 0.32 0.24 0.45 0.00 0.00 0.00 178.15 179.22 3igv h HIS 120 N 1.03 1.18 -0.00 1.37 3.86 -1.22 -1.58 115.15 119.79 3igv h HIS 120 Ca 0.23 -0.11 -0.17 0.00 -1.16 0.00 0.00 60.37 59.16 3igv h HIS 120 Cb 0.23 -0.34 -0.02 0.00 1.06 0.00 0.00 27.41 28.34 3igv h HIS 120 CO 0.02 0.93 -0.78 0.66 0.86 0.00 0.00 177.93 179.61 3igv h SER 121 N 1.09 0.06 -0.51 2.45 4.64 -1.27 -0.85 113.55 119.16 3igv h SER 121 Ca 0.24 -0.05 -0.09 0.00 -0.47 0.00 0.00 61.79 61.42 3igv h SER 121 Cb 0.29 -0.02 -0.02 0.00 -0.31 0.00 0.00 62.40 62.35 3igv h SER 121 CO -0.01 0.82 -0.05 0.58 -0.87 0.00 0.00 176.83 177.30 3igv h VAL 122 N 0.03 1.27 -0.31 0.95 2.07 -1.16 -1.10 116.25 118.00 3igv h VAL 122 Ca -0.01 -1.17 -0.02 0.00 0.82 0.00 0.00 66.70 66.32 3igv h VAL 122 Cb 1.38 0.98 -0.01 0.00 -1.52 0.00 0.00 31.29 32.12 3igv h VAL 122 CO 0.11 0.41 0.13 -0.25 0.02 0.00 0.00 177.57 177.99 3igv h TRP 123 N 0.80 0.47 -0.52 1.57 2.91 -1.16 -1.33 115.95 118.69 3igv h TRP 123 Ca 0.14 -0.03 -0.01 0.00 1.13 0.00 0.00 58.89 60.12 3igv h TRP 123 Cb 0.59 -0.14 -0.03 0.00 -0.51 0.00 0.00 29.16 29.07 3igv h TRP 123 CO 0.04 0.44 0.30 -0.22 -1.03 0.00 0.00 178.44 177.98 3igv h LYS 124 N 0.36 0.72 -0.15 2.65 3.64 -1.11 -1.89 116.57 120.80 3igv h LYS 124 Ca 0.10 -0.07 -0.04 0.00 -1.27 0.00 0.00 60.65 59.37 3igv h LYS 124 Cb 0.17 -0.15 -0.01 0.00 -0.41 0.00 0.00 32.23 31.83 3igv h LYS 124 CO -0.01 0.54 -0.08 0.22 -2.27 0.00 0.00 179.45 177.85 3igv h ASP 125 N 0.70 0.21 -0.43 4.20 3.58 -1.12 -2.35 116.42 121.22 3igv h ASP 125 Ca 0.19 -0.03 -0.09 0.00 0.42 0.00 0.00 57.03 57.52 3igv h ASP 125 Cb 0.02 -0.05 -0.02 0.00 1.72 0.00 0.00 39.33 40.99 3igv h ASP 125 CO -0.03 0.33 -0.03 -0.07 -2.88 0.00 0.00 179.24 176.55 3igv h LEU 126 N 0.22 0.83 -0.96 2.28 3.38 -0.47 -2.03 115.31 118.56 3igv h LEU 126 Ca 0.05 -0.22 -0.10 0.00 0.09 0.00 0.00 57.88 57.69 3igv h LEU 126 Cb 0.29 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.81 3igv h LEU 126 CO 0.01 0.92 -0.49 -0.07 0.09 0.00 0.00 178.44 178.90 3igv h LEU 127 N 0.79 0.00 0.00 1.67 3.38 -0.88 -3.30 115.31 116.97 3igv h LEU 127 Ca 0.14 0.00 -0.19 0.00 0.09 0.00 0.00 57.88 57.93 3igv h LEU 127 Cb 0.52 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.24 3igv h LEU 127 CO 0.03 0.49 -1.68 -0.62 0.09 0.00 0.00 178.44 176.75 3igv n GLU 128 N -3.83 0.64 -4.12 1.13 1.02 -1.02 -4.88 120.64 109.58 3igv n GLU 128 Ca -0.01 0.13 -0.31 0.00 -0.02 0.00 0.00 57.16 56.95 3igv n GLU 128 Cb 0.53 -1.72 -0.16 0.00 -0.02 0.00 0.00 31.44 30.07 3igv n GLU 128 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 3igv s ASP 129 N -5.56 2.76 -0.18 1.62 -1.08 -0.77 -5.00 116.67 108.45 3igv s ASP 129 Ca -0.05 -0.51 0.15 0.00 -0.52 0.00 0.00 52.55 51.62 3igv s ASP 129 Cb 0.09 -1.23 0.38 0.00 -1.46 0.00 0.00 42.92 40.70 3igv s ASP 129 CO 0.83 -0.03 1.24 0.35 0.52 0.00 0.00 175.17 178.07 3igv n THR 130 N 4.65 2.11 0.00 1.71 -2.24 -1.26 -4.64 114.28 114.61 3igv n THR 130 Ca -0.18 -2.59 0.00 0.00 -2.27 0.00 0.00 64.05 59.00 3igv n THR 130 Cb 0.50 -0.25 0.00 0.00 -2.10 0.00 0.00 70.33 68.48 3igv n THR 130 CO 0.00 0.00 0.00 1.33 -0.57 0.00 0.00 175.07 175.83 3igv n VAL 131 N -1.20 0.00 -2.24 2.28 0.24 -1.26 -4.71 118.33 111.44 3igv n VAL 131 Ca 0.19 0.00 -0.43 0.00 -2.04 0.00 0.00 64.34 62.07 3igv n VAL 131 Cb 0.73 -0.08 -0.02 0.00 -1.47 0.00 0.00 33.84 33.00 3igv n VAL 131 CO 0.00 0.00 0.00 -0.89 -2.14 0.00 0.00 176.83 173.80 3igv s THR 132 N -1.11 3.78 0.34 3.34 2.01 -1.26 -4.80 115.64 117.95 3igv s THR 132 Ca 0.00 0.82 -0.27 0.00 0.31 0.00 0.00 61.69 62.55 3igv s THR 132 Cb 0.00 -4.00 -0.13 0.00 0.01 0.00 0.00 72.50 68.38 3igv s THR 132 CO 0.00 -0.60 1.03 -2.65 -0.69 0.00 0.00 174.62 171.72 3igv n PRO 133 N 8.07 1.44 -3.66 4.92 -0.02 -1.26 -4.75 135.00 139.74 3igv n PRO 133 Ca 0.18 0.51 -0.38 0.00 -2.02 0.00 0.00 63.50 61.80 3igv n PRO 133 Cb 0.47 -1.96 -0.06 0.00 -0.02 0.00 0.00 33.50 31.93 3igv n PRO 133 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 3igv s ILE 134 N -1.14 5.24 0.24 4.25 1.01 0.25 -4.97 121.20 126.07 3igv s ILE 134 Ca 0.59 0.57 -0.31 0.00 0.00 0.00 0.00 60.65 61.50 3igv s ILE 134 Cb -0.64 -3.58 -0.11 0.00 0.01 0.00 0.00 42.46 38.14 3igv s ILE 134 CO 0.59 0.59 1.64 -0.62 0.00 0.00 0.00 174.94 177.14 3igv s ASP 135 N -1.00 6.42 0.07 3.58 2.15 -1.26 -4.47 116.67 122.17 3igv s ASP 135 Ca 0.20 2.86 0.08 0.00 0.43 0.00 0.00 52.55 56.11 3igv s ASP 135 Cb -0.15 -2.61 -0.03 0.00 -0.30 0.00 0.00 42.92 39.83 3igv s ASP 135 CO 0.09 -0.91 -0.21 0.42 -0.17 0.00 0.00 175.17 174.38 3igv s THR 136 N 0.64 1.74 -0.17 1.71 -4.23 -1.20 -4.19 115.64 109.94 3igv s THR 136 Ca 0.69 -1.39 -0.11 0.00 -1.18 0.00 0.00 61.69 59.69 3igv s THR 136 Cb -0.48 -1.54 -0.05 0.00 1.34 0.00 0.00 72.50 71.77 3igv s THR 136 CO 0.39 0.08 0.20 -0.89 -0.54 0.00 0.00 174.62 173.86 3igv s THR 137 N -0.98 5.37 -0.23 3.99 2.01 0.13 -0.91 115.64 125.02 3igv s THR 137 Ca 0.07 0.34 -0.08 0.00 0.31 0.00 0.00 61.69 62.34 3igv s THR 137 Cb -0.09 -3.53 -0.04 0.00 0.01 0.00 0.00 72.50 68.85 3igv s THR 137 CO 0.03 0.45 0.09 -0.51 -0.69 0.00 0.00 174.62 173.98 3igv s ILE 138 N 0.20 4.64 0.26 1.82 2.07 -0.59 -1.50 121.20 128.10 3igv s ILE 138 Ca 0.12 -0.07 0.08 0.00 -1.41 0.00 0.00 60.65 59.37 3igv s ILE 138 Cb -0.12 -3.15 -0.05 0.00 0.13 0.00 0.00 42.46 39.27 3igv s ILE 138 CO 0.01 0.37 -0.10 -0.04 -1.91 0.00 0.00 174.94 173.27 3igv s MET 139 N 1.19 1.51 -0.25 3.50 -1.94 0.25 -4.37 119.30 119.19 3igv s MET 139 Ca 0.05 -1.73 -0.08 0.00 -1.71 0.00 0.00 55.69 52.22 3igv s MET 139 Cb -0.14 -1.24 -0.03 0.00 2.01 0.00 0.00 34.83 35.42 3igv s MET 139 CO 0.04 0.12 0.10 0.00 -0.01 0.00 0.00 175.02 175.27 3igv s ALA 140 N -2.93 3.27 0.37 3.03 0.00 -1.26 -0.75 121.76 123.49 3igv s ALA 140 Ca 0.27 -1.09 -0.27 0.00 0.00 0.00 0.00 51.96 50.88 3igv s ALA 140 Cb 0.01 -2.16 -0.09 0.00 0.00 0.00 0.00 23.12 20.88 3igv s ALA 140 CO 0.11 -0.45 1.29 0.15 0.00 0.00 0.00 175.76 176.86 3igv s LYS 141 N 1.54 4.14 -0.54 0.00 1.02 0.48 -4.65 119.74 121.74 3igv s LYS 141 Ca 0.06 2.15 -0.16 0.00 0.02 0.00 0.00 55.97 58.04 3igv s LYS 141 Cb -0.15 -2.88 0.12 0.00 -0.52 0.00 0.00 37.83 34.40 3igv s LYS 141 CO 0.05 -0.35 0.51 -0.80 -0.92 0.00 0.00 175.35 173.84 3igv s ASN 142 N -0.67 6.18 -0.02 2.83 0.02 -1.26 -4.32 114.94 117.71 3igv s ASN 142 Ca 0.53 -1.68 0.05 0.00 -1.02 0.00 0.00 52.86 50.74 3igv s ASN 142 Cb -0.38 -2.22 -0.03 0.00 0.02 0.00 0.00 41.25 38.64 3igv s ASN 142 CO 0.50 -0.86 -0.15 -1.61 0.02 0.00 0.00 177.10 175.00 3igv s GLU 143 N 1.73 2.37 -0.07 -0.60 2.02 -1.26 -4.88 118.70 118.00 3igv s GLU 143 Ca 0.04 -0.79 -0.13 0.00 0.02 0.00 0.00 54.97 54.11 3igv s GLU 143 Cb -0.28 -2.32 -0.05 0.00 0.10 0.00 0.00 34.13 31.57 3igv s GLU 143 CO 0.04 0.59 0.32 0.08 0.02 0.00 0.00 175.26 176.31 3igv s VAL 144 N -0.81 5.21 0.29 2.63 1.01 -1.26 -1.51 120.40 125.96 3igv s VAL 144 Ca 0.13 0.63 0.03 0.00 0.00 0.00 0.00 61.98 62.77 3igv s VAL 144 Cb -0.11 -3.62 -0.03 0.00 0.00 0.00 0.00 36.38 32.62 3igv s VAL 144 CO 0.03 0.54 0.27 -0.36 0.00 0.00 0.00 175.10 175.57 3igv s PHE 145 N -0.65 1.47 -0.07 5.22 0.08 -0.41 -4.79 117.98 118.83 3igv s PHE 145 Ca 0.20 -1.51 -0.00 0.00 0.12 0.00 0.00 56.93 55.73 3igv s PHE 145 Cb -0.15 -0.57 -0.03 0.00 -0.57 0.00 0.00 43.02 41.70 3igv s PHE 145 CO 0.09 -0.84 -0.02 0.00 -0.10 0.00 0.00 175.22 174.35 3igv s VAL 147 N -0.90 2.46 0.00 0.00 -7.23 -0.31 -5.00 120.40 109.42 3igv s VAL 147 Ca 0.14 0.32 0.00 0.00 -1.81 0.00 0.00 61.98 60.63 3igv s VAL 147 Cb -0.11 -3.15 0.00 0.00 0.56 0.00 0.00 36.38 33.68 3igv s VAL 147 CO 0.03 -0.03 0.00 1.67 -0.31 0.00 0.00 175.10 176.47 3igv n GLN 148 N -1.16 0.99 -4.43 4.82 7.27 -1.26 -5.06 117.38 118.55 3igv n GLN 148 Ca 0.11 0.00 -0.34 0.00 0.07 0.00 0.00 57.00 56.84 3igv n GLN 148 Cb 0.47 -0.84 -0.11 0.00 2.41 0.00 0.00 30.24 32.18 3igv n GLN 148 CO 0.00 0.00 0.00 1.03 0.07 0.00 0.00 177.06 178.16 3igv s ARG 154 N -1.68 3.19 0.02 3.69 0.52 -1.26 -5.32 118.95 118.11 3igv s ARG 154 Ca 0.00 -0.47 -0.19 0.00 -0.52 0.00 0.00 55.73 54.55 3igv s ARG 154 Cb 0.00 -2.80 -0.06 0.00 0.52 0.00 0.00 34.95 32.61 3igv s ARG 154 CO 0.00 0.53 0.54 0.15 0.02 0.00 0.00 175.30 176.54 3igv s LYS 155 N -0.41 4.21 0.52 3.54 1.02 -1.26 -5.08 119.74 122.27 3igv s LYS 155 Ca 0.07 0.65 -0.18 0.00 0.02 0.00 0.00 55.97 56.53 3igv s LYS 155 Cb -0.12 -3.29 -0.07 0.00 -0.52 0.00 0.00 37.83 33.83 3igv s LYS 155 CO 0.02 0.51 1.02 -1.25 -0.92 0.00 0.00 175.35 174.73 3igv s PRO 156 N -0.62 3.71 0.60 -1.68 0.04 -1.26 -4.80 135.00 130.99 3igv s PRO 156 Ca 0.28 1.20 -0.19 0.00 0.04 0.00 0.00 61.00 62.33 3igv s PRO 156 Cb -0.18 -2.09 -0.04 0.00 0.04 0.00 0.00 34.50 32.23 3igv s PRO 156 CO 0.17 -0.49 1.21 0.00 0.04 0.00 0.00 177.00 177.93 3igv n ALA 157 N -1.43 0.97 -2.22 8.56 0.00 -1.26 -4.94 120.51 120.19 3igv n ALA 157 Ca 0.08 0.05 -0.32 0.00 0.00 0.00 0.00 53.44 53.25 3igv n ALA 157 Cb 0.53 -2.27 -0.06 0.00 0.00 0.00 0.00 19.45 17.66 3igv n ALA 157 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 3igv s ARG 158 N -3.01 3.93 -0.13 0.00 0.52 -1.26 -4.71 118.95 114.29 3igv s ARG 158 Ca 0.77 0.54 -0.09 0.00 -0.52 0.00 0.00 55.73 56.43 3igv s ARG 158 Cb -0.41 -2.48 -0.04 0.00 0.52 0.00 0.00 34.95 32.53 3igv s ARG 158 CO 0.45 0.18 0.18 -0.51 0.02 0.00 0.00 175.30 175.63 3igv s LEU 159 N -3.02 4.34 -0.14 2.53 1.43 -1.26 -0.39 118.68 122.17 3igv s LEU 159 Ca 0.52 0.47 -0.00 0.00 -1.03 0.00 0.00 54.13 54.09 3igv s LEU 159 Cb -0.10 -2.17 -0.01 0.00 0.03 0.00 0.00 46.19 43.94 3igv s LEU 159 CO 0.20 0.31 -0.13 -0.51 0.23 0.00 0.00 176.35 176.45 3igv s ILE 160 N -0.55 3.07 -0.15 -0.59 1.10 0.07 -4.86 121.20 119.30 3igv s ILE 160 Ca 0.14 -0.65 0.02 0.00 -0.51 0.00 0.00 60.65 59.65 3igv s ILE 160 Cb -0.12 -2.29 0.01 0.00 0.15 0.00 0.00 42.46 40.20 3igv s ILE 160 CO 0.04 0.52 -0.20 -0.69 -2.11 0.00 0.00 174.94 172.50 3igv s VAL 161 N 0.42 2.23 -0.07 4.00 1.01 -1.26 -0.58 120.40 126.14 3igv s VAL 161 Ca -0.10 -0.92 -0.16 0.00 0.00 0.00 0.00 61.98 60.81 3igv s VAL 161 Cb -0.16 -1.91 0.03 0.00 0.00 0.00 0.00 36.38 34.34 3igv s VAL 161 CO 0.05 0.54 0.38 0.72 0.00 0.00 0.00 175.10 176.79 3igv s PHE 162 N 0.91 -0.33 0.91 5.22 -0.71 -0.56 -0.67 117.98 122.74 3igv s PHE 162 Ca -0.04 0.69 -0.15 0.00 -1.04 0.00 0.00 56.93 56.39 3igv s PHE 162 Cb -0.15 0.15 0.16 0.00 -1.21 0.00 0.00 43.02 41.97 3igv s PHE 162 CO -0.03 -0.34 1.28 -1.25 -1.34 0.00 0.00 175.22 173.54 3igv s PRO 163 N -0.67 1.07 0.60 1.99 0.04 -1.26 0.17 135.00 136.94 3igv s PRO 163 Ca -0.08 -0.25 -0.18 0.00 0.04 0.00 0.00 61.00 60.53 3igv s PRO 163 Cb -0.04 -1.88 -0.03 0.00 0.04 0.00 0.00 34.50 32.59 3igv s PRO 163 CO 0.03 -2.15 1.19 0.34 0.04 0.00 0.00 177.00 176.45 3igv s ASP 164 N -4.79 5.21 0.23 6.66 2.15 -1.26 -4.77 116.67 120.10 3igv s ASP 164 Ca 0.70 2.33 -0.17 0.00 0.43 0.00 0.00 52.55 55.84 3igv s ASP 164 Cb -0.06 -2.59 0.26 0.00 -0.30 0.00 0.00 42.92 40.23 3igv s ASP 164 CO 0.52 -1.58 1.55 0.25 -0.17 0.00 0.00 175.17 175.74 3igv h LEU 165 N 0.81 -1.40 -0.81 -1.34 5.85 -1.83 -0.42 115.31 116.18 3igv h LEU 165 Ca -0.50 0.31 0.18 0.00 0.84 0.00 0.00 57.88 58.71 3igv h LEU 165 Cb 1.29 0.75 -0.11 0.00 0.37 0.00 0.00 40.66 42.96 3igv h LEU 165 CO 0.55 -0.29 0.32 1.23 -0.34 0.00 0.00 178.44 179.90 3igv h GLY 166 N -0.00 1.28 1.03 3.75 0.00 -1.95 0.25 103.07 107.44 3igv h GLY 166 Ca 0.36 -0.14 -0.07 0.00 0.00 0.00 0.00 47.33 47.48 3igv h GLY 166 CO -0.99 -0.18 0.07 -2.08 0.00 0.00 0.00 176.54 173.36 3igv h VAL 167 N 0.40 1.26 -0.71 4.60 2.07 -1.46 -2.45 116.25 119.97 3igv h VAL 167 Ca 0.47 -1.01 0.02 0.00 0.82 0.00 0.00 66.70 67.00 3igv h VAL 167 Cb 0.81 0.81 -0.04 0.00 -1.52 0.00 0.00 31.29 31.35 3igv h VAL 167 CO -0.47 0.37 0.46 0.03 0.02 0.00 0.00 177.57 177.98 3igv h ARG 168 N 0.85 0.90 -0.71 1.57 3.08 -0.30 0.27 114.38 120.04 3igv h ARG 168 Ca 0.17 -0.05 -0.01 0.00 0.07 0.00 0.00 59.98 60.16 3igv h ARG 168 Cb 0.45 -0.20 -0.03 0.00 0.08 0.00 0.00 29.97 30.26 3igv h ARG 168 CO 0.02 0.59 0.42 0.28 -1.07 0.00 0.00 179.97 180.21 3igv h VAL 169 N 0.93 1.21 -0.74 2.04 2.07 -1.23 -2.46 116.25 118.06 3igv h VAL 169 Ca 0.27 -0.47 -0.03 0.00 0.82 0.00 0.00 66.70 67.29 3igv h VAL 169 Cb -0.06 0.23 -0.03 0.00 -1.52 0.00 0.00 31.29 29.91 3igv h VAL 169 CO -0.08 0.22 0.32 0.00 0.02 0.00 0.00 177.57 178.05 3igv h GLU 171 N 1.05 0.11 -0.80 0.00 5.08 -0.23 -2.54 114.58 117.26 3igv h GLU 171 Ca 0.25 -0.01 0.06 0.00 -1.00 0.00 0.00 59.36 58.67 3igv h GLU 171 Cb 0.15 -0.03 -0.06 0.00 0.50 0.00 0.00 28.75 29.31 3igv h GLU 171 CO -0.03 0.07 0.48 0.87 -1.00 0.00 0.00 179.01 179.40 3igv h LYS 172 N 0.12 0.84 -0.11 2.33 1.57 -1.13 0.29 116.57 120.47 3igv h LYS 172 Ca 0.16 -0.05 0.03 0.00 -1.87 0.00 0.00 60.65 58.91 3igv h LYS 172 Cb 0.20 -0.19 -0.03 0.00 0.08 0.00 0.00 32.23 32.30 3igv h LYS 172 CO -0.25 0.55 -0.06 0.52 -0.57 0.00 0.00 179.45 179.65 3igv h MET 173 N 0.86 -0.05 0.14 3.15 2.86 -1.02 -1.62 114.93 119.25 3igv h MET 173 Ca 0.35 0.00 -0.28 0.00 -2.06 0.00 0.00 59.70 57.72 3igv h MET 173 Cb 0.20 0.01 0.01 0.00 0.06 0.00 0.00 31.60 31.88 3igv h MET 173 CO -0.18 -0.03 -1.26 0.00 1.06 0.00 0.00 176.91 176.49 3igv h ALA 174 N 1.05 0.08 0.00 6.32 0.00 -1.21 -0.06 119.26 125.44 3igv h ALA 174 Ca 0.06 -0.88 0.00 0.00 0.00 0.00 0.00 54.91 54.09 3igv h ALA 174 Cb 0.14 0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.95 3igv h ALA 174 CO -0.14 0.95 0.00 1.28 0.00 0.00 0.00 179.25 181.34 3igv n LEU 175 N -3.55 0.37 -0.17 0.00 4.77 0.99 -4.73 117.00 114.68 3igv n LEU 175 Ca -0.09 -0.61 -0.07 0.00 -0.03 0.00 0.00 56.01 55.20 3igv n LEU 175 Cb 1.03 0.00 0.02 0.00 -2.33 0.00 0.00 43.42 42.14 3igv n LEU 175 CO 0.54 0.09 1.08 0.22 -1.33 0.00 0.00 177.39 178.00 3igv h TYR 176 N 0.00 0.63 -0.30 -1.77 3.20 -1.38 -1.77 116.97 115.58 3igv h TYR 176 Ca 0.00 0.01 -0.08 0.00 3.14 0.00 0.00 58.73 61.80 3igv h TYR 176 Cb 0.03 -0.21 -0.01 0.00 1.54 0.00 0.00 36.73 38.08 3igv h TYR 176 CO 0.00 0.40 -0.13 0.22 -1.64 0.00 0.00 178.16 177.01 3igv h ASP 177 N 0.68 0.64 0.31 -2.11 3.58 -1.80 -2.57 116.42 115.15 3igv h ASP 177 Ca 0.18 -0.40 0.00 0.00 0.42 0.00 0.00 57.03 57.24 3igv h ASP 177 Cb -0.08 -0.18 -0.02 0.00 1.72 0.00 0.00 39.33 40.77 3igv h ASP 177 CO -0.04 0.89 -0.33 0.58 -2.88 0.00 0.00 179.24 177.46 3igv h VAL 178 N 0.38 0.31 0.00 2.25 2.07 -1.80 -1.92 116.25 117.55 3igv h VAL 178 Ca 0.07 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.59 3igv h VAL 178 Cb 0.64 0.31 0.00 0.00 -1.52 0.00 0.00 31.29 30.73 3igv h VAL 178 CO 0.04 0.00 0.00 -0.37 0.02 0.00 0.00 177.57 177.26 3igv h VAL 179 N -0.67 0.00 0.00 2.57 -1.51 -1.37 0.18 116.25 115.45 3igv h VAL 179 Ca -0.01 -0.27 -0.10 0.00 -1.23 0.00 0.00 66.70 65.08 3igv h VAL 179 Cb 0.62 1.10 -0.02 0.00 -2.13 0.00 0.00 31.29 30.86 3igv h VAL 179 CO -0.08 0.00 -0.91 0.28 -1.23 0.00 0.00 177.57 175.63 3igv h SER 180 N 0.00 0.00 0.00 4.19 0.02 -1.06 -3.43 113.55 113.27 3igv h SER 180 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 3igv h SER 180 Cb 0.33 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.87 3igv h SER 180 CO 0.00 0.39 -0.93 0.35 -1.14 0.00 0.00 176.83 175.51 3igv n THR 181 N -2.98 0.00 -0.19 -2.27 -2.24 -0.76 -4.62 114.28 101.23 3igv n THR 181 Ca -0.03 0.00 -0.06 0.00 -2.27 0.00 0.00 64.05 61.70 3igv n THR 181 Cb 0.72 -0.68 0.04 0.00 -2.10 0.00 0.00 70.33 68.31 3igv n THR 181 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 3igv h LEU 182 N 0.00 0.57 -1.25 3.22 6.46 -0.88 -3.19 115.31 120.23 3igv h LEU 182 Ca 0.00 -0.00 0.01 0.00 -0.12 0.00 0.00 57.88 57.76 3igv h LEU 182 Cb 0.93 -0.13 -0.04 0.00 -0.73 0.00 0.00 40.66 40.70 3igv h LEU 182 CO 0.00 0.40 0.49 -0.65 -0.62 0.00 0.00 178.44 178.07 3igv h PRO 183 N 0.68 0.99 -0.30 5.25 0.11 -1.82 0.10 132.00 137.02 3igv h PRO 183 Ca 0.22 -0.06 -0.09 0.00 0.11 0.00 0.00 66.00 66.17 3igv h PRO 183 Cb -0.01 -0.22 -0.01 0.00 0.11 0.00 0.00 31.00 30.87 3igv h PRO 183 CO -0.08 0.66 -0.15 0.37 -0.21 0.00 0.00 178.00 178.59 3igv h GLN 184 N 1.02 0.64 -0.67 1.05 -0.00 -1.87 -0.63 115.11 114.65 3igv h GLN 184 Ca 0.28 -0.28 -0.07 0.00 -0.00 0.00 0.00 58.65 58.58 3igv h GLN 184 Cb -0.11 -0.02 -0.03 0.00 0.00 0.00 0.00 27.48 27.32 3igv h GLN 184 CO -0.06 0.87 0.15 0.28 0.00 0.00 0.00 178.83 180.07 3igv h VAL 185 N 0.39 1.26 0.01 2.39 2.07 -1.42 0.12 116.25 121.07 3igv h VAL 185 Ca 0.07 -0.96 -0.09 0.00 0.82 0.00 0.00 66.70 66.54 3igv h VAL 185 Cb 0.68 0.57 0.01 0.00 -1.52 0.00 0.00 31.29 31.03 3igv h VAL 185 CO 0.05 0.36 -0.37 0.58 0.02 0.00 0.00 177.57 178.21 3igv h VAL 186 N 1.02 1.53 -0.01 2.57 2.07 -0.96 -3.38 116.25 119.09 3igv h VAL 186 Ca 0.21 -2.07 0.00 0.00 0.82 0.00 0.00 66.70 65.66 3igv h VAL 186 Cb 0.37 2.82 0.00 0.00 -1.52 0.00 0.00 31.29 32.95 3igv h VAL 186 CO 0.00 0.57 -0.60 0.23 0.02 0.00 0.00 177.57 177.80 3igv n MET 187 N -4.41 1.07 0.00 1.57 2.81 -0.25 -4.90 117.12 113.02 3igv n MET 187 Ca -0.10 -0.64 0.00 0.00 -1.81 0.00 0.00 57.70 55.14 3igv n MET 187 Cb 0.58 -1.43 0.00 0.00 -0.71 0.00 0.00 33.22 31.66 3igv n MET 187 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3igv n GLY 188 N 1.39 3.55 0.00 3.03 0.00 0.43 -1.98 105.19 111.62 3igv n GLY 188 Ca 0.07 -0.12 0.12 0.00 0.00 0.00 0.00 46.02 46.09 3igv n GLY 188 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3igv n SER 189 N 4.62 0.00 0.23 1.61 3.41 -1.26 -2.80 113.62 119.43 3igv n SER 189 Ca 0.00 0.30 0.11 0.00 -0.26 0.00 0.00 58.87 59.02 3igv n SER 189 Cb 0.00 -0.43 0.48 0.00 -0.26 0.00 0.00 64.21 64.00 3igv n SER 189 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 3igv h SER 190 N 0.00 0.00 -3.43 4.04 0.02 -1.57 -3.43 113.55 109.18 3igv h SER 190 Ca 0.00 0.00 -0.57 0.00 -0.84 0.00 0.00 61.79 60.38 3igv h SER 190 Cb 0.36 0.00 -0.06 0.00 0.14 0.00 0.00 62.40 62.85 3igv h SER 190 CO 0.00 0.20 0.99 -0.47 -1.14 0.00 0.00 176.83 176.41 3igv s TYR 191 N -3.65 2.64 -0.78 3.45 5.04 -1.12 -0.81 117.35 122.11 3igv s TYR 191 Ca 0.01 0.75 0.26 0.00 -2.44 0.00 0.00 57.07 55.65 3igv s TYR 191 Cb 0.10 -4.27 0.84 0.00 0.35 0.00 0.00 41.96 38.98 3igv s TYR 191 CO 0.63 -1.61 1.75 0.41 -1.34 0.00 0.00 175.55 175.39 3igv n GLY 192 N 4.82 -1.63 0.04 8.97 0.00 -0.20 -3.61 105.19 113.58 3igv n GLY 192 Ca 0.14 -0.07 0.15 0.00 0.00 0.00 0.00 46.02 46.24 3igv n GLY 192 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3igv n PHE 193 N -2.08 0.00 0.60 1.61 3.72 -1.26 -2.73 117.46 117.32 3igv n PHE 193 Ca 0.06 0.00 0.13 0.00 -0.05 0.00 0.00 57.45 57.59 3igv n PHE 193 Cb 0.41 -0.22 0.39 0.00 -0.94 0.00 0.00 39.48 39.12 3igv n PHE 193 CO 0.00 0.00 0.00 -0.56 -0.05 0.00 0.00 176.76 176.15 3igv h GLN 194 N 0.20 0.00 -5.50 -1.08 3.07 -1.67 -3.20 115.11 106.93 3igv h GLN 194 Ca 0.00 0.00 -0.59 0.00 0.09 0.00 0.00 58.65 58.15 3igv h GLN 194 Cb 0.28 0.00 -0.10 0.00 0.08 0.00 0.00 27.48 27.74 3igv h GLN 194 CO 0.00 0.00 -0.29 0.71 0.09 0.00 0.00 178.83 179.34 3igv s TYR 195 N -3.11 3.45 0.86 0.06 2.02 -1.11 -4.63 117.35 114.90 3igv s TYR 195 Ca 0.10 0.62 -0.12 0.00 -0.37 0.00 0.00 57.07 57.31 3igv s TYR 195 Cb 0.12 -2.40 0.11 0.00 -0.40 0.00 0.00 41.96 39.39 3igv s TYR 195 CO 0.60 0.18 1.10 -1.54 -1.57 0.00 0.00 175.55 174.32 3igv s SER 196 N 0.61 3.85 0.21 2.29 1.04 -1.26 -4.79 113.70 115.65 3igv s SER 196 Ca 0.18 1.35 -0.11 0.00 0.48 0.00 0.00 55.95 57.86 3igv s SER 196 Cb -0.14 -2.05 0.29 0.00 0.10 0.00 0.00 66.02 64.22 3igv s SER 196 CO 0.05 -2.38 1.69 -0.65 0.98 0.00 0.00 173.24 172.92 3igv h PRO 197 N -1.37 0.18 -0.78 4.02 0.11 -1.92 -0.24 132.00 131.99 3igv h PRO 197 Ca -0.49 -0.01 0.01 0.00 0.11 0.00 0.00 66.00 65.63 3igv h PRO 197 Cb 1.28 -0.04 -0.04 0.00 0.11 0.00 0.00 31.00 32.31 3igv h PRO 197 CO 0.57 0.12 0.51 0.78 -0.21 0.00 0.00 178.00 179.77 3igv h GLY 198 N 0.18 1.11 1.44 -0.55 0.00 -1.71 -0.87 103.07 102.67 3igv h GLY 198 Ca 0.31 -0.40 -0.13 0.00 0.00 0.00 0.00 47.33 47.11 3igv h GLY 198 CO -0.45 0.38 -0.34 1.46 0.00 0.00 0.00 176.54 177.59 3igv h GLN 199 N 1.03 0.63 -0.05 4.80 4.20 -1.68 -1.26 115.11 122.79 3igv h GLN 199 Ca 0.29 -0.29 -0.01 0.00 0.06 0.00 0.00 58.65 58.70 3igv h GLN 199 Cb -0.08 -0.01 -0.00 0.00 0.30 0.00 0.00 27.48 27.69 3igv h GLN 199 CO -0.08 0.88 -0.00 -0.09 -0.67 0.00 0.00 178.83 178.87 3igv h ARG 200 N 0.53 0.10 -0.25 1.46 2.43 -0.56 0.20 114.38 118.28 3igv h ARG 200 Ca 0.06 -0.03 0.06 0.00 -0.81 0.00 0.00 59.98 59.25 3igv h ARG 200 Cb 0.84 -0.01 -0.06 0.00 -0.42 0.00 0.00 29.97 30.32 3igv h ARG 200 CO 0.07 0.40 -0.11 0.28 -1.51 0.00 0.00 179.97 179.09 3igv h VAL 201 N -0.21 0.64 -0.49 0.20 2.07 -1.19 0.26 116.25 117.52 3igv h VAL 201 Ca 0.01 0.00 0.08 0.00 0.82 0.00 0.00 66.70 67.61 3igv h VAL 201 Cb 0.35 0.64 -0.06 0.00 -1.52 0.00 0.00 31.29 30.70 3igv h VAL 201 CO 0.00 0.00 0.14 -0.08 0.02 0.00 0.00 177.57 177.65 3igv h GLU 202 N -0.08 0.28 -0.30 1.57 4.81 -1.07 -1.14 114.58 118.65 3igv h GLU 202 Ca 0.13 -0.02 -0.16 0.00 -0.13 0.00 0.00 59.36 59.19 3igv h GLU 202 Cb 0.28 -0.06 -0.01 0.00 0.63 0.00 0.00 28.75 29.59 3igv h GLU 202 CO -0.30 0.19 -0.45 0.35 -0.73 0.00 0.00 179.01 178.07 3igv h PHE 203 N 0.29 0.93 -0.46 0.92 3.57 0.15 -1.30 116.94 121.04 3igv h PHE 203 Ca 0.24 -0.30 -0.07 0.00 3.53 0.00 0.00 57.97 61.38 3igv h PHE 203 Cb 0.29 -0.19 -0.02 0.00 2.79 0.00 0.00 35.95 38.83 3igv h PHE 203 CO -0.19 1.07 0.01 -0.07 -2.23 0.00 0.00 178.31 176.90 3igv h LEU 204 N 0.62 0.79 -0.08 0.59 3.38 -0.26 -1.83 115.31 118.51 3igv h LEU 204 Ca 0.04 -0.30 -0.03 0.00 0.09 0.00 0.00 57.88 57.68 3igv h LEU 204 Cb 1.01 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 41.55 3igv h LEU 204 CO 0.10 0.89 -0.07 0.58 0.09 0.00 0.00 178.44 180.03 3igv h VAL 205 N 0.66 1.36 -0.50 1.22 2.07 -1.17 -0.05 116.25 119.83 3igv h VAL 205 Ca 0.13 -1.19 0.07 0.00 0.82 0.00 0.00 66.70 66.53 3igv h VAL 205 Cb 0.48 1.99 -0.06 0.00 -1.52 0.00 0.00 31.29 32.18 3igv h VAL 205 CO 0.02 0.33 0.19 0.78 0.02 0.00 0.00 177.57 178.91 3igv h ASN 206 N -0.24 0.20 -0.40 0.57 2.35 -1.29 0.93 115.58 117.69 3igv h ASN 206 Ca 0.01 0.06 0.01 0.00 -0.55 0.00 0.00 56.30 55.83 3igv h ASN 206 Cb 0.56 0.04 -0.02 0.00 0.05 0.00 0.00 38.32 38.95 3igv h ASN 206 CO 0.02 0.14 0.25 0.74 -1.65 0.00 0.00 177.43 176.93 3igv h THR 207 N 0.37 1.08 -0.71 2.81 2.02 -1.25 0.47 112.91 117.70 3igv h THR 207 Ca 0.24 -0.18 0.01 0.00 0.77 0.00 0.00 66.41 67.25 3igv h THR 207 Cb 0.25 0.52 -0.04 0.00 -1.74 0.00 0.00 68.15 67.14 3igv h THR 207 CO -0.24 0.09 0.47 -0.25 0.37 0.00 0.00 175.52 175.97 3igv h TRP 208 N 0.52 0.90 0.00 3.16 2.91 -0.38 -2.65 115.95 120.40 3igv h TRP 208 Ca 0.15 0.02 -0.07 0.00 1.13 0.00 0.00 58.89 60.12 3igv h TRP 208 Cb -0.04 -0.30 -0.01 0.00 -0.51 0.00 0.00 29.16 28.30 3igv h TRP 208 CO -0.06 0.57 -0.33 0.87 -1.03 0.00 0.00 178.44 178.46 3igv h LYS 209 N 0.97 0.00 0.00 2.65 1.57 -0.17 -3.23 116.57 118.35 3igv h LYS 209 Ca 0.26 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.04 3igv h LYS 209 Cb -0.11 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.20 3igv h LYS 209 CO -0.06 0.33 0.00 -1.13 -0.57 0.00 0.00 179.45 178.02 3igv n SER 210 N -3.20 0.00 -4.42 0.86 3.41 0.10 -4.74 113.62 105.63 3igv n SER 210 Ca 0.02 -1.58 -0.33 0.00 -0.26 0.00 0.00 58.87 56.72 3igv n SER 210 Cb 0.65 0.00 -0.14 0.00 -0.26 0.00 0.00 64.21 64.46 3igv n SER 210 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 3igv s LYS 211 N -2.00 3.40 0.09 4.33 -0.14 -1.22 -5.03 119.74 119.17 3igv s LYS 211 Ca 0.15 -0.64 -0.24 0.00 -1.36 0.00 0.00 55.97 53.88 3igv s LYS 211 Cb 0.07 -2.69 -0.15 0.00 -1.68 0.00 0.00 37.83 33.38 3igv s LYS 211 CO 0.11 0.26 1.73 0.87 -0.76 0.00 0.00 175.35 177.56 3igv h LYS 212 N 6.58 -0.09 -3.23 1.68 1.57 -1.89 -3.35 116.57 117.85 3igv h LYS 212 Ca -0.29 0.01 -0.61 0.00 -1.87 0.00 0.00 60.65 57.89 3igv h LYS 212 Cb 1.20 0.02 -0.40 0.00 0.08 0.00 0.00 32.23 33.13 3igv h LYS 212 CO 0.57 -0.06 -0.73 -0.80 -0.57 0.00 0.00 179.45 177.86 3igv s ASN 213 N -5.11 3.84 0.06 0.86 0.01 -1.26 -5.07 114.94 108.26 3igv s ASN 213 Ca -0.13 -2.43 -0.31 0.00 -0.71 0.00 0.00 52.86 49.28 3igv s ASN 213 Cb 0.06 -1.08 -0.06 0.00 0.41 0.00 0.00 41.25 40.59 3igv s ASN 213 CO 0.66 -0.30 1.20 -2.16 -1.51 0.00 0.00 177.10 174.98 3igv s PRO 214 N 0.59 4.43 0.06 -0.60 0.04 -1.26 0.45 135.00 138.72 3igv s PRO 214 Ca 0.16 1.76 0.09 0.00 0.04 0.00 0.00 61.00 63.05 3igv s PRO 214 Cb -0.23 -3.36 -0.03 0.00 0.04 0.00 0.00 34.50 30.92 3igv s PRO 214 CO -0.05 -0.26 -0.25 1.41 0.04 0.00 0.00 177.00 177.89 3igv s MET 215 N 1.10 1.62 -0.00 4.56 1.75 0.51 -4.74 119.30 124.09 3igv s MET 215 Ca 0.59 -1.13 -0.05 0.00 -1.25 0.00 0.00 55.69 53.84 3igv s MET 215 Cb -0.29 -1.85 -0.00 0.00 2.84 0.00 0.00 34.83 35.53 3igv s MET 215 CO 0.29 0.47 0.10 0.20 -0.65 0.00 0.00 175.02 175.43 3igv s GLY 216 N -1.42 0.06 -0.03 2.11 0.00 -0.54 -0.94 107.32 106.55 3igv s GLY 216 Ca 0.11 -0.13 -0.19 0.00 0.00 0.00 0.00 44.72 44.52 3igv s GLY 216 CO 0.03 -0.23 0.40 -0.11 0.00 0.00 0.00 173.10 173.19 3igv s PHE 217 N -1.09 -0.31 -0.04 1.90 -0.71 -0.56 -0.27 117.98 116.90 3igv s PHE 217 Ca -0.12 0.53 -0.03 0.00 -1.04 0.00 0.00 56.93 56.27 3igv s PHE 217 Cb -0.07 0.17 -0.04 0.00 -1.21 0.00 0.00 43.02 41.88 3igv s PHE 217 CO 0.01 -0.43 0.13 -1.54 -1.34 0.00 0.00 175.22 172.05 3igv s SER 218 N -1.19 6.11 -0.35 1.98 1.04 -1.26 -0.97 113.70 119.06 3igv s SER 218 Ca -0.12 0.31 -0.02 0.00 0.48 0.00 0.00 55.95 56.60 3igv s SER 218 Cb -0.04 -1.88 0.08 0.00 0.10 0.00 0.00 66.02 64.28 3igv s SER 218 CO 0.05 0.31 0.09 -0.47 0.98 0.00 0.00 173.24 174.21 3igv s TYR 219 N -1.18 3.43 -0.47 5.02 5.04 -0.55 -4.67 117.35 123.98 3igv s TYR 219 Ca 0.22 -2.16 -0.24 0.00 -2.44 0.00 0.00 57.07 52.46 3igv s TYR 219 Cb -0.12 -2.63 0.03 0.00 0.35 0.00 0.00 41.96 39.58 3igv s TYR 219 CO 0.12 -0.88 0.83 0.34 -1.34 0.00 0.00 175.55 174.63 3igv s ASP 220 N 1.47 6.41 0.15 4.32 2.15 -1.26 -4.30 116.67 125.61 3igv s ASP 220 Ca 0.02 -0.12 -0.30 0.00 0.43 0.00 0.00 52.55 52.57 3igv s ASP 220 Cb -0.21 -2.40 -0.07 0.00 -0.30 0.00 0.00 42.92 39.94 3igv s ASP 220 CO -0.03 -0.99 1.04 -0.89 -0.17 0.00 0.00 175.17 174.14 3igv s THR 221 N 3.46 4.12 -0.39 1.71 2.01 -1.26 -0.33 115.64 124.96 3igv s THR 221 Ca 0.31 1.80 -0.29 0.00 0.31 0.00 0.00 61.69 63.82 3igv s THR 221 Cb -0.12 -4.15 0.00 0.00 0.01 0.00 0.00 72.50 68.24 3igv s THR 221 CO 0.23 0.30 1.51 -0.60 -0.69 0.00 0.00 174.62 175.36 3igv s ARG 222 N -0.22 3.52 -0.58 4.92 3.52 -0.79 -4.17 118.95 125.15 3igv s ARG 222 Ca 0.48 1.06 -0.17 0.00 -0.13 0.00 0.00 55.73 56.98 3igv s ARG 222 Cb -0.27 -4.07 0.02 0.00 -1.56 0.00 0.00 34.95 29.08 3igv s ARG 222 CO 0.33 -1.64 0.64 0.00 -0.81 0.00 0.00 175.30 173.82 3igv h PHE 224 N 1.23 0.62 -0.95 0.00 3.57 -1.97 -2.28 116.94 117.16 3igv h PHE 224 Ca -0.32 0.02 0.14 0.00 3.53 0.00 0.00 57.97 61.33 3igv h PHE 224 Cb 1.22 -0.19 -0.09 0.00 2.79 0.00 0.00 35.95 39.68 3igv h PHE 224 CO 0.12 0.33 0.57 -0.44 -2.23 0.00 0.00 178.31 176.66 3igv h ASP 225 N 0.65 0.78 -0.00 0.41 3.32 -1.90 -1.50 116.42 118.18 3igv h ASP 225 Ca 0.24 0.07 -0.10 0.00 0.02 0.00 0.00 57.03 57.26 3igv h ASP 225 Cb 0.07 -0.08 -0.01 0.00 0.22 0.00 0.00 39.33 39.53 3igv h ASP 225 CO -0.13 0.37 -0.29 0.28 -1.72 0.00 0.00 179.24 177.76 3igv h SER 226 N 0.84 0.44 1.29 6.45 0.02 -1.71 -2.31 113.55 118.58 3igv h SER 226 Ca 0.50 -0.16 -0.02 0.00 -0.84 0.00 0.00 61.79 61.27 3igv h SER 226 Cb 0.60 -0.12 -0.00 0.00 0.14 0.00 0.00 62.40 63.01 3igv h SER 226 CO -0.31 0.72 -0.09 0.71 -1.14 0.00 0.00 176.83 176.72 3igv h THR 227 N 0.38 0.19 -2.73 -2.27 1.35 -1.15 -3.44 112.91 105.24 3igv h THR 227 Ca 0.05 -0.91 -0.54 0.00 -0.55 0.00 0.00 66.41 64.46 3igv h THR 227 Cb 0.70 1.77 -0.00 0.00 -1.73 0.00 0.00 68.15 68.88 3igv h THR 227 CO 0.05 0.09 0.99 -0.69 -0.25 0.00 0.00 175.52 175.71 3igv s VAL 228 N -3.49 3.53 0.49 6.82 1.01 -1.11 -4.80 120.40 122.85 3igv s VAL 228 Ca 0.03 0.81 0.02 0.00 0.00 0.00 0.00 61.98 62.84 3igv s VAL 228 Cb 0.08 -3.52 0.02 0.00 0.00 0.00 0.00 36.38 32.96 3igv s VAL 228 CO 0.61 -0.04 0.70 0.42 0.00 0.00 0.00 175.10 176.80 3igv s THR 229 N 3.22 3.24 0.29 3.92 -4.23 -1.26 -4.05 115.64 116.77 3igv s THR 229 Ca 0.70 -0.65 0.01 0.00 -1.18 0.00 0.00 61.69 60.57 3igv s THR 229 Cb -0.34 -3.19 0.29 0.00 1.34 0.00 0.00 72.50 70.60 3igv s THR 229 CO 0.28 -0.13 1.87 -0.08 -0.54 0.00 0.00 174.62 176.03 3igv h GLU 230 N 0.28 0.98 -0.16 3.99 4.81 -1.86 -1.94 114.58 120.67 3igv h GLU 230 Ca -0.43 -0.06 0.04 0.00 -0.13 0.00 0.00 59.36 58.78 3igv h GLU 230 Cb 1.28 -0.22 -0.04 0.00 0.63 0.00 0.00 28.75 30.40 3igv h GLU 230 CO 0.53 0.65 -0.09 -0.97 -0.73 0.00 0.00 179.01 178.40 3igv h ASN 231 N 1.01 -0.29 -0.86 1.04 -1.24 -1.96 -0.90 115.58 112.38 3igv h ASN 231 Ca 0.44 0.07 0.06 0.00 0.71 0.00 0.00 56.30 57.59 3igv h ASN 231 Cb 0.36 0.16 -0.06 0.00 0.73 0.00 0.00 38.32 39.51 3igv h ASN 231 CO -0.20 -0.12 0.56 0.44 -1.29 0.00 0.00 177.43 176.82 3igv h ASP 232 N -0.08 0.84 0.10 1.15 3.32 -1.74 0.31 116.42 120.32 3igv h ASP 232 Ca 0.09 0.01 -0.19 0.00 0.02 0.00 0.00 57.03 56.96 3igv h ASP 232 Cb 0.22 -0.18 -0.00 0.00 0.22 0.00 0.00 39.33 39.59 3igv h ASP 232 CO -0.21 0.54 -0.71 0.40 -1.72 0.00 0.00 179.24 177.54 3igv h ILE 233 N 0.96 1.34 -0.45 0.35 2.04 -1.20 0.16 117.51 120.71 3igv h ILE 233 Ca 0.37 -2.03 -0.07 0.00 1.00 0.00 0.00 64.86 64.14 3igv h ILE 233 Cb 0.21 2.01 -0.02 0.00 -0.74 0.00 0.00 36.82 38.28 3igv h ILE 233 CO -0.13 0.62 0.02 0.03 0.00 0.00 0.00 178.15 178.69 3igv h ARG 234 N 0.38 0.77 -0.55 2.37 3.08 -0.28 -1.87 114.38 118.29 3igv h ARG 234 Ca -0.03 -0.23 -0.03 0.00 0.07 0.00 0.00 59.98 59.76 3igv h ARG 234 Cb 1.29 -0.08 -0.02 0.00 0.08 0.00 0.00 29.97 31.24 3igv h ARG 234 CO 0.13 0.82 0.23 0.28 -1.07 0.00 0.00 179.97 180.36 3igv h VAL 235 N 0.62 1.22 0.00 2.04 2.07 -0.33 -0.98 116.25 120.89 3igv h VAL 235 Ca 0.13 -0.67 -0.08 0.00 0.82 0.00 0.00 66.70 66.91 3igv h VAL 235 Cb 0.46 0.63 -0.01 0.00 -1.52 0.00 0.00 31.29 30.85 3igv h VAL 235 CO 0.02 0.26 -0.36 1.05 0.02 0.00 0.00 177.57 178.56 3igv h GLU 236 N 0.74 0.00 -0.27 1.57 4.11 -0.92 -2.36 114.58 117.45 3igv h GLU 236 Ca 0.18 0.00 -0.18 0.00 0.07 0.00 0.00 59.36 59.43 3igv h GLU 236 Cb 0.19 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.43 3igv h GLU 236 CO -0.02 0.36 -0.56 1.49 0.07 0.00 0.00 179.01 180.36 3igv h GLU 237 N 0.00 0.82 0.00 1.06 4.81 -0.90 -2.60 114.58 117.77 3igv h GLU 237 Ca -0.00 -0.52 -0.02 0.00 -0.13 0.00 0.00 59.36 58.68 3igv h GLU 237 Cb 0.66 0.06 -0.00 0.00 0.63 0.00 0.00 28.75 30.10 3igv h GLU 237 CO 0.05 1.16 -0.09 0.66 -0.73 0.00 0.00 179.01 180.05 3igv h SER 238 N 0.63 0.00 -0.11 1.04 4.64 -0.83 -0.83 113.55 118.08 3igv h SER 238 Ca 0.01 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.29 3igv h SER 238 Cb 1.16 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.24 3igv h SER 238 CO 0.12 0.09 -0.07 0.40 -0.87 0.00 0.00 176.83 176.50 3igv h ILE 239 N 0.00 1.33 -0.64 0.95 2.04 -1.28 -3.10 117.51 116.81 3igv h ILE 239 Ca -0.00 -1.15 0.07 0.00 1.00 0.00 0.00 64.86 64.79 3igv h ILE 239 Cb 0.18 1.85 -0.06 0.00 -0.74 0.00 0.00 36.82 38.05 3igv h ILE 239 CO 0.01 0.33 0.32 1.88 0.00 0.00 0.00 178.15 180.69 3igv h TYR 240 N -0.12 0.57 0.00 1.37 0.05 -0.99 -2.46 116.97 115.39 3igv h TYR 240 Ca 0.02 0.03 0.00 0.00 0.05 0.00 0.00 58.73 58.83 3igv h TYR 240 Cb 0.55 -0.16 0.00 0.00 1.01 0.00 0.00 36.73 38.13 3igv h TYR 240 CO 0.07 0.23 0.00 1.96 -1.05 0.00 0.00 178.16 179.38 3igv h GLN 241 N 0.57 0.00 0.00 4.88 1.08 -1.16 -1.72 115.11 118.76 3igv h GLN 241 Ca 0.30 0.00 -0.04 0.00 -1.45 0.00 0.00 58.65 57.47 3igv h GLN 241 Cb 0.27 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.70 3igv h GLN 241 CO -0.23 0.00 -0.18 0.00 -0.95 0.00 0.00 178.83 177.47 3igv s ASP 244 N -1.95 6.34 0.02 0.00 -1.08 0.60 -4.97 116.67 115.64 3igv s ASP 244 Ca 0.74 1.55 0.01 0.00 -0.52 0.00 0.00 52.55 54.33 3igv s ASP 244 Cb -0.28 -2.53 -0.02 0.00 -1.46 0.00 0.00 42.92 38.63 3igv s ASP 244 CO 0.39 -1.30 -0.05 -0.76 0.52 0.00 0.00 175.17 173.97 3igv s LEU 245 N 5.33 2.17 0.37 -1.34 1.43 -1.26 -1.84 118.68 123.54 3igv s LEU 245 Ca 0.71 -0.38 -0.27 0.00 -1.03 0.00 0.00 54.13 53.16 3igv s LEU 245 Cb -0.24 -0.08 -0.11 0.00 0.03 0.00 0.00 46.19 45.79 3igv s LEU 245 CO 0.29 -0.16 1.37 0.00 0.23 0.00 0.00 176.35 178.08 3igv n ALA 246 N 2.00 1.74 0.23 4.21 0.00 -1.26 -4.82 120.51 122.61 3igv n ALA 246 Ca -0.20 0.33 0.18 0.00 0.00 0.00 0.00 53.44 53.75 3igv n ALA 246 Cb 0.56 -2.33 0.85 0.00 0.00 0.00 0.00 19.45 18.54 3igv n ALA 246 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 3igv h PRO 247 N 2.60 0.00 -0.02 0.00 0.11 -2.00 0.92 132.00 133.61 3igv h PRO 247 Ca -0.48 0.00 -0.23 0.00 0.11 0.00 0.00 66.00 65.39 3igv h PRO 247 Cb 1.27 0.00 0.01 0.00 0.11 0.00 0.00 31.00 32.39 3igv h PRO 247 CO 0.63 0.00 -0.94 0.93 -0.21 0.00 0.00 178.00 178.40 3igv h GLU 248 N 0.00 0.51 -0.55 1.05 5.08 -2.00 -2.99 114.58 115.69 3igv h GLU 248 Ca 0.08 -0.53 -0.06 0.00 -1.00 0.00 0.00 59.36 57.85 3igv h GLU 248 Cb 0.63 0.14 -0.02 0.00 0.50 0.00 0.00 28.75 30.00 3igv h GLU 248 CO -0.00 1.16 0.12 0.00 -1.00 0.00 0.00 179.01 179.29 3igv h ALA 249 N 0.66 0.72 -0.83 3.43 0.00 -1.19 -1.96 119.26 120.08 3igv h ALA 249 Ca -0.09 -0.23 0.02 0.00 0.00 0.00 0.00 54.91 54.62 3igv h ALA 249 Cb 1.58 -0.21 -0.05 0.00 0.00 0.00 0.00 17.79 19.11 3igv h ALA 249 CO 0.17 0.43 0.54 0.00 0.00 0.00 0.00 179.25 180.40 3igv h ARG 250 N 0.78 1.05 0.04 0.00 3.08 -1.45 -0.36 114.38 117.52 3igv h ARG 250 Ca 0.17 -0.06 -0.00 0.00 0.07 0.00 0.00 59.98 60.15 3igv h ARG 250 Cb 0.36 -0.24 0.00 0.00 0.08 0.00 0.00 29.97 30.17 3igv h ARG 250 CO 0.00 0.70 -0.02 0.37 -1.07 0.00 0.00 179.97 179.95 3igv h GLN 251 N 1.08 -0.06 -0.58 0.04 5.75 -1.43 -2.48 115.11 117.43 3igv h GLN 251 Ca 0.32 0.00 0.01 0.00 -0.15 0.00 0.00 58.65 58.84 3igv h GLN 251 Cb -0.06 0.01 -0.03 0.00 1.07 0.00 0.00 27.48 28.47 3igv h GLN 251 CO -0.09 0.29 0.38 0.00 -2.65 0.00 0.00 178.83 176.76 3igv h ALA 252 N 0.52 0.74 0.05 3.38 0.00 -1.18 -0.67 119.26 122.10 3igv h ALA 252 Ca -0.01 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.87 3igv h ALA 252 Cb 0.38 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 17.95 3igv h ALA 252 CO 0.01 0.14 -0.03 0.82 0.00 0.00 0.00 179.25 180.20 3igv h ILE 253 N 0.76 0.98 -0.39 0.00 2.04 -1.09 0.12 117.51 119.94 3igv h ILE 253 Ca 0.22 -0.11 0.06 0.00 1.00 0.00 0.00 64.86 66.03 3igv h ILE 253 Cb -0.05 1.05 -0.05 0.00 -0.74 0.00 0.00 36.82 37.03 3igv h ILE 253 CO -0.06 0.03 0.09 0.50 0.00 0.00 0.00 178.15 178.70 3igv h LYS 254 N -0.12 0.21 -0.25 2.37 3.64 -1.23 -0.51 116.57 120.67 3igv h LYS 254 Ca -0.01 -0.01 0.01 0.00 -1.27 0.00 0.00 60.65 59.37 3igv h LYS 254 Cb 0.10 -0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 31.86 3igv h LYS 254 CO 0.01 0.14 0.14 1.03 -2.27 0.00 0.00 179.45 178.50 3igv h SER 255 N 0.22 0.23 -0.21 4.20 0.87 -0.85 -1.43 113.55 116.58 3igv h SER 255 Ca 0.18 0.00 -0.07 0.00 -1.23 0.00 0.00 61.79 60.68 3igv h SER 255 Cb 0.21 -0.04 -0.02 0.00 -0.44 0.00 0.00 62.40 62.11 3igv h SER 255 CO -0.23 0.17 -0.07 -0.07 -0.53 0.00 0.00 176.83 176.09 3igv h LEU 256 N 0.30 0.54 -0.13 2.23 3.38 -0.42 0.12 115.31 121.33 3igv h LEU 256 Ca 0.10 -0.13 -0.01 0.00 0.09 0.00 0.00 57.88 57.93 3igv h LEU 256 Cb 0.00 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.60 3igv h LEU 256 CO -0.05 0.66 0.05 0.74 0.09 0.00 0.00 178.44 179.93 3igv h THR 257 N 0.52 1.15 -0.08 0.22 2.02 -0.78 0.30 112.91 116.27 3igv h THR 257 Ca 0.10 -0.45 -0.19 0.00 0.77 0.00 0.00 66.41 66.64 3igv h THR 257 Cb 0.45 1.20 -0.00 0.00 -1.74 0.00 0.00 68.15 68.06 3igv h THR 257 CO 0.02 0.14 -0.76 -0.33 0.37 0.00 0.00 175.52 174.96 3igv h GLU 258 N 0.06 0.44 0.00 6.66 4.39 -1.01 -0.54 114.58 124.58 3igv h GLU 258 Ca 0.04 -0.37 -0.09 0.00 0.34 0.00 0.00 59.36 59.28 3igv h GLU 258 Cb 0.17 0.08 -0.02 0.00 -0.10 0.00 0.00 28.75 28.89 3igv h GLU 258 CO -0.00 1.01 -1.83 0.54 -1.16 0.00 0.00 179.01 177.57 3igv n ARG 259 N -3.83 0.65 0.07 2.33 1.74 0.41 -4.67 116.66 113.35 3igv n ARG 259 Ca -0.05 -0.06 0.00 0.00 -0.77 0.00 0.00 57.85 56.97 3igv n ARG 259 Cb 0.73 -1.61 0.00 0.00 -1.02 0.00 0.00 32.46 30.56 3igv n ARG 259 CO 0.00 0.00 0.00 -0.11 -1.52 0.00 0.00 177.63 176.00 3igv n LEU 260 N -2.50 0.66 -0.03 0.55 7.94 0.80 -0.59 117.00 123.84 3igv n LEU 260 Ca -0.09 0.22 -0.06 0.00 -1.11 0.00 0.00 56.01 54.97 3igv n LEU 260 Cb 0.70 -0.11 0.14 0.00 0.53 0.00 0.00 43.42 44.68 3igv n LEU 260 CO 0.44 -0.70 0.69 1.88 -1.11 0.00 0.00 177.39 178.59 3igv h TYR 261 N 0.00 0.70 -0.15 1.96 0.05 -0.80 -2.99 116.97 115.74 3igv h TYR 261 Ca 0.00 -0.16 -0.13 0.00 0.05 0.00 0.00 58.73 58.48 3igv h TYR 261 Cb 0.08 -0.17 -0.01 0.00 1.01 0.00 0.00 36.73 37.65 3igv h TYR 261 CO 0.00 0.82 -0.47 0.82 -1.05 0.00 0.00 178.16 178.28 3igv h ILE 262 N 0.53 1.33 0.00 -2.88 2.04 -1.33 -3.42 117.51 113.78 3igv h ILE 262 Ca 0.07 -1.68 0.00 0.00 1.00 0.00 0.00 64.86 64.25 3igv h ILE 262 Cb 0.75 1.73 0.00 0.00 -0.74 0.00 0.00 36.82 38.55 3igv h ILE 262 CO 0.06 0.51 0.00 0.61 0.00 0.00 0.00 178.15 179.33 3igv n GLY 263 N 0.04 -2.21 0.00 5.37 0.00 -1.13 -4.13 105.19 103.13 3igv n GLY 263 Ca -0.02 -1.23 0.00 0.00 0.00 0.00 0.00 46.02 44.77 3igv n GLY 263 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3igv n GLY 264 N -0.56 1.56 3.77 -0.02 0.00 -0.79 -4.14 105.19 105.02 3igv n GLY 264 Ca 0.00 -1.14 -0.34 0.00 0.00 0.00 0.00 46.02 44.54 3igv n GLY 264 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3igv s PRO 265 N -2.00 3.03 -0.15 1.61 0.04 -1.26 -0.77 135.00 135.50 3igv s PRO 265 Ca 0.00 1.45 0.00 0.00 0.04 0.00 0.00 61.00 62.49 3igv s PRO 265 Cb 0.00 -1.98 -0.00 0.00 0.04 0.00 0.00 34.50 32.56 3igv s PRO 265 CO 0.00 -1.08 -0.15 -0.51 0.04 0.00 0.00 177.00 175.30 3igv s LEU 266 N -4.48 2.48 -0.14 -3.56 1.43 0.14 -3.25 118.68 111.31 3igv s LEU 266 Ca 0.69 -0.46 0.02 0.00 -1.03 0.00 0.00 54.13 53.35 3igv s LEU 266 Cb -0.21 -1.56 0.01 0.00 0.03 0.00 0.00 46.19 44.46 3igv s LEU 266 CO 0.36 0.09 -0.21 -0.89 0.23 0.00 0.00 176.35 175.93 3igv s THR 267 N 0.76 2.00 0.96 5.49 2.01 -0.08 0.24 115.64 127.02 3igv s THR 267 Ca -0.06 -0.94 -0.12 0.00 0.31 0.00 0.00 61.69 60.88 3igv s THR 267 Cb -0.15 -1.77 0.17 0.00 0.01 0.00 0.00 72.50 70.75 3igv s THR 267 CO 0.01 0.54 1.09 0.54 -0.69 0.00 0.00 174.62 176.10 3igv s ASN 268 N 0.85 2.91 0.64 3.53 2.20 -0.23 -1.54 114.94 123.30 3igv s ASN 268 Ca -0.07 1.40 0.41 0.00 -0.94 0.00 0.00 52.86 53.66 3igv s ASN 268 Cb -0.15 -2.07 2.23 0.00 -2.00 0.00 0.00 41.25 39.25 3igv s ASN 268 CO -0.02 -2.98 2.32 0.77 -2.94 0.00 0.00 177.10 174.25 3igv h SER 269 N -1.78 0.00 1.61 3.54 4.64 -1.76 -1.21 113.55 118.58 3igv h SER 269 Ca -0.52 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 60.75 3igv h SER 269 Cb 1.30 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.39 3igv h SER 269 CO 0.55 0.01 -0.40 0.11 -0.87 0.00 0.00 176.83 176.23 3igv h LYS 270 N 0.00 0.00 0.00 4.77 1.57 -1.89 -3.48 116.57 117.54 3igv h LYS 270 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3igv h LYS 270 Cb 0.05 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.36 3igv h LYS 270 CO 0.00 0.18 0.00 0.41 -0.57 0.00 0.00 179.45 179.47 3igv n GLY 271 N 1.17 1.01 3.85 3.86 0.00 -0.46 -5.12 105.19 109.51 3igv n GLY 271 Ca 0.02 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.71 3igv n GLY 271 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3igv s GLN 272 N -0.33 3.98 -0.19 1.61 -0.21 -1.26 -4.85 119.66 118.42 3igv s GLN 272 Ca 0.00 0.60 -0.27 0.00 0.02 0.00 0.00 55.36 55.71 3igv s GLN 272 Cb 0.00 -2.54 -0.00 0.00 1.00 0.00 0.00 33.01 31.47 3igv s GLN 272 CO 0.00 0.22 0.95 1.21 -2.12 0.00 0.00 175.29 175.55 3igv s ASN 273 N -2.21 7.05 0.12 5.90 3.04 -1.26 -1.07 114.94 126.51 3igv s ASN 273 Ca 0.51 1.30 0.19 0.00 0.04 0.00 0.00 52.86 54.91 3igv s ASN 273 Cb -0.11 -2.50 -0.08 0.00 -1.54 0.00 0.00 41.25 37.01 3igv s ASN 273 CO 0.19 -0.53 0.91 0.00 -3.04 0.00 0.00 177.10 174.62 3igv n GLY 275 N 1.30 0.42 3.14 0.00 0.00 -1.22 0.18 105.19 109.01 3igv n GLY 275 Ca -0.05 -1.43 -0.21 0.00 0.00 0.00 0.00 46.02 44.32 3igv n GLY 275 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 3igv s TYR 276 N -3.72 1.25 -0.12 1.61 5.04 -0.19 0.25 117.35 121.47 3igv s TYR 276 Ca 0.00 -0.32 -0.01 0.00 -2.44 0.00 0.00 57.07 54.30 3igv s TYR 276 Cb 0.00 -0.76 -0.03 0.00 0.35 0.00 0.00 41.96 41.52 3igv s TYR 276 CO 0.00 0.02 -0.07 0.50 -1.34 0.00 0.00 175.55 174.66 3igv s ARG 277 N -0.91 3.26 -0.13 4.97 3.52 0.05 -1.59 118.95 128.13 3igv s ARG 277 Ca 0.03 -0.57 0.15 0.00 -0.13 0.00 0.00 55.73 55.21 3igv s ARG 277 Cb -0.07 -2.73 0.34 0.00 -1.56 0.00 0.00 34.95 30.94 3igv s ARG 277 CO 0.01 0.39 1.17 0.54 -0.81 0.00 0.00 175.30 176.60 3igv n ARG 278 N 3.04 1.03 -1.89 5.12 1.74 -0.37 -1.88 116.66 123.45 3igv n ARG 278 Ca -0.18 -2.63 0.00 0.00 -0.77 0.00 0.00 57.85 54.28 3igv n ARG 278 Cb 0.53 -1.16 0.00 0.00 -1.02 0.00 0.00 32.46 30.81 3igv n ARG 278 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3igv s ARG 280 N -1.83 4.17 0.19 0.00 6.06 -0.88 -4.65 118.95 122.00 3igv s ARG 280 Ca 0.00 2.44 -0.30 0.00 -2.50 0.00 0.00 55.73 55.37 3igv s ARG 280 Cb 0.00 -3.82 -0.08 0.00 0.06 0.00 0.00 34.95 31.11 3igv s ARG 280 CO 0.00 -0.84 1.14 0.00 -2.50 0.00 0.00 175.30 173.11 3igv s ALA 281 N 3.41 3.40 -0.93 6.12 0.00 -1.26 -4.76 121.76 127.73 3igv s ALA 281 Ca 0.79 0.88 0.26 0.00 0.00 0.00 0.00 51.96 53.89 3igv s ALA 281 Cb -0.41 -3.38 0.67 0.00 0.00 0.00 0.00 23.12 20.00 3igv s ALA 281 CO 0.35 -0.28 1.54 -1.13 0.00 0.00 0.00 175.76 176.24 3igv n SER 282 N 2.38 0.42 -2.25 0.00 3.41 -1.24 -4.18 113.62 112.16 3igv n SER 282 Ca 0.03 0.02 -0.25 0.00 -0.26 0.00 0.00 58.87 58.41 3igv n SER 282 Cb 0.45 0.02 0.01 0.00 -0.26 0.00 0.00 64.21 64.43 3igv n SER 282 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3igv n GLY 283 N 1.47 6.19 3.44 5.00 0.00 0.16 -4.34 105.19 117.10 3igv n GLY 283 Ca 0.06 -2.71 -0.23 0.00 0.00 0.00 0.00 46.02 43.13 3igv n GLY 283 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3igv s VAL 284 N -5.06 2.31 0.36 1.61 -7.23 -1.18 -4.37 120.40 106.84 3igv s VAL 284 Ca 0.49 -2.35 0.06 0.00 -1.81 0.00 0.00 61.98 58.38 3igv s VAL 284 Cb 0.40 -2.23 0.30 0.00 0.56 0.00 0.00 36.38 35.41 3igv s VAL 284 CO -0.07 -0.43 1.94 0.25 -0.31 0.00 0.00 175.10 176.48 3igv h LEU 285 N 2.38 0.67 -0.91 1.32 5.85 -1.80 -2.18 115.31 120.65 3igv h LEU 285 Ca -0.40 0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.33 3igv h LEU 285 Cb 1.25 -0.13 0.00 0.00 0.37 0.00 0.00 40.66 42.15 3igv h LEU 285 CO 0.60 0.42 0.00 0.35 -0.34 0.00 0.00 178.44 179.47 3igv n THR 286 N -4.49 0.24 0.06 1.05 -2.24 -1.26 -4.32 114.28 103.32 3igv n THR 286 Ca 0.12 -0.30 -0.11 0.00 -2.27 0.00 0.00 64.05 61.49 3igv n THR 286 Cb 0.28 0.20 -0.04 0.00 -2.10 0.00 0.00 70.33 68.66 3igv n THR 286 CO 0.00 0.00 0.00 0.74 -0.57 0.00 0.00 175.07 175.24 3igv h THR 287 N 1.65 0.47 0.26 4.28 2.02 -1.66 0.18 112.91 120.12 3igv h THR 287 Ca 0.00 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.17 3igv h THR 287 Cb 0.37 0.47 0.00 0.00 -1.74 0.00 0.00 68.15 67.25 3igv h THR 287 CO 0.00 0.00 -0.12 -1.28 0.37 0.00 0.00 175.52 174.49 3igv h SER 288 N -0.35 -0.29 -0.59 4.18 0.87 -1.75 -2.01 113.55 113.60 3igv h SER 288 Ca 0.06 -0.18 -0.10 0.00 -1.23 0.00 0.00 61.79 60.35 3igv h SER 288 Cb 0.44 0.08 -0.02 0.00 -0.44 0.00 0.00 62.40 62.45 3igv h SER 288 CO -0.21 0.03 -0.00 0.00 -0.53 0.00 0.00 176.83 176.12 3igv h GLY 290 N 0.94 0.51 0.98 0.00 0.00 -0.68 0.17 103.07 104.98 3igv h GLY 290 Ca 0.17 -0.25 -0.05 0.00 0.00 0.00 0.00 47.33 47.20 3igv h GLY 290 CO 0.03 0.24 0.13 3.43 0.00 0.00 0.00 176.54 180.37 3igv h ASN 291 N 0.39 0.76 -0.11 0.19 2.35 -1.28 -1.02 115.58 116.86 3igv h ASN 291 Ca 0.11 -0.23 0.00 0.00 -0.55 0.00 0.00 56.30 55.63 3igv h ASN 291 Cb 0.12 -0.20 -0.01 0.00 0.05 0.00 0.00 38.32 38.28 3igv h ASN 291 CO -0.01 0.79 0.07 0.74 -1.65 0.00 0.00 177.43 177.37 3igv h THR 292 N 0.69 1.02 -0.79 2.81 2.02 -1.01 0.23 112.91 117.87 3igv h THR 292 Ca 0.16 -0.05 -0.04 0.00 0.77 0.00 0.00 66.41 67.25 3igv h THR 292 Cb 0.33 0.87 -0.04 0.00 -1.74 0.00 0.00 68.15 67.57 3igv h THR 292 CO 0.00 0.03 0.35 -0.07 0.37 0.00 0.00 175.52 176.20 3igv h LEU 293 N 0.14 1.06 -0.14 2.58 3.38 -0.91 -0.66 115.31 120.77 3igv h LEU 293 Ca 0.04 -0.15 -0.23 0.00 0.09 0.00 0.00 57.88 57.63 3igv h LEU 293 Cb -0.01 -0.27 0.01 0.00 0.09 0.00 0.00 40.66 40.48 3igv h LEU 293 CO -0.01 0.92 -0.85 0.74 0.09 0.00 0.00 178.44 179.33 3igv h THR 294 N 1.13 1.28 -0.25 0.22 2.02 -0.95 -0.53 112.91 115.83 3igv h THR 294 Ca 0.27 -2.06 -0.02 0.00 0.77 0.00 0.00 66.41 65.37 3igv h THR 294 Cb 0.16 2.09 -0.01 0.00 -1.74 0.00 0.00 68.15 68.65 3igv h THR 294 CO -0.03 0.65 0.07 0.00 0.37 0.00 0.00 175.52 176.57 3igv h TYR 296 N 0.23 0.48 -0.09 0.00 3.20 -1.08 -0.81 116.97 118.90 3igv h TYR 296 Ca 0.08 -0.02 0.02 0.00 3.14 0.00 0.00 58.73 61.95 3igv h TYR 296 Cb 0.27 -0.15 -0.03 0.00 1.54 0.00 0.00 36.73 38.36 3igv h TYR 296 CO 0.01 0.40 -0.06 1.25 -1.64 0.00 0.00 178.16 178.12 3igv h LEU 297 N 0.41 -0.20 -0.06 2.82 5.85 -1.06 -1.15 115.31 121.92 3igv h LEU 297 Ca 0.12 0.04 -0.01 0.00 0.84 0.00 0.00 57.88 58.87 3igv h LEU 297 Cb 0.10 0.10 -0.00 0.00 0.37 0.00 0.00 40.66 41.23 3igv h LEU 297 CO -0.02 -0.09 0.01 0.11 -0.34 0.00 0.00 178.44 178.11 3igv h LYS 298 N -0.07 0.11 -0.04 1.25 1.57 -1.15 -2.72 116.57 115.51 3igv h LYS 298 Ca 0.06 -0.03 -0.00 0.00 -1.87 0.00 0.00 60.65 58.81 3igv h LYS 298 Cb 0.15 -0.01 -0.00 0.00 0.08 0.00 0.00 32.23 32.45 3igv h LYS 298 CO -0.13 0.35 0.02 0.00 -0.57 0.00 0.00 179.45 179.12 3igv h ALA 299 N 0.75 0.06 -0.55 3.86 0.00 -1.15 -0.30 119.26 121.93 3igv h ALA 299 Ca 0.02 -0.06 0.09 0.00 0.00 0.00 0.00 54.91 54.96 3igv h ALA 299 Cb 0.30 -0.02 -0.07 0.00 0.00 0.00 0.00 17.79 18.00 3igv h ALA 299 CO 0.00 -0.39 0.15 0.77 0.00 0.00 0.00 179.25 179.79 3igv h SER 300 N -0.05 0.09 -0.36 0.00 0.02 -1.23 0.25 113.55 112.27 3igv h SER 300 Ca 0.01 0.09 -0.05 0.00 -0.84 0.00 0.00 61.79 61.00 3igv h SER 300 Cb 0.12 0.10 -0.02 0.00 0.14 0.00 0.00 62.40 62.74 3igv h SER 300 CO -0.00 0.07 0.07 0.00 -1.14 0.00 0.00 176.83 175.82 3igv h ALA 301 N 1.41 1.30 0.00 3.77 0.00 -1.36 -2.60 119.26 121.77 3igv h ALA 301 Ca 0.28 -0.20 -0.06 0.00 0.00 0.00 0.00 54.91 54.92 3igv h ALA 301 Cb 0.36 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 3igv h ALA 301 CO -0.32 0.48 -0.31 0.00 0.00 0.00 0.00 179.25 179.10 3igv h ALA 302 N 1.43 0.91 -0.27 0.00 0.00 0.76 -2.09 119.26 120.01 3igv h ALA 302 Ca 0.14 -0.28 -0.16 0.00 0.00 0.00 0.00 54.91 54.61 3igv h ALA 302 Cb 0.30 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 3igv h ALA 302 CO 0.00 0.39 -0.47 0.00 0.00 0.00 0.00 179.25 179.17 3igv h ARG 304 N 0.57 0.99 -0.37 0.00 3.08 -1.26 -0.10 114.38 117.29 3igv h ARG 304 Ca 0.03 -0.42 -0.13 0.00 0.07 0.00 0.00 59.98 59.54 3igv h ARG 304 Cb 1.03 -0.04 -0.01 0.00 0.08 0.00 0.00 29.97 31.03 3igv h ARG 304 CO 0.10 1.09 -0.28 0.00 -1.07 0.00 0.00 179.97 179.80 3igv h ALA 305 N 0.90 0.81 -0.01 0.04 0.00 -1.37 -3.00 119.26 116.63 3igv h ALA 305 Ca 0.11 -0.40 0.00 0.00 0.00 0.00 0.00 54.91 54.62 3igv h ALA 305 Cb 0.78 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.43 3igv h ALA 305 CO 0.06 0.64 -0.15 0.00 0.00 0.00 0.00 179.25 179.81 3igv n ALA 306 N -2.51 2.86 -3.74 0.00 0.00 -0.61 -4.95 120.51 111.57 3igv n ALA 306 Ca -0.01 -0.37 -0.25 0.00 0.00 0.00 0.00 53.44 52.82 3igv n ALA 306 Cb 0.47 -1.20 0.04 0.00 0.00 0.00 0.00 19.45 18.76 3igv n ALA 306 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 3igv n LYS 307 N -0.54 -5.80 -2.17 0.00 5.02 -0.14 -4.87 118.16 109.66 3igv n LYS 307 Ca 0.15 0.67 -0.42 0.00 -2.02 0.00 0.00 58.31 56.68 3igv n LYS 307 Cb 0.32 -5.48 -0.03 0.00 -0.02 0.00 0.00 35.03 29.83 3igv n LYS 307 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 3igv s LEU 308 N -6.97 4.34 -0.23 -0.35 1.02 -0.68 -4.97 118.68 110.85 3igv s LEU 308 Ca 0.34 2.23 -0.29 0.00 0.02 0.00 0.00 54.13 56.43 3igv s LEU 308 Cb -0.16 -3.57 0.00 0.00 0.02 0.00 0.00 46.19 42.48 3igv s LEU 308 CO 0.80 -0.72 1.11 -1.10 0.02 0.00 0.00 176.35 176.46 3igv s GLN 309 N 2.00 4.22 -0.96 1.70 -1.52 -1.26 -4.23 119.66 119.61 3igv s GLN 309 Ca 0.65 1.40 -0.11 0.00 -1.95 0.00 0.00 55.36 55.35 3igv s GLN 309 Cb -0.34 -3.69 0.00 0.00 -0.22 0.00 0.00 33.01 28.76 3igv s GLN 309 CO 0.28 -0.70 0.70 -3.47 -0.25 0.00 0.00 175.29 171.85 3igv n ASP 310 N 6.50 -5.53 -4.73 5.90 2.03 -1.26 -0.96 116.55 118.51 3igv n ASP 310 Ca 0.13 -0.84 -0.37 0.00 0.52 0.00 0.00 54.79 54.22 3igv n ASP 310 Cb 0.46 -2.97 -0.06 0.00 -0.72 0.00 0.00 41.12 37.82 3igv n ASP 310 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3igv s THR 312 N 0.53 4.44 -0.04 0.00 2.01 0.12 -4.96 115.64 117.75 3igv s THR 312 Ca 0.22 -0.15 -0.01 0.00 0.31 0.00 0.00 61.69 62.05 3igv s THR 312 Cb -0.14 -3.00 -0.04 0.00 0.01 0.00 0.00 72.50 69.34 3igv s THR 312 CO 0.07 0.46 0.04 -0.04 -0.69 0.00 0.00 174.62 174.46 3igv s MET 313 N 0.53 3.00 -0.15 4.92 -1.94 -1.26 -1.26 119.30 123.12 3igv s MET 313 Ca 0.01 -0.46 -0.00 0.00 -1.71 0.00 0.00 55.69 53.53 3igv s MET 313 Cb -0.13 -2.82 0.03 0.00 2.01 0.00 0.00 34.83 33.92 3igv s MET 313 CO 0.02 0.67 -0.08 -1.17 -0.01 0.00 0.00 175.02 174.45 3igv s LEU 314 N -1.34 1.61 -0.07 -0.03 2.96 -0.15 -4.22 118.68 117.45 3igv s LEU 314 Ca 0.18 -0.57 0.05 0.00 -0.22 0.00 0.00 54.13 53.56 3igv s LEU 314 Cb -0.12 -0.98 -0.00 0.00 0.50 0.00 0.00 46.19 45.59 3igv s LEU 314 CO 0.08 -0.14 -0.22 -0.69 -1.32 0.00 0.00 176.35 174.06 3igv s VAL 315 N 1.60 1.85 -0.36 1.68 1.01 0.01 -1.45 120.40 124.73 3igv s VAL 315 Ca 0.02 -0.93 -0.00 0.00 0.00 0.00 0.00 61.98 61.07 3igv s VAL 315 Cb -0.14 -1.58 0.12 0.00 0.00 0.00 0.00 36.38 34.77 3igv s VAL 315 CO -0.08 0.52 0.17 0.20 0.00 0.00 0.00 175.10 175.90 3igv s ASN 316 N 0.10 3.64 1.99 3.32 -0.87 0.34 -1.03 114.94 122.43 3igv s ASN 316 Ca -0.09 -2.03 0.00 0.00 -1.57 0.00 0.00 52.86 49.17 3igv s ASN 316 Cb -0.15 -0.77 0.00 0.00 -0.02 0.00 0.00 41.25 40.31 3igv s ASN 316 CO 0.05 -0.35 0.00 0.61 -2.57 0.00 0.00 177.10 174.84 3igv n GLY 317 N 4.31 4.36 0.42 0.66 0.00 -1.26 -0.97 105.19 112.70 3igv n GLY 317 Ca 0.04 0.14 0.14 0.00 0.00 0.00 0.00 46.02 46.34 3igv n GLY 317 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3igv n ASP 318 N 8.72 1.31 -4.66 1.61 5.75 -1.26 -3.42 116.55 124.59 3igv n ASP 318 Ca 0.00 -1.43 -0.40 0.00 -0.01 0.00 0.00 54.79 52.95 3igv n ASP 318 Cb 0.00 0.00 -0.06 0.00 -1.03 0.00 0.00 41.12 40.03 3igv n ASP 318 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 3igv s ASP 319 N -2.00 6.67 -0.04 -1.12 -1.08 -0.15 -4.70 116.67 114.24 3igv s ASP 319 Ca 0.39 0.81 0.01 0.00 -0.52 0.00 0.00 52.55 53.24 3igv s ASP 319 Cb 0.21 -2.34 0.02 0.00 -1.46 0.00 0.00 42.92 39.35 3igv s ASP 319 CO 0.34 -0.26 -0.05 -0.22 0.52 0.00 0.00 175.17 175.50 3igv s LEU 320 N 1.89 1.37 -0.03 -1.34 2.96 -1.26 -0.51 118.68 121.76 3igv s LEU 320 Ca 0.28 -0.13 0.02 0.00 -0.22 0.00 0.00 54.13 54.08 3igv s LEU 320 Cb -0.16 -0.44 0.01 0.00 0.50 0.00 0.00 46.19 46.10 3igv s LEU 320 CO 0.10 -0.05 -0.08 0.54 -1.32 0.00 0.00 176.35 175.54 3igv s VAL 321 N 0.85 0.74 -0.07 1.68 0.11 -0.53 -1.48 120.40 121.70 3igv s VAL 321 Ca -0.11 -0.32 0.05 0.00 -2.93 0.00 0.00 61.98 58.67 3igv s VAL 321 Cb -0.14 -0.67 -0.01 0.00 -1.53 0.00 0.00 36.38 34.03 3igv s VAL 321 CO 0.00 0.24 -0.24 -0.69 -3.33 0.00 0.00 175.10 171.08 3igv s VAL 322 N 0.31 2.15 -0.09 2.04 1.01 -0.14 -0.98 120.40 124.71 3igv s VAL 322 Ca -0.05 -1.02 0.02 0.00 0.00 0.00 0.00 61.98 60.93 3igv s VAL 322 Cb -0.09 -1.80 0.01 0.00 0.00 0.00 0.00 36.38 34.50 3igv s VAL 322 CO 0.01 0.57 -0.15 -0.63 0.00 0.00 0.00 175.10 174.89 3igv s ILE 323 N -0.04 1.41 0.36 2.22 1.01 -0.39 -1.49 121.20 124.27 3igv s ILE 323 Ca -0.07 -0.62 -0.04 0.00 0.00 0.00 0.00 60.65 59.92 3igv s ILE 323 Cb -0.15 -1.28 0.02 0.00 0.01 0.00 0.00 42.46 41.06 3igv s ILE 323 CO 0.05 0.42 0.54 0.00 0.00 0.00 0.00 174.94 175.95 3igv s GLU 325 N -2.66 4.51 0.35 0.00 0.41 -0.13 -0.37 118.70 120.81 3igv s GLU 325 Ca 0.26 1.70 -0.26 0.00 -0.41 0.00 0.00 54.97 56.26 3igv s GLU 325 Cb -0.02 -3.34 -0.09 0.00 -1.78 0.00 0.00 34.13 28.90 3igv s GLU 325 CO 0.19 -0.10 1.01 0.45 -0.49 0.00 0.00 175.26 176.32 3igv s SER 326 N 0.62 7.08 -0.17 -0.19 0.15 0.17 -4.49 113.70 116.87 3igv s SER 326 Ca 0.54 1.99 0.17 0.00 0.70 0.00 0.00 55.95 59.35 3igv s SER 326 Cb -0.28 -2.59 0.52 0.00 -1.71 0.00 0.00 66.02 61.96 3igv s SER 326 CO 0.31 -0.26 1.41 0.00 1.20 0.00 0.00 173.24 175.91 3igv n ALA 327 N 0.40 2.96 0.00 5.45 0.00 -1.26 -4.89 120.51 123.17 3igv n ALA 327 Ca 0.03 -2.30 0.00 0.00 0.00 0.00 0.00 53.44 51.16 3igv n ALA 327 Cb 0.49 -0.70 0.00 0.00 0.00 0.00 0.00 19.45 19.24 3igv n ALA 327 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3igv n GLY 328 N -0.52 0.56 0.29 0.00 0.00 -1.26 -4.40 105.19 99.85 3igv n GLY 328 Ca 0.21 -1.69 0.06 0.00 0.00 0.00 0.00 46.02 44.60 3igv n GLY 328 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 3igv h THR 329 N 0.00 1.04 -0.05 2.61 1.35 -1.98 -0.45 112.91 115.43 3igv h THR 329 Ca 0.00 -0.09 -0.08 0.00 -0.55 0.00 0.00 66.41 65.69 3igv h THR 329 Cb 0.00 0.76 0.00 0.00 -1.73 0.00 0.00 68.15 67.18 3igv h THR 329 CO 0.00 0.05 -0.28 -0.61 -0.25 0.00 0.00 175.52 174.43 3igv h GLN 330 N 0.26 0.27 -0.22 4.72 4.15 -2.00 -2.36 115.11 119.94 3igv h GLN 330 Ca 0.08 -0.23 -0.10 0.00 0.77 0.00 0.00 58.65 59.17 3igv h GLN 330 Cb -0.01 0.05 -0.01 0.00 0.21 0.00 0.00 27.48 27.72 3igv h GLN 330 CO -0.02 0.89 -0.29 0.93 -1.93 0.00 0.00 178.83 178.41 3igv h GLU 331 N -0.27 0.43 -0.58 1.69 4.39 -1.67 -1.95 114.58 116.62 3igv h GLU 331 Ca -0.02 -0.17 -0.10 0.00 0.34 0.00 0.00 59.36 59.41 3igv h GLU 331 Cb 0.95 -0.02 -0.02 0.00 -0.10 0.00 0.00 28.75 29.56 3igv h GLU 331 CO 0.06 0.68 -0.02 -0.44 -1.16 0.00 0.00 179.01 178.12 3igv h ASP 332 N 0.38 1.03 -0.53 1.42 3.32 -1.15 0.73 116.42 121.62 3igv h ASP 332 Ca 0.05 -0.32 -0.09 0.00 0.02 0.00 0.00 57.03 56.69 3igv h ASP 332 Cb 0.70 -0.28 -0.02 0.00 0.22 0.00 0.00 39.33 39.95 3igv h ASP 332 CO 0.05 1.10 -0.02 0.00 -1.72 0.00 0.00 179.24 178.65 3igv h ALA 333 N 0.97 0.90 0.00 3.45 0.00 -1.14 -1.58 119.26 121.86 3igv h ALA 333 Ca 0.16 -0.31 -0.18 0.00 0.00 0.00 0.00 54.91 54.59 3igv h ALA 333 Cb 0.59 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.14 3igv h ALA 333 CO 0.03 0.65 -0.85 0.00 0.00 0.00 0.00 179.25 179.09 3igv h ALA 334 N 1.07 0.60 -0.09 0.00 0.00 -1.29 -2.94 119.26 116.61 3igv h ALA 334 Ca 0.16 -0.76 -0.00 0.00 0.00 0.00 0.00 54.91 54.30 3igv h ALA 334 Cb 0.55 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.21 3igv h ALA 334 CO 0.03 1.04 0.04 0.77 0.00 0.00 0.00 179.25 181.14 3igv h SER 335 N 0.01 0.12 0.04 0.00 0.02 -0.65 -3.00 113.55 110.08 3igv h SER 335 Ca -0.01 -0.12 -0.06 0.00 -0.84 0.00 0.00 61.79 60.76 3igv h SER 335 Cb 1.49 -0.03 -0.01 0.00 0.14 0.00 0.00 62.40 63.99 3igv h SER 335 CO 0.11 0.21 -0.16 -0.07 -1.14 0.00 0.00 176.83 175.78 3igv h LEU 336 N 0.02 0.23 -0.49 5.07 3.38 -1.30 -1.00 115.31 121.22 3igv h LEU 336 Ca 0.03 -0.05 -0.01 0.00 0.09 0.00 0.00 57.88 57.94 3igv h LEU 336 Cb 0.12 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 40.79 3igv h LEU 336 CO -0.00 0.41 0.26 0.03 0.09 0.00 0.00 178.44 179.22 3igv h ARG 337 N 0.23 0.70 -0.42 1.13 3.08 -1.51 0.20 114.38 117.79 3igv h ARG 337 Ca 0.04 -0.09 -0.04 0.00 0.07 0.00 0.00 59.98 59.96 3igv h ARG 337 Cb 0.42 -0.13 -0.02 0.00 0.08 0.00 0.00 29.97 30.32 3igv h ARG 337 CO 0.03 0.57 0.10 0.28 -1.07 0.00 0.00 179.97 179.87 3igv h VAL 338 N 0.66 1.23 -0.42 2.04 2.07 -1.28 0.25 116.25 120.81 3igv h VAL 338 Ca 0.17 -0.80 0.08 0.00 0.82 0.00 0.00 66.70 66.97 3igv h VAL 338 Cb 0.08 0.96 -0.07 0.00 -1.52 0.00 0.00 31.29 30.74 3igv h VAL 338 CO -0.03 0.28 -0.00 0.15 0.02 0.00 0.00 177.57 177.99 3igv h PHE 339 N 0.54 -0.02 -0.55 1.57 3.57 -1.02 0.65 116.94 121.67 3igv h PHE 339 Ca 0.13 0.03 -0.10 0.00 3.53 0.00 0.00 57.97 61.56 3igv h PHE 339 Cb 0.32 0.07 -0.02 0.00 2.79 0.00 0.00 35.95 39.11 3igv h PHE 339 CO 0.02 -0.08 -0.05 1.15 -2.23 0.00 0.00 178.31 177.12 3igv h THR 340 N 0.11 1.26 -0.11 4.41 2.02 -0.19 0.09 112.91 120.50 3igv h THR 340 Ca 0.21 -1.18 -0.01 0.00 0.77 0.00 0.00 66.41 66.20 3igv h THR 340 Cb 0.29 0.89 -0.00 0.00 -1.74 0.00 0.00 68.15 67.59 3igv h THR 340 CO -0.34 0.42 0.04 -0.33 0.37 0.00 0.00 175.52 175.68 3igv h GLU 341 N 0.89 0.17 0.05 6.66 5.08 -0.21 0.29 114.58 127.52 3igv h GLU 341 Ca 0.15 -0.03 0.02 0.00 -1.00 0.00 0.00 59.36 58.50 3igv h GLU 341 Cb 0.59 -0.03 -0.03 0.00 0.50 0.00 0.00 28.75 29.78 3igv h GLU 341 CO 0.04 0.29 -0.21 0.00 -1.00 0.00 0.00 179.01 178.12 3igv h ALA 342 N 0.87 -0.32 -0.96 3.43 0.00 -0.70 0.10 119.26 121.69 3igv h ALA 342 Ca 0.04 -0.01 0.07 0.00 0.00 0.00 0.00 54.91 55.00 3igv h ALA 342 Cb 0.19 0.36 -0.06 0.00 0.00 0.00 0.00 17.79 18.27 3igv h ALA 342 CO -0.00 -0.73 0.62 0.52 0.00 0.00 0.00 179.25 179.66 3igv h MET 343 N -0.37 1.06 -0.49 0.00 2.86 -0.93 -0.74 114.93 116.32 3igv h MET 343 Ca 0.04 -0.06 -0.04 0.00 -2.06 0.00 0.00 59.70 57.58 3igv h MET 343 Cb 0.42 -0.24 -0.02 0.00 0.06 0.00 0.00 31.60 31.82 3igv h MET 343 CO -0.16 0.70 0.14 1.15 1.06 0.00 0.00 176.91 179.80 3igv h THR 344 N 1.09 1.23 -0.83 2.22 2.02 -0.28 0.35 112.91 118.71 3igv h THR 344 Ca 0.41 -0.80 -0.02 0.00 0.77 0.00 0.00 66.41 66.77 3igv h THR 344 Cb 0.20 0.82 -0.04 0.00 -1.74 0.00 0.00 68.15 67.40 3igv h THR 344 CO -0.16 0.29 0.44 0.03 0.37 0.00 0.00 175.52 176.49 3igv h ARG 345 N 0.67 1.17 0.00 6.66 3.08 0.00 -1.77 114.38 124.20 3igv h ARG 345 Ca 0.16 -0.14 0.00 0.00 0.07 0.00 0.00 59.98 60.06 3igv h ARG 345 Cb 0.30 -0.23 0.00 0.00 0.08 0.00 0.00 29.97 30.13 3igv h ARG 345 CO -0.00 0.87 0.00 0.66 -1.07 0.00 0.00 179.97 180.43 3igv n TYR 346 N -4.33 0.00 -2.77 3.04 4.01 -0.36 -1.08 117.16 115.67 3igv n TYR 346 Ca 0.09 0.00 -0.10 0.00 -0.16 0.00 0.00 57.90 57.72 3igv n TYR 346 Cb 0.11 0.00 0.05 0.00 -0.31 0.00 0.00 39.34 39.19 3igv n TYR 346 CO 0.00 0.00 0.00 0.45 -0.46 0.00 0.00 176.86 176.85 3igv n SER 347 N -0.71 -3.60 -3.03 7.72 2.88 -0.66 -4.88 113.62 111.34 3igv n SER 347 Ca 0.08 -0.43 -0.18 0.00 -1.33 0.00 0.00 58.87 57.01 3igv n SER 347 Cb 0.04 -3.52 -0.02 0.00 -0.75 0.00 0.00 64.21 59.96 3igv n SER 347 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3igv n ALA 348 N -2.81 0.99 -1.31 -1.46 0.00 0.12 -4.55 120.51 111.49 3igv n ALA 348 Ca -0.11 -2.66 -0.31 0.00 0.00 0.00 0.00 53.44 50.36 3igv n ALA 348 Cb 0.59 -1.01 0.09 0.00 0.00 0.00 0.00 19.45 19.13 3igv n ALA 348 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 3igv s PRO 349 N -0.62 2.18 0.58 0.00 0.04 -1.26 -3.91 135.00 132.01 3igv s PRO 349 Ca 0.34 1.06 -0.08 0.00 0.04 0.00 0.00 61.00 62.36 3igv s PRO 349 Cb 0.21 -1.90 -0.02 0.00 0.04 0.00 0.00 34.50 32.84 3igv s PRO 349 CO -0.15 -1.66 0.93 -1.25 0.04 0.00 0.00 177.00 174.91 3igv s PRO 350 N -4.94 3.30 0.00 0.56 0.04 -1.26 -1.89 135.00 130.82 3igv s PRO 350 Ca 0.61 0.35 0.00 0.00 0.04 0.00 0.00 61.00 62.00 3igv s PRO 350 Cb -0.17 -2.21 0.00 0.00 0.04 0.00 0.00 34.50 32.16 3igv s PRO 350 CO 0.56 -0.56 0.00 0.41 0.04 0.00 0.00 177.00 177.45 3igv n GLY 351 N -2.59 1.15 3.78 0.56 0.00 0.55 -4.11 105.19 104.53 3igv n GLY 351 Ca 0.04 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.69 3igv n GLY 351 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3igv s ASP 352 N -1.00 7.06 0.27 1.61 -0.00 -1.26 -4.96 116.67 118.39 3igv s ASP 352 Ca 0.00 1.99 -0.30 0.00 -0.00 0.00 0.00 52.55 54.25 3igv s ASP 352 Cb 0.00 -2.59 -0.10 0.00 -0.00 0.00 0.00 42.92 40.23 3igv s ASP 352 CO 0.00 -0.27 1.46 -2.16 -0.00 0.00 0.00 175.17 174.19 3igv s PRO 353 N -2.16 4.24 0.39 8.23 0.04 -1.26 -4.69 135.00 139.79 3igv s PRO 353 Ca 0.53 2.36 -0.27 0.00 0.04 0.00 0.00 61.00 63.66 3igv s PRO 353 Cb -0.22 -3.08 -0.09 0.00 0.04 0.00 0.00 34.50 31.14 3igv s PRO 353 CO 0.28 -0.44 1.32 -1.25 0.04 0.00 0.00 177.00 176.95 3igv s PRO 354 N -0.62 4.03 -0.05 0.56 0.04 -1.26 -5.03 135.00 132.67 3igv s PRO 354 Ca 0.59 2.21 0.06 0.00 0.04 0.00 0.00 61.00 63.90 3igv s PRO 354 Cb -0.43 -2.82 -0.01 0.00 0.04 0.00 0.00 34.50 31.27 3igv s PRO 354 CO 0.46 -0.46 -0.24 -0.65 0.04 0.00 0.00 177.00 176.16 3igv s GLN 355 N -2.16 2.46 0.06 4.56 -1.52 -1.26 -5.00 119.66 116.80 3igv s GLN 355 Ca 0.55 -0.88 -0.30 0.00 -1.95 0.00 0.00 55.36 52.78 3igv s GLN 355 Cb -0.39 -2.17 -0.05 0.00 -0.22 0.00 0.00 33.01 30.18 3igv s GLN 355 CO 0.51 0.45 1.06 -1.25 -0.25 0.00 0.00 175.29 175.81 3igv s PRO 356 N -0.32 4.55 0.05 2.91 0.04 -1.26 -4.59 135.00 136.37 3igv s PRO 356 Ca 0.01 1.58 0.06 0.00 0.04 0.00 0.00 61.00 62.69 3igv s PRO 356 Cb -0.13 -3.38 -0.03 0.00 0.04 0.00 0.00 34.50 31.00 3igv s PRO 356 CO 0.02 -0.05 -0.14 -1.21 0.04 0.00 0.00 177.00 175.66 3igv s GLU 357 N 0.66 2.19 0.00 4.56 0.41 0.62 -4.97 118.70 122.18 3igv s GLU 357 Ca 0.53 -0.93 0.07 0.00 -0.41 0.00 0.00 54.97 54.23 3igv s GLU 357 Cb -0.25 -2.29 0.07 0.00 -1.78 0.00 0.00 34.13 29.88 3igv s GLU 357 CO 0.30 0.55 0.76 0.66 -0.49 0.00 0.00 175.26 177.04 3igv n TYR 358 N 1.37 0.03 -4.17 1.61 4.01 -1.26 -1.47 117.16 117.28 3igv n TYR 358 Ca -0.15 -0.06 -0.32 0.00 -0.16 0.00 0.00 57.90 57.21 3igv n TYR 358 Cb 0.52 -0.00 -0.16 0.00 -0.31 0.00 0.00 39.34 39.39 3igv n TYR 358 CO 0.00 0.00 0.00 0.34 -0.46 0.00 0.00 176.86 176.74 3igv s ASP 359 N -0.61 2.91 0.52 7.72 -1.08 -1.26 -4.98 116.67 119.89 3igv s ASP 359 Ca 0.09 -0.57 0.18 0.00 -0.52 0.00 0.00 52.55 51.73 3igv s ASP 359 Cb 0.06 -1.33 1.29 0.00 -1.46 0.00 0.00 42.92 41.47 3igv s ASP 359 CO 0.09 -0.01 2.09 0.25 0.52 0.00 0.00 175.17 178.11 3igv h LEU 360 N 7.87 0.03 -0.36 -1.34 5.85 -1.96 -1.43 115.31 123.96 3igv h LEU 360 Ca -0.40 -0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.32 3igv h LEU 360 Cb 1.15 -0.01 0.00 0.00 0.37 0.00 0.00 40.66 42.17 3igv h LEU 360 CO 0.58 0.02 0.00 -0.33 -0.34 0.00 0.00 178.44 178.37 3igv h GLU 361 N 0.04 0.00 -0.02 1.25 5.08 -1.96 -2.87 114.58 116.10 3igv h GLU 361 Ca 0.10 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.46 3igv h GLU 361 Cb 0.34 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.59 3igv h GLU 361 CO -0.01 0.00 -0.03 1.28 -1.00 0.00 0.00 179.01 179.25 3igv n LEU 362 N -2.32 1.94 -4.66 1.33 4.77 -0.54 -4.57 117.00 112.94 3igv n LEU 362 Ca 0.04 -0.64 -0.39 0.00 -0.03 0.00 0.00 56.01 54.99 3igv n LEU 362 Cb 0.34 -0.01 -0.07 0.00 -2.33 0.00 0.00 43.42 41.35 3igv n LEU 362 CO 0.26 0.33 0.16 -0.63 -1.33 0.00 0.00 177.39 176.18 3igv s ILE 363 N -2.05 5.15 -0.25 -0.08 1.01 -1.08 -5.05 121.20 118.85 3igv s ILE 363 Ca 0.33 0.81 -0.09 0.00 0.00 0.00 0.00 60.65 61.70 3igv s ILE 363 Cb 0.20 -3.78 -0.04 0.00 0.01 0.00 0.00 42.46 38.86 3igv s ILE 363 CO 0.34 0.20 0.11 -0.89 0.00 0.00 0.00 174.94 174.71 3igv s THR 364 N 1.58 4.78 -0.02 2.92 2.01 -1.26 -4.22 115.64 121.42 3igv s THR 364 Ca 0.21 -0.02 -0.02 0.00 0.31 0.00 0.00 61.69 62.17 3igv s THR 364 Cb -0.15 -3.24 0.01 0.00 0.01 0.00 0.00 72.50 69.13 3igv s THR 364 CO 0.09 0.33 0.05 -0.94 -0.69 0.00 0.00 174.62 173.46 3igv s SER 365 N 1.44 -0.05 -1.50 3.53 1.04 -0.15 -4.68 113.70 113.33 3igv s SER 365 Ca 0.06 0.11 -0.10 0.00 0.48 0.00 0.00 55.95 56.50 3igv s SER 365 Cb -0.15 0.11 0.07 0.00 0.10 0.00 0.00 66.02 66.15 3igv s SER 365 CO 0.06 -0.02 0.83 0.00 0.98 0.00 0.00 173.24 175.09 3igv n SER 367 N -2.87 -5.35 -4.27 0.00 7.64 -1.26 -4.94 113.62 102.58 3igv n SER 367 Ca -0.06 0.07 -0.27 0.00 1.01 0.00 0.00 58.87 59.61 3igv n SER 367 Cb 0.57 -3.38 -0.15 0.00 -1.01 0.00 0.00 64.21 60.24 3igv n SER 367 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 3igv s SER 368 N -1.92 2.65 0.18 6.43 0.01 -0.31 -4.59 113.70 116.15 3igv s SER 368 Ca 0.00 -0.50 0.10 0.00 1.31 0.00 0.00 55.95 56.86 3igv s SER 368 Cb 0.00 -0.25 -0.04 0.00 0.21 0.00 0.00 66.02 65.94 3igv s SER 368 CO 0.00 0.22 -0.19 0.54 0.41 0.00 0.00 173.24 174.21 3igv s ASN 369 N -0.99 3.73 0.37 2.44 4.22 0.11 -0.98 114.94 123.84 3igv s ASN 369 Ca 0.09 -0.74 -0.26 0.00 -2.14 0.00 0.00 52.86 49.81 3igv s ASN 369 Cb -0.09 -0.43 -0.09 0.00 1.28 0.00 0.00 41.25 41.92 3igv s ASN 369 CO 0.01 0.12 1.11 -0.69 -2.04 0.00 0.00 177.10 175.61 3igv s VAL 370 N -1.60 3.44 0.27 3.54 1.01 -1.26 -0.75 120.40 125.06 3igv s VAL 370 Ca 0.21 1.23 -0.06 0.00 0.00 0.00 0.00 61.98 63.37 3igv s VAL 370 Cb -0.09 -3.70 -0.01 0.00 0.00 0.00 0.00 36.38 32.58 3igv s VAL 370 CO 0.11 0.13 0.38 -0.55 0.00 0.00 0.00 175.10 175.18 3igv s SER 371 N -1.22 0.38 -0.02 3.32 0.15 -0.18 -4.36 113.70 111.77 3igv s SER 371 Ca 0.54 -1.26 0.05 0.00 0.70 0.00 0.00 55.95 55.98 3igv s SER 371 Cb -0.28 0.56 -0.01 0.00 -1.71 0.00 0.00 66.02 64.58 3igv s SER 371 CO 0.35 -1.12 -0.17 0.54 1.20 0.00 0.00 173.24 174.04 3igv s VAL 372 N -3.70 1.38 0.34 4.45 0.11 -1.26 -1.69 120.40 120.04 3igv s VAL 372 Ca 0.30 -0.74 0.07 0.00 -2.93 0.00 0.00 61.98 58.68 3igv s VAL 372 Cb 0.01 -1.16 -0.03 0.00 -1.53 0.00 0.00 36.38 33.68 3igv s VAL 372 CO 0.14 0.39 0.25 0.00 -3.33 0.00 0.00 175.10 172.56 3igv s ALA 373 N -0.35 2.05 0.03 1.54 0.00 -0.61 -3.60 121.76 120.83 3igv s ALA 373 Ca 0.05 -1.92 0.09 0.00 0.00 0.00 0.00 51.96 50.18 3igv s ALA 373 Cb -0.07 1.36 -0.03 0.00 0.00 0.00 0.00 23.12 24.38 3igv s ALA 373 CO -0.00 -0.61 -0.26 -1.01 0.00 0.00 0.00 175.76 173.88 3igv s HIS 374 N -3.41 2.25 0.00 0.00 3.76 -0.22 -0.74 115.29 116.93 3igv s HIS 374 Ca 0.38 -0.41 0.00 0.00 -0.15 0.00 0.00 55.06 54.88 3igv s HIS 374 Cb 0.02 -1.36 0.00 0.00 1.11 0.00 0.00 32.58 32.35 3igv s HIS 374 CO 0.25 0.09 0.00 -0.40 -0.85 0.00 0.00 174.74 173.84 3igv n ASP 375 N 1.91 0.00 -0.05 1.40 3.85 -1.08 -0.59 116.55 121.99 3igv n ASP 375 Ca -0.17 -0.05 0.00 0.00 -0.71 0.00 0.00 54.79 53.87 3igv n ASP 375 Cb 0.52 0.00 0.30 0.00 -1.35 0.00 0.00 41.12 40.59 3igv n ASP 375 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 3igv h ALA 376 N -1.41 1.44 -0.05 2.12 0.00 -1.90 -1.71 119.26 117.75 3igv h ALA 376 Ca 0.00 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.77 3igv h ALA 376 Cb 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.60 3igv h ALA 376 CO 0.00 0.42 0.00 0.43 0.00 0.00 0.00 179.25 180.10 3igv n SER 377 N -4.35 0.61 0.00 0.00 7.64 -1.26 -4.87 113.62 111.40 3igv n SER 377 Ca 0.03 -1.47 0.00 0.00 1.01 0.00 0.00 58.87 58.45 3igv n SER 377 Cb 0.17 -0.03 0.00 0.00 -1.01 0.00 0.00 64.21 63.33 3igv n SER 377 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3igv n GLY 378 N 0.94 1.19 3.67 0.23 0.00 -0.64 -4.98 105.19 105.60 3igv n GLY 378 Ca 0.16 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.76 3igv n GLY 378 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3igv s LYS 379 N -0.14 4.23 0.24 1.61 2.20 -1.26 -4.56 119.74 122.06 3igv s LYS 379 Ca 0.00 1.88 -0.30 0.00 -0.36 0.00 0.00 55.97 57.18 3igv s LYS 379 Cb 0.00 -3.78 -0.14 0.00 -1.51 0.00 0.00 37.83 32.39 3igv s LYS 379 CO 0.00 -0.71 1.15 0.54 -0.36 0.00 0.00 175.35 175.97 3igv n ARG 380 N 6.46 1.46 -3.73 4.03 1.74 -1.26 -2.63 116.66 122.73 3igv n ARG 380 Ca 0.15 0.51 -0.12 0.00 -0.77 0.00 0.00 57.85 57.62 3igv n ARG 380 Cb 0.44 -1.99 -0.13 0.00 -1.02 0.00 0.00 32.46 29.76 3igv n ARG 380 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 3igv s VAL 381 N -0.58 -0.04 0.15 1.55 0.11 0.08 -4.92 120.40 116.76 3igv s VAL 381 Ca 0.65 0.14 -0.13 0.00 -2.93 0.00 0.00 61.98 59.71 3igv s VAL 381 Cb -0.74 -0.40 -0.07 0.00 -1.53 0.00 0.00 36.38 33.65 3igv s VAL 381 CO 0.55 0.06 0.54 -0.31 -3.33 0.00 0.00 175.10 172.61 3igv s TYR 382 N 1.25 3.58 0.07 1.54 2.02 -1.26 -1.57 117.35 122.98 3igv s TYR 382 Ca -0.09 1.02 -0.12 0.00 -0.37 0.00 0.00 57.07 57.50 3igv s TYR 382 Cb -0.10 -2.34 0.01 0.00 -0.40 0.00 0.00 41.96 39.13 3igv s TYR 382 CO -0.09 0.41 0.27 1.52 -1.57 0.00 0.00 175.55 176.09 3igv s TYR 383 N -1.51 -0.02 -0.01 2.71 1.13 -0.68 -4.98 117.35 113.99 3igv s TYR 383 Ca 0.39 -0.24 -0.15 0.00 -1.41 0.00 0.00 57.07 55.66 3igv s TYR 383 Cb -0.14 0.06 -0.06 0.00 -1.10 0.00 0.00 41.96 40.72 3igv s TYR 383 CO 0.19 -0.53 0.41 -0.51 -2.51 0.00 0.00 175.55 172.60 3igv s LEU 384 N -2.40 4.47 0.32 -3.49 1.43 -1.26 -1.01 118.68 116.73 3igv s LEU 384 Ca -0.01 0.96 0.04 0.00 -1.03 0.00 0.00 54.13 54.08 3igv s LEU 384 Cb 0.01 -2.59 -0.02 0.00 0.03 0.00 0.00 46.19 43.62 3igv s LEU 384 CO -0.07 0.31 0.33 0.28 0.23 0.00 0.00 176.35 177.43 3igv s THR 385 N -1.00 0.00 0.27 5.49 -1.32 0.07 -4.73 115.64 114.42 3igv s THR 385 Ca 0.24 -1.88 -0.18 0.00 -1.21 0.00 0.00 61.69 58.66 3igv s THR 385 Cb -0.17 -2.54 0.01 0.00 -1.51 0.00 0.00 72.50 68.30 3igv s THR 385 CO 0.13 0.00 0.63 0.00 -2.21 0.00 0.00 174.62 173.18 3igv s ARG 386 N -3.38 1.70 0.16 7.08 1.70 -1.26 0.03 118.95 124.98 3igv s ARG 386 Ca 0.38 -1.08 -0.31 0.00 -0.47 0.00 0.00 55.73 54.24 3igv s ARG 386 Cb 0.02 0.56 -0.11 0.00 -0.57 0.00 0.00 34.95 34.85 3igv s ARG 386 CO 0.24 -0.76 1.74 0.34 -1.08 0.00 0.00 175.30 175.79 3igv s ASP 387 N -2.95 6.44 0.00 -2.89 -1.08 -1.26 -4.89 116.67 110.04 3igv s ASP 387 Ca 0.15 2.76 0.17 0.00 -0.52 0.00 0.00 52.55 55.12 3igv s ASP 387 Cb -0.04 -2.58 0.68 0.00 -1.46 0.00 0.00 42.92 39.52 3igv s ASP 387 CO 0.08 -0.96 1.49 -0.81 0.52 0.00 0.00 175.17 175.49 3igv n PRO 388 N 4.81 1.58 0.01 4.34 -0.04 -1.26 -4.41 135.00 140.03 3igv n PRO 388 Ca 0.16 -0.88 -0.10 0.00 -0.04 0.00 0.00 63.50 62.64 3igv n PRO 388 Cb 0.37 -1.33 -0.04 0.00 -0.04 0.00 0.00 33.50 32.46 3igv n PRO 388 CO 0.00 0.00 0.00 1.15 -0.04 0.00 0.00 175.50 176.61 3igv h THR 389 N 1.69 0.70 0.16 0.52 2.02 -1.95 -1.57 112.91 114.47 3igv h THR 389 Ca 0.00 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.17 3igv h THR 389 Cb 0.37 0.70 0.00 0.00 -1.74 0.00 0.00 68.15 67.48 3igv h THR 389 CO 0.00 0.00 -0.08 0.74 0.37 0.00 0.00 175.52 176.55 3igv h THR 390 N -0.14 0.98 -0.98 3.16 2.02 -1.96 -1.79 112.91 114.20 3igv h THR 390 Ca 0.07 -0.93 0.22 0.00 0.77 0.00 0.00 66.41 66.55 3igv h THR 390 Cb 0.25 1.52 -0.09 0.00 -1.74 0.00 0.00 68.15 68.09 3igv h THR 390 CO -0.18 0.21 0.63 -0.65 0.37 0.00 0.00 175.52 175.89 3igv h PRO 391 N -0.69 0.48 -0.04 6.66 0.11 -1.83 -0.22 132.00 136.47 3igv h PRO 391 Ca -0.02 -0.03 -0.15 0.00 0.11 0.00 0.00 66.00 65.91 3igv h PRO 391 Cb 0.50 -0.11 0.01 0.00 0.11 0.00 0.00 31.00 31.51 3igv h PRO 391 CO 0.04 0.32 -0.56 -0.07 -0.21 0.00 0.00 178.00 177.51 3igv h LEU 392 N 0.50 0.57 -1.06 2.35 3.38 -1.27 -1.38 115.31 118.39 3igv h LEU 392 Ca 0.54 -0.71 0.13 0.00 0.09 0.00 0.00 57.88 57.94 3igv h LEU 392 Cb 1.22 -0.17 -0.08 0.00 0.09 0.00 0.00 40.66 41.71 3igv h LEU 392 CO -0.27 1.19 0.62 0.00 0.09 0.00 0.00 178.44 180.07 3igv h ALA 393 N 0.39 1.59 0.03 1.53 0.00 -0.60 -0.38 119.26 121.82 3igv h ALA 393 Ca -0.06 0.03 -0.22 0.00 0.00 0.00 0.00 54.91 54.66 3igv h ALA 393 Cb 1.24 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.84 3igv h ALA 393 CO 0.11 0.14 -0.99 0.00 0.00 0.00 0.00 179.25 178.51 3igv h ARG 394 N 0.92 0.14 -0.76 0.00 3.08 -1.03 -2.73 114.38 114.00 3igv h ARG 394 Ca 0.50 -0.19 -0.05 0.00 0.07 0.00 0.00 59.98 60.31 3igv h ARG 394 Cb 0.58 0.06 -0.03 0.00 0.08 0.00 0.00 29.97 30.66 3igv h ARG 394 CO -0.27 1.02 0.27 0.00 -1.07 0.00 0.00 179.97 179.92 3igv h ALA 395 N 0.91 0.99 -0.61 0.04 0.00 -0.84 -1.16 119.26 118.59 3igv h ALA 395 Ca -0.05 -0.21 0.04 0.00 0.00 0.00 0.00 54.91 54.68 3igv h ALA 395 Cb 1.69 -0.30 -0.04 0.00 0.00 0.00 0.00 17.79 19.14 3igv h ALA 395 CO 0.15 0.65 0.36 0.00 0.00 0.00 0.00 179.25 180.40 3igv h ALA 396 N 1.14 0.80 -0.70 0.00 0.00 -1.00 0.20 119.26 119.70 3igv h ALA 396 Ca 0.25 -0.00 -0.04 0.00 0.00 0.00 0.00 54.91 55.12 3igv h ALA 396 Cb 0.26 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.86 3igv h ALA 396 CO -0.01 0.08 0.30 2.35 0.00 0.00 0.00 179.25 181.96 3igv h TRP 397 N 0.70 1.05 0.00 0.00 2.91 -1.26 -2.79 115.95 116.55 3igv h TRP 397 Ca 0.25 -0.07 0.00 0.00 1.13 0.00 0.00 58.89 60.20 3igv h TRP 397 Cb 0.07 -0.32 0.00 0.00 -0.51 0.00 0.00 29.16 28.40 3igv h TRP 397 CO -0.06 0.80 0.00 0.39 -1.03 0.00 0.00 178.44 178.54 3igv n GLU 398 N -4.39 0.04 0.10 2.65 1.02 -0.46 -0.41 120.64 119.20 3igv n GLU 398 Ca 0.05 0.07 -0.05 0.00 -0.02 0.00 0.00 57.16 57.22 3igv n GLU 398 Cb 0.16 -1.56 0.07 0.00 -0.02 0.00 0.00 31.44 30.10 3igv n GLU 398 CO 0.00 0.00 0.00 1.15 1.18 0.00 0.00 177.13 179.46 3igv h THR 399 N 0.00 1.49 0.00 2.62 2.02 -0.35 -3.37 112.91 115.32 3igv h THR 399 Ca 0.00 -2.42 -0.03 0.00 0.77 0.00 0.00 66.41 64.73 3igv h THR 399 Cb 0.51 2.31 -0.01 0.00 -1.74 0.00 0.00 68.15 69.22 3igv h THR 399 CO 0.00 0.70 -1.69 0.00 0.37 0.00 0.00 175.52 174.90 3igv n ALA 400 N -2.43 2.41 -3.20 6.16 0.00 -0.99 -4.88 120.51 117.58 3igv n ALA 400 Ca -0.02 -0.41 -0.24 0.00 0.00 0.00 0.00 53.44 52.77 3igv n ALA 400 Cb 0.71 -0.43 -0.16 0.00 0.00 0.00 0.00 19.45 19.57 3igv n ALA 400 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 3igv s ARG 401 N -2.90 1.57 0.15 0.00 1.81 0.46 -4.91 118.95 115.12 3igv s ARG 401 Ca -0.05 -0.45 -0.31 0.00 -1.72 0.00 0.00 55.73 53.20 3igv s ARG 401 Cb 0.08 -1.35 -0.08 0.00 -0.45 0.00 0.00 34.95 33.15 3igv s ARG 401 CO 0.59 0.11 1.37 -1.01 -0.68 0.00 0.00 175.30 175.68 3igv s HIS 402 N 0.38 3.23 0.20 -0.53 3.76 -1.26 -4.22 115.29 116.84 3igv s HIS 402 Ca -0.09 1.03 0.10 0.00 -0.15 0.00 0.00 55.06 55.95 3igv s HIS 402 Cb -0.13 -3.67 -0.04 0.00 1.11 0.00 0.00 32.58 29.84 3igv s HIS 402 CO 0.03 -2.28 -0.21 0.95 -0.85 0.00 0.00 174.74 172.38 3igv s THR 403 N 0.72 2.16 0.33 1.30 -4.23 -1.26 -5.05 115.64 109.61 3igv s THR 403 Ca 0.62 -2.06 0.06 0.00 -1.18 0.00 0.00 61.69 59.13 3igv s THR 403 Cb -0.37 -2.05 0.11 0.00 1.34 0.00 0.00 72.50 71.53 3igv s THR 403 CO 0.34 -0.25 1.82 1.55 -0.54 0.00 0.00 174.62 177.53 3igv h PRO 404 N 3.04 0.36 -5.12 3.99 0.13 -1.96 -3.41 132.00 129.03 3igv h PRO 404 Ca -0.43 -0.11 -0.67 0.00 -0.87 0.00 0.00 66.00 63.92 3igv h PRO 404 Cb 1.22 -0.04 -0.32 0.00 0.13 0.00 0.00 31.00 31.99 3igv h PRO 404 CO 0.52 0.54 -0.82 0.08 -0.23 0.00 0.00 178.00 178.08 3igv s VAL 405 N -4.62 2.44 -0.71 1.56 1.01 -1.26 -4.70 120.40 114.12 3igv s VAL 405 Ca -0.06 -0.83 -0.20 0.00 0.00 0.00 0.00 61.98 60.89 3igv s VAL 405 Cb 0.15 -2.03 0.11 0.00 0.00 0.00 0.00 36.38 34.60 3igv s VAL 405 CO 0.76 0.52 0.90 0.20 0.00 0.00 0.00 175.10 177.48 3igv s ASN 406 N 1.06 6.32 0.44 3.32 0.01 -0.36 -4.89 114.94 120.85 3igv s ASN 406 Ca -0.01 -1.51 0.17 0.00 -0.71 0.00 0.00 52.86 50.80 3igv s ASN 406 Cb -0.14 -2.36 1.00 0.00 0.41 0.00 0.00 41.25 40.16 3igv s ASN 406 CO -0.05 -1.18 1.95 0.77 -1.51 0.00 0.00 177.10 177.08 3igv h SER 407 N 9.15 0.00 -0.98 -1.22 4.64 -1.93 -2.97 113.55 120.24 3igv h SER 407 Ca -0.16 0.00 0.02 0.00 -0.47 0.00 0.00 61.79 61.18 3igv h SER 407 Cb 1.06 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 63.10 3igv h SER 407 CO 1.11 0.24 0.64 4.11 -0.87 0.00 0.00 176.83 182.06 3igv h TRP 408 N 0.00 1.22 -0.31 4.77 5.08 -1.90 0.34 115.95 125.15 3igv h TRP 408 Ca -0.00 0.03 -0.14 0.00 1.08 0.00 0.00 58.89 59.86 3igv h TRP 408 Cb 0.45 -0.41 -0.00 0.00 -3.00 0.00 0.00 29.16 26.20 3igv h TRP 408 CO 0.00 0.74 -0.36 1.25 -1.28 0.00 0.00 178.44 178.79 3igv h LEU 409 N 1.29 0.85 -0.47 0.11 5.85 -1.92 -1.10 115.31 119.91 3igv h LEU 409 Ca 0.37 -0.49 0.05 0.00 0.84 0.00 0.00 57.88 58.66 3igv h LEU 409 Cb -0.09 -0.24 -0.05 0.00 0.37 0.00 0.00 40.66 40.66 3igv h LEU 409 CO -0.10 1.16 0.20 1.23 -0.34 0.00 0.00 178.44 180.60 3igv h GLY 410 N 0.55 0.64 1.29 3.75 0.00 -1.32 0.74 103.07 108.71 3igv h GLY 410 Ca 0.04 -0.13 -0.11 0.00 0.00 0.00 0.00 47.33 47.14 3igv h GLY 410 CO 0.09 0.06 -0.15 3.43 0.00 0.00 0.00 176.54 179.96 3igv h ASN 411 N 0.40 0.83 -0.18 0.19 2.35 -0.86 -0.39 115.58 117.92 3igv h ASN 411 Ca 0.22 -0.28 -0.02 0.00 -0.55 0.00 0.00 56.30 55.67 3igv h ASN 411 Cb 0.18 -0.23 -0.01 0.00 0.05 0.00 0.00 38.32 38.31 3igv h ASN 411 CO -0.19 0.99 0.03 0.40 -1.65 0.00 0.00 177.43 177.01 3igv h ILE 412 N 0.74 1.22 -0.69 2.81 2.04 -0.90 0.22 117.51 122.94 3igv h ILE 412 Ca 0.11 -0.71 0.02 0.00 1.00 0.00 0.00 64.86 65.28 3igv h ILE 412 Cb 0.67 1.34 -0.04 0.00 -0.74 0.00 0.00 36.82 38.05 3igv h ILE 412 CO 0.05 0.22 0.45 0.40 0.00 0.00 0.00 178.15 179.26 3igv h ILE 413 N 0.09 1.14 0.00 -0.67 2.04 -0.68 0.86 117.51 120.30 3igv h ILE 413 Ca 0.06 -0.31 -0.11 0.00 1.00 0.00 0.00 64.86 65.49 3igv h ILE 413 Cb 0.30 0.16 -0.02 0.00 -0.74 0.00 0.00 36.82 36.53 3igv h ILE 413 CO 0.00 0.16 -1.07 0.24 0.00 0.00 0.00 178.15 177.49 3igv h MET 414 N 0.90 0.00 0.00 2.37 2.86 -1.05 -3.37 114.93 116.65 3igv h MET 414 Ca 0.26 0.00 -0.00 0.00 -2.06 0.00 0.00 59.70 57.90 3igv h MET 414 Cb -0.06 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.59 3igv h MET 414 CO -0.08 0.26 -0.24 0.66 1.06 0.00 0.00 176.91 178.57 3igv n TYR 415 N -2.92 0.00 -0.33 -0.22 4.01 0.75 -4.85 117.16 113.60 3igv n TYR 415 Ca -0.04 -1.15 0.20 0.00 -0.16 0.00 0.00 57.90 56.74 3igv n TYR 415 Cb 0.74 -0.19 0.41 0.00 -0.31 0.00 0.00 39.34 39.99 3igv n TYR 415 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 3igv h ALA 416 N 0.43 1.74 0.00 -0.72 0.00 -0.96 -0.31 119.26 119.43 3igv h ALA 416 Ca -0.01 0.19 0.00 0.00 0.00 0.00 0.00 54.91 55.09 3igv h ALA 416 Cb 1.04 0.17 0.00 0.00 0.00 0.00 0.00 17.79 19.00 3igv h ALA 416 CO 0.00 -0.49 0.00 -1.35 0.00 0.00 0.00 179.25 177.41 3igv h PRO 417 N 0.34 0.00 -7.25 0.00 0.11 -1.86 -3.40 132.00 119.93 3igv h PRO 417 Ca 0.67 0.00 -0.50 0.00 0.11 0.00 0.00 66.00 66.28 3igv h PRO 417 Cb 1.45 0.00 0.09 0.00 0.11 0.00 0.00 31.00 32.65 3igv h PRO 417 CO -0.60 0.00 0.36 0.95 -0.21 0.00 0.00 178.00 178.51 3igv s THR 418 N -3.34 3.63 0.20 -1.15 -4.23 -0.13 -4.93 115.64 105.68 3igv s THR 418 Ca 0.04 0.67 -0.08 0.00 -1.18 0.00 0.00 61.69 61.14 3igv s THR 418 Cb 0.09 -3.23 0.09 0.00 1.34 0.00 0.00 72.50 70.79 3igv s THR 418 CO 0.43 -0.55 1.67 0.25 -0.54 0.00 0.00 174.62 175.88 3igv h LEU 419 N -0.19 1.04 0.00 4.79 5.85 -1.89 -2.69 115.31 122.21 3igv h LEU 419 Ca -0.46 -0.27 -0.20 0.00 0.84 0.00 0.00 57.88 57.79 3igv h LEU 419 Cb 1.23 -0.28 -0.03 0.00 0.37 0.00 0.00 40.66 41.95 3igv h LEU 419 CO 0.55 1.06 -1.00 4.11 -0.34 0.00 0.00 178.44 182.82 3igv h TRP 420 N 0.99 0.00 0.01 1.25 5.08 -1.93 -2.46 115.95 118.89 3igv h TRP 420 Ca 0.18 0.00 -0.19 0.00 1.08 0.00 0.00 58.89 59.96 3igv h TRP 420 Cb 0.51 0.00 -0.02 0.00 -3.00 0.00 0.00 29.16 26.65 3igv h TRP 420 CO 0.04 0.90 -0.88 0.00 -1.28 0.00 0.00 178.44 177.21 3igv h ALA 421 N 1.10 0.54 0.00 0.11 0.00 -1.81 -2.67 119.26 116.54 3igv h ALA 421 Ca -0.04 -0.76 -0.00 0.00 0.00 0.00 0.00 54.91 54.10 3igv h ALA 421 Cb 1.72 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 19.41 3igv h ALA 421 CO 0.11 1.01 -0.00 0.00 0.00 0.00 0.00 179.25 180.37 3igv h ARG 422 N 0.04 -0.00 0.10 0.00 3.08 -1.51 -1.23 114.38 114.86 3igv h ARG 422 Ca -0.03 0.00 -0.27 0.00 0.07 0.00 0.00 59.98 59.75 3igv h ARG 422 Cb 1.54 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 31.58 3igv h ARG 422 CO 0.12 0.91 -1.29 0.52 -1.07 0.00 0.00 179.97 179.17 3igv h MET 423 N -0.97 0.22 0.00 0.04 2.86 -1.58 -3.34 114.93 112.15 3igv h MET 423 Ca -0.00 -0.38 -0.03 0.00 -2.06 0.00 0.00 59.70 57.23 3igv h MET 423 Cb 0.92 0.14 -0.00 0.00 0.06 0.00 0.00 31.60 32.71 3igv h MET 423 CO 0.00 1.14 -1.00 -0.89 1.06 0.00 0.00 176.91 177.22 3igv n ILE 424 N -3.47 1.47 -0.05 -1.22 5.41 -1.03 -4.29 119.36 116.16 3igv n ILE 424 Ca -0.09 0.13 -0.11 0.00 1.00 0.00 0.00 62.75 63.68 3igv n ILE 424 Cb 1.02 -2.24 -0.04 0.00 -0.71 0.00 0.00 39.64 37.66 3igv n ILE 424 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 176.55 176.48 3igv h LEU 425 N -0.90 0.26 -0.16 1.39 3.38 -1.46 -1.05 115.31 116.77 3igv h LEU 425 Ca -0.04 -0.14 -0.01 0.00 0.09 0.00 0.00 57.88 57.77 3igv h LEU 425 Cb 0.94 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.62 3igv h LEU 425 CO -0.03 0.33 0.04 0.24 0.09 0.00 0.00 178.44 179.12 3igv h MET 426 N 0.17 0.25 -0.21 1.13 2.86 -1.34 -2.79 114.93 115.01 3igv h MET 426 Ca 0.07 -0.06 -0.00 0.00 -2.06 0.00 0.00 59.70 57.65 3igv h MET 426 Cb 0.15 -0.03 -0.01 0.00 0.06 0.00 0.00 31.60 31.76 3igv h MET 426 CO -0.01 0.39 0.13 1.15 1.06 0.00 0.00 176.91 179.63 3igv h THR 427 N 0.06 1.07 -0.05 2.22 2.02 -1.66 -1.84 112.91 114.74 3igv h THR 427 Ca 0.05 -0.17 -0.00 0.00 0.77 0.00 0.00 66.41 67.06 3igv h THR 427 Cb 0.25 0.81 -0.00 0.00 -1.74 0.00 0.00 68.15 67.47 3igv h THR 427 CO -0.00 0.07 0.02 -0.74 0.37 0.00 0.00 175.52 175.24 3igv h HIS 428 N 0.26 0.08 0.09 3.16 6.17 -1.23 -2.65 115.15 121.04 3igv h HIS 428 Ca 0.08 -0.01 -0.27 0.00 0.71 0.00 0.00 60.37 60.88 3igv h HIS 428 Cb 0.00 -0.02 0.01 0.00 2.52 0.00 0.00 27.41 29.92 3igv h HIS 428 CO -0.05 0.25 -1.16 0.74 0.71 0.00 0.00 177.93 178.41 3igv h PHE 429 N -0.11 0.68 -0.34 5.26 0.04 -1.49 -2.40 116.94 118.58 3igv h PHE 429 Ca 0.02 -0.44 -0.05 0.00 2.80 0.00 0.00 57.97 60.30 3igv h PHE 429 Cb 0.20 -0.05 -0.02 0.00 2.20 0.00 0.00 35.95 38.29 3igv h PHE 429 CO -0.01 1.30 -0.01 0.74 -0.60 0.00 0.00 178.31 179.74 3igv h PHE 430 N 0.17 0.55 -0.41 -0.55 0.04 -1.43 0.39 116.94 115.71 3igv h PHE 430 Ca -0.14 -0.06 0.04 0.00 2.80 0.00 0.00 57.97 60.62 3igv h PHE 430 Cb 1.84 -0.16 -0.04 0.00 2.20 0.00 0.00 35.95 39.79 3igv h PHE 430 CO 0.08 0.55 0.17 1.03 -0.60 0.00 0.00 178.31 179.54 3igv h SER 431 N 0.51 0.21 -0.44 2.17 0.87 -1.35 -0.78 113.55 114.75 3igv h SER 431 Ca 0.11 0.04 -0.05 0.00 -1.23 0.00 0.00 61.79 60.66 3igv h SER 431 Cb 0.34 0.01 -0.02 0.00 -0.44 0.00 0.00 62.40 62.29 3igv h SER 431 CO 0.01 0.16 0.10 0.40 -0.53 0.00 0.00 176.83 176.97 3igv h ILE 432 N 0.35 1.24 -0.16 2.23 2.04 -0.83 -2.69 117.51 119.67 3igv h ILE 432 Ca 0.18 -0.83 -0.09 0.00 1.00 0.00 0.00 64.86 65.13 3igv h ILE 432 Cb 0.14 0.94 -0.01 0.00 -0.74 0.00 0.00 36.82 37.15 3igv h ILE 432 CO -0.17 0.29 -0.28 -0.07 0.00 0.00 0.00 178.15 177.93 3igv h LEU 433 N 0.58 0.31 -0.12 1.44 3.38 -0.76 -2.60 115.31 117.53 3igv h LEU 433 Ca 0.14 -0.10 -0.03 0.00 0.09 0.00 0.00 57.88 57.98 3igv h LEU 433 Cb 0.33 -0.08 -0.00 0.00 0.09 0.00 0.00 40.66 41.00 3igv h LEU 433 CO 0.00 0.59 -0.03 -0.07 0.09 0.00 0.00 178.44 179.02 3igv h LEU 434 N 0.27 0.23 -1.93 1.67 3.38 -1.05 0.99 115.31 118.86 3igv h LEU 434 Ca 0.04 -0.37 -0.02 0.00 0.09 0.00 0.00 57.88 57.62 3igv h LEU 434 Cb 0.64 -0.06 -0.00 0.00 0.09 0.00 0.00 40.66 41.32 3igv h LEU 434 CO 0.05 0.54 -0.09 0.00 0.09 0.00 0.00 178.44 179.03 3igv h ALA 435 N 0.69 1.70 0.00 1.53 0.00 -1.37 -1.89 119.26 119.93 3igv h ALA 435 Ca 0.03 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.86 3igv h ALA 435 Cb 0.44 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.22 3igv h ALA 435 CO 0.01 0.11 -0.88 1.04 0.00 0.00 0.00 179.25 179.54 3igv n GLN 436 N -4.20 0.14 -3.51 0.00 1.13 -0.99 -4.98 117.38 104.96 3igv n GLN 436 Ca -0.03 -0.00 -0.19 0.00 -1.94 0.00 0.00 57.00 54.85 3igv n GLN 436 Cb 0.17 -1.54 0.07 0.00 0.11 0.00 0.00 30.24 29.04 3igv n GLN 436 CO 0.00 0.00 0.00 0.39 -1.44 0.00 0.00 177.06 176.01 3igv n GLU 437 N -1.72 -5.67 -1.04 -1.09 1.02 -0.34 -4.95 120.64 106.85 3igv n GLU 437 Ca 0.03 0.77 -0.03 0.00 -0.02 0.00 0.00 57.16 57.92 3igv n GLU 437 Cb 0.38 -5.61 0.15 0.00 -0.02 0.00 0.00 31.44 26.34 3igv n GLU 437 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 3igv n GLN 438 N -4.11 2.16 -0.13 3.49 6.02 0.20 -4.74 117.38 120.26 3igv n GLN 438 Ca -0.27 -3.54 -0.07 0.00 -0.01 0.00 0.00 57.00 53.10 3igv n GLN 438 Cb 0.67 -1.79 0.09 0.00 1.02 0.00 0.00 30.24 30.23 3igv n GLN 438 CO 0.00 0.00 0.00 -0.07 -1.01 0.00 0.00 177.06 175.98 3igv h LEU 439 N 1.35 0.86 -0.00 1.08 3.38 -1.93 -2.95 115.31 117.09 3igv h LEU 439 Ca 0.10 -0.26 0.00 0.00 0.09 0.00 0.00 57.88 57.81 3igv h LEU 439 Cb 1.17 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 41.69 3igv h LEU 439 CO 0.22 0.97 0.00 -0.62 0.09 0.00 0.00 178.44 179.11 3igv n GLU 440 N -4.16 0.00 -2.57 1.13 -0.58 -1.26 -4.04 120.64 109.17 3igv n GLU 440 Ca 0.02 0.06 -0.43 0.00 -0.42 0.00 0.00 57.16 56.39 3igv n GLU 440 Cb 0.37 -1.51 -0.02 0.00 -0.57 0.00 0.00 31.44 29.71 3igv n GLU 440 CO 0.00 0.00 0.00 0.21 -0.48 0.00 0.00 177.13 176.86 3igv s LYS 441 N -3.00 4.35 0.12 3.49 2.20 -1.12 -4.92 119.74 120.85 3igv s LYS 441 Ca 0.12 1.52 -0.31 0.00 -0.36 0.00 0.00 55.97 56.95 3igv s LYS 441 Cb 0.17 -3.59 -0.08 0.00 -1.51 0.00 0.00 37.83 32.82 3igv s LYS 441 CO 0.47 -0.47 1.33 0.00 -0.36 0.00 0.00 175.35 176.32 3igv s ALA 442 N 2.48 3.53 0.06 3.13 0.00 -1.26 -4.39 121.76 125.30 3igv s ALA 442 Ca 0.51 1.05 0.09 0.00 0.00 0.00 0.00 51.96 53.62 3igv s ALA 442 Cb -0.20 -3.50 -0.03 0.00 0.00 0.00 0.00 23.12 19.38 3igv s ALA 442 CO 0.17 -0.55 -0.26 -0.51 0.00 0.00 0.00 175.76 174.61 3igv s LEU 443 N 0.82 2.21 -0.06 0.00 1.43 0.18 -4.83 118.68 118.44 3igv s LEU 443 Ca 0.61 -0.61 -0.19 0.00 -1.03 0.00 0.00 54.13 52.92 3igv s LEU 443 Cb -0.35 -1.29 -0.05 0.00 0.03 0.00 0.00 46.19 44.54 3igv s LEU 443 CO 0.32 0.25 0.52 -1.81 0.23 0.00 0.00 176.35 175.85 3igv s ASP 444 N -1.39 6.81 0.26 2.29 1.01 -1.26 0.98 116.67 125.38 3igv s ASP 444 Ca 0.12 0.97 -0.07 0.00 0.71 0.00 0.00 52.55 54.28 3igv s ASP 444 Cb -0.10 -2.31 -0.01 0.00 1.01 0.00 0.00 42.92 41.50 3igv s ASP 444 CO 0.03 0.07 0.39 0.00 0.21 0.00 0.00 175.17 175.86 3igv s GLN 446 N -3.77 3.22 -0.17 0.00 -0.21 -1.26 -0.14 119.66 117.33 3igv s GLN 446 Ca 0.29 -0.77 0.01 0.00 0.02 0.00 0.00 55.36 54.91 3igv s GLN 446 Cb 0.01 -2.52 0.03 0.00 1.00 0.00 0.00 33.01 31.53 3igv s GLN 446 CO 0.13 0.13 -0.15 0.42 -2.12 0.00 0.00 175.29 173.71 3igv s ILE 447 N 0.51 1.70 -1.53 1.08 1.01 -0.32 -4.77 121.20 118.88 3igv s ILE 447 Ca -0.11 -0.79 -0.12 0.00 0.00 0.00 0.00 60.65 59.62 3igv s ILE 447 Cb -0.16 -1.62 0.08 0.00 0.01 0.00 0.00 42.46 40.77 3igv s ILE 447 CO 0.05 0.41 0.89 -1.22 0.00 0.00 0.00 174.94 175.06 3igv n TYR 448 N 4.72 -2.13 0.00 3.97 4.01 -1.26 -1.83 117.16 124.64 3igv n TYR 448 Ca -0.17 0.87 0.00 0.00 -0.16 0.00 0.00 57.90 58.44 3igv n TYR 448 Cb 0.49 -3.83 0.00 0.00 -0.31 0.00 0.00 39.34 35.69 3igv n TYR 448 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3igv n GLY 449 N -1.65 3.15 3.83 2.72 0.00 -1.26 -0.21 105.19 111.76 3igv n GLY 449 Ca -0.01 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.65 3igv n GLY 449 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3igv s ALA 450 N -1.85 3.50 -0.03 4.61 0.00 -0.76 -4.46 121.76 122.78 3igv s ALA 450 Ca 0.00 0.02 -0.18 0.00 0.00 0.00 0.00 51.96 51.81 3igv s ALA 450 Cb 0.00 -2.67 -0.05 0.00 0.00 0.00 0.00 23.12 20.40 3igv s ALA 450 CO 0.00 0.39 0.49 0.00 0.00 0.00 0.00 175.76 176.64 3igv s TYR 452 N -0.36 0.97 -0.40 0.00 2.02 0.81 -1.61 117.35 118.79 3igv s TYR 452 Ca 0.27 -0.31 -0.26 0.00 -0.37 0.00 0.00 57.07 56.39 3igv s TYR 452 Cb -0.17 -0.79 0.02 0.00 -0.40 0.00 0.00 41.96 40.62 3igv s TYR 452 CO 0.14 -0.22 0.95 0.45 -1.57 0.00 0.00 175.55 175.30 3igv s SER 453 N 0.85 6.65 -0.08 2.29 0.15 -1.26 -1.29 113.70 121.01 3igv s SER 453 Ca -0.12 0.49 0.04 0.00 0.70 0.00 0.00 55.95 57.06 3igv s SER 453 Cb -0.15 -2.47 0.00 0.00 -1.71 0.00 0.00 66.02 61.69 3igv s SER 453 CO 0.01 -0.94 -0.20 -0.63 1.20 0.00 0.00 173.24 172.68 3igv s ILE 454 N 3.63 1.72 -0.22 6.45 -1.09 0.27 -4.85 121.20 127.12 3igv s ILE 454 Ca 0.39 -0.84 -0.23 0.00 -2.23 0.00 0.00 60.65 57.74 3igv s ILE 454 Cb -0.11 -1.49 -0.01 0.00 -1.58 0.00 0.00 42.46 39.26 3igv s ILE 454 CO 0.21 0.49 0.76 -1.61 -1.23 0.00 0.00 174.94 173.56 3igv s GLU 455 N 0.29 4.20 0.51 2.79 2.02 -1.26 0.51 118.70 127.75 3igv s GLU 455 Ca -0.13 0.83 0.26 0.00 0.02 0.00 0.00 54.97 55.95 3igv s GLU 455 Cb -0.16 -3.62 1.36 0.00 0.10 0.00 0.00 34.13 31.81 3igv s GLU 455 CO 0.06 -0.41 1.92 -1.35 0.02 0.00 0.00 175.26 175.50 3igv h PRO 456 N 7.62 0.10 0.00 0.39 0.11 -1.77 -0.42 132.00 138.02 3igv h PRO 456 Ca -0.26 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.84 3igv h PRO 456 Cb 1.11 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.20 3igv h PRO 456 CO 0.83 0.06 0.00 1.28 -0.21 0.00 0.00 178.00 179.96 3igv n LEU 457 N -4.36 0.15 -0.41 2.35 4.77 -1.26 -1.71 117.00 116.53 3igv n LEU 457 Ca 0.15 0.54 0.13 0.00 -0.03 0.00 0.00 56.01 56.81 3igv n LEU 457 Cb 0.76 -0.53 0.38 0.00 -2.33 0.00 0.00 43.42 41.71 3igv n LEU 457 CO 0.36 -0.36 0.70 0.47 -1.33 0.00 0.00 177.39 177.24 3igv n ASP 458 N -1.67 1.44 -0.20 -1.43 10.43 -0.17 -4.43 116.55 120.52 3igv n ASP 458 Ca 0.03 -1.26 0.01 0.00 2.57 0.00 0.00 54.79 56.13 3igv n ASP 458 Cb 0.16 0.10 0.11 0.00 1.84 0.00 0.00 41.12 43.33 3igv n ASP 458 CO 0.00 0.00 0.00 -0.07 -1.07 0.00 0.00 177.20 176.06 3igv h LEU 459 N 2.02 0.01 -0.53 0.64 3.38 -1.46 0.16 115.31 119.53 3igv h LEU 459 Ca 0.00 0.11 0.05 0.00 0.09 0.00 0.00 57.88 58.14 3igv h LEU 459 Cb 0.56 0.15 -0.05 0.00 0.09 0.00 0.00 40.66 41.42 3igv h LEU 459 CO 0.00 0.01 0.25 -0.65 0.09 0.00 0.00 178.44 178.14 3igv h PRO 460 N 0.26 0.47 -0.46 1.13 0.11 -1.82 0.07 132.00 131.76 3igv h PRO 460 Ca 0.32 -0.03 -0.07 0.00 0.11 0.00 0.00 66.00 66.33 3igv h PRO 460 Cb 0.48 -0.11 -0.02 0.00 0.11 0.00 0.00 31.00 31.46 3igv h PRO 460 CO -0.41 0.31 0.00 1.96 -0.21 0.00 0.00 178.00 179.66 3igv h GLN 461 N 0.48 0.75 -0.32 1.05 7.50 -1.68 -1.86 115.11 121.03 3igv h GLN 461 Ca 0.24 -0.19 -0.04 0.00 0.50 0.00 0.00 58.65 59.16 3igv h GLN 461 Cb 0.18 -0.09 -0.01 0.00 0.05 0.00 0.00 27.48 27.60 3igv h GLN 461 CO -0.19 0.76 0.05 0.82 -1.50 0.00 0.00 178.83 178.78 3igv h ILE 462 N 0.71 1.24 -0.36 2.54 2.04 -0.45 -2.90 117.51 120.31 3igv h ILE 462 Ca 0.14 -0.82 -0.13 0.00 1.00 0.00 0.00 64.86 65.05 3igv h ILE 462 Cb 0.43 1.15 -0.01 0.00 -0.74 0.00 0.00 36.82 37.64 3igv h ILE 462 CO 0.02 0.27 -0.29 0.40 0.00 0.00 0.00 178.15 178.55 3igv h ILE 463 N 0.37 1.28 -0.77 -0.67 2.04 -0.80 -1.90 117.51 117.06 3igv h ILE 463 Ca 0.10 -1.43 0.04 0.00 1.00 0.00 0.00 64.86 64.57 3igv h ILE 463 Cb 0.35 1.31 -0.04 0.00 -0.74 0.00 0.00 36.82 37.70 3igv h ILE 463 CO 0.01 0.47 0.51 -0.08 0.00 0.00 0.00 178.15 179.05 3igv h GLU 464 N 0.65 0.90 0.05 2.37 4.81 -1.34 -0.87 114.58 121.15 3igv h GLU 464 Ca 0.08 -0.05 -0.24 0.00 -0.13 0.00 0.00 59.36 59.01 3igv h GLU 464 Cb 0.82 -0.20 -0.02 0.00 0.63 0.00 0.00 28.75 29.98 3igv h GLU 464 CO 0.07 0.59 -1.15 0.00 -0.73 0.00 0.00 179.01 177.79 3igv h ARG 465 N 0.92 0.11 0.00 1.92 2.47 -1.24 -2.05 114.38 116.51 3igv h ARG 465 Ca 0.31 -0.19 -0.02 0.00 -1.26 0.00 0.00 59.98 58.82 3igv h ARG 465 Cb 0.08 0.07 -0.00 0.00 -1.65 0.00 0.00 29.97 28.46 3igv h ARG 465 CO -0.09 1.06 -1.48 1.28 0.56 0.00 0.00 179.97 181.30 3igv n LEU 466 N -3.41 0.48 0.00 3.04 4.77 -0.75 -4.62 117.00 116.52 3igv n LEU 466 Ca -0.05 0.19 0.00 0.00 -0.03 0.00 0.00 56.01 56.12 3igv n LEU 466 Cb 0.98 -0.01 0.00 0.00 -2.33 0.00 0.00 43.42 42.06 3igv n LEU 466 CO 0.50 -0.07 -0.26 1.41 -1.33 0.00 0.00 177.39 177.64 3igv n HIS 467 N -2.53 0.00 0.00 -1.77 8.25 -0.34 -1.79 115.22 117.04 3igv n HIS 467 Ca -0.03 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.43 3igv n HIS 467 Cb 0.60 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.71 3igv n HIS 467 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3igv n GLY 468 N 1.33 -1.05 0.37 -1.41 0.00 -0.77 -4.60 105.19 99.05 3igv n GLY 468 Ca 0.00 -1.60 0.16 0.00 0.00 0.00 0.00 46.02 44.57 3igv n GLY 468 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3igv h LEU 469 N 0.00 0.27 -2.00 0.99 3.38 -1.86 -2.63 115.31 113.45 3igv h LEU 469 Ca 0.00 0.01 0.11 0.00 0.09 0.00 0.00 57.88 58.09 3igv h LEU 469 Cb 0.00 -0.04 -0.02 0.00 0.09 0.00 0.00 40.66 40.69 3igv h LEU 469 CO 0.00 0.15 0.41 0.77 0.09 0.00 0.00 178.44 179.86 3igv h SER 470 N 0.29 0.00 -0.20 -0.43 4.64 -1.97 -0.52 113.55 115.36 3igv h SER 470 Ca 0.30 0.00 0.06 0.00 -0.47 0.00 0.00 61.79 61.68 3igv h SER 470 Cb 0.78 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.87 3igv h SER 470 CO -0.07 0.00 0.15 0.00 -0.87 0.00 0.00 176.83 176.04 3igv h ALA 471 N 1.53 2.13 0.00 5.18 0.00 -1.72 0.47 119.26 126.84 3igv h ALA 471 Ca 0.18 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.08 3igv h ALA 471 Cb 1.01 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.81 3igv h ALA 471 CO -0.00 -0.25 -0.17 1.19 0.00 0.00 0.00 179.25 180.02 3igv n PHE 472 N -4.37 0.10 0.23 0.00 3.72 -0.20 -3.99 117.46 112.95 3igv n PHE 472 Ca 0.02 0.03 0.05 0.00 -0.05 0.00 0.00 57.45 57.50 3igv n PHE 472 Cb 0.29 -0.47 -0.08 0.00 -0.94 0.00 0.00 39.48 38.28 3igv n PHE 472 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 176.76 177.14 3igv n SER 473 N -1.59 1.56 -4.58 4.37 7.64 0.04 -4.47 113.62 116.59 3igv n SER 473 Ca 0.06 -0.34 -0.49 0.00 1.01 0.00 0.00 58.87 59.11 3igv n SER 473 Cb 0.35 1.28 -0.04 0.00 -1.01 0.00 0.00 64.21 64.79 3igv n SER 473 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 3igv n LEU 474 N -1.61 1.52 -3.99 -3.43 4.77 -0.50 -4.49 117.00 109.27 3igv n LEU 474 Ca -0.00 1.14 -0.12 0.00 -0.03 0.00 0.00 56.01 57.00 3igv n LEU 474 Cb 0.24 -1.21 -0.03 0.00 -2.33 0.00 0.00 43.42 40.09 3igv n LEU 474 CO 0.23 -1.28 0.25 -1.38 -1.33 0.00 0.00 177.39 173.88 3igv s HIS 475 N -0.12 0.65 -0.96 -1.77 -3.43 0.24 -4.98 115.29 104.92 3igv s HIS 475 Ca 0.75 -1.02 -0.10 0.00 -0.80 0.00 0.00 55.06 53.89 3igv s HIS 475 Cb -0.87 0.22 -0.01 0.00 -1.43 0.00 0.00 32.58 30.49 3igv s HIS 475 CO 0.52 -1.22 0.75 0.43 -2.00 0.00 0.00 174.74 173.22 3igv n SER 476 N -1.16 -6.11 -4.80 7.38 7.64 -1.26 -1.06 113.62 114.25 3igv n SER 476 Ca -0.02 -0.71 -0.32 0.00 1.01 0.00 0.00 58.87 58.83 3igv n SER 476 Cb 0.61 -3.84 0.04 0.00 -1.01 0.00 0.00 64.21 60.01 3igv n SER 476 CO 0.00 0.00 0.00 -0.31 -3.01 0.00 0.00 175.04 171.72 3igv s TYR 477 N -3.24 2.90 0.49 1.43 2.02 -1.26 -4.08 117.35 115.61 3igv s TYR 477 Ca 0.26 1.50 -0.23 0.00 -0.37 0.00 0.00 57.07 58.23 3igv s TYR 477 Cb -0.08 -3.01 -0.06 0.00 -0.40 0.00 0.00 41.96 38.40 3igv s TYR 477 CO 0.82 -1.33 1.26 -1.54 -1.57 0.00 0.00 175.55 173.19 3igv s SER 478 N -3.05 5.82 0.33 2.29 1.04 -1.24 -4.84 113.70 114.05 3igv s SER 478 Ca 0.63 2.53 0.10 0.00 0.48 0.00 0.00 55.95 59.69 3igv s SER 478 Cb -0.17 -2.62 0.88 0.00 0.10 0.00 0.00 66.02 64.22 3igv s SER 478 CO 0.44 -1.18 1.76 -0.65 0.98 0.00 0.00 173.24 174.59 3igv h PRO 479 N 1.87 0.59 -0.54 4.02 0.11 -1.96 -1.19 132.00 134.91 3igv h PRO 479 Ca -0.50 -0.04 -0.12 0.00 0.11 0.00 0.00 66.00 65.46 3igv h PRO 479 Cb 1.27 -0.13 -0.02 0.00 0.11 0.00 0.00 31.00 32.23 3igv h PRO 479 CO 0.59 0.39 -0.13 0.78 -0.21 0.00 0.00 178.00 179.42 3igv h GLY 480 N 0.60 1.13 0.71 -0.55 0.00 -1.99 -1.12 103.07 101.85 3igv h GLY 480 Ca 0.60 -0.93 -0.01 0.00 0.00 0.00 0.00 47.33 46.99 3igv h GLY 480 CO -0.39 0.85 -0.01 -2.09 0.00 0.00 0.00 176.54 174.90 3igv h GLU 481 N 0.92 0.12 -0.74 4.80 4.57 -1.83 -2.86 114.58 119.55 3igv h GLU 481 Ca 0.14 -0.04 0.08 0.00 -1.18 0.00 0.00 59.36 58.36 3igv h GLU 481 Cb 0.71 -0.01 -0.07 0.00 -0.16 0.00 0.00 28.75 29.22 3igv h GLU 481 CO 0.05 0.42 0.41 0.82 -1.18 0.00 0.00 179.01 179.53 3igv h ILE 482 N -0.19 0.92 -0.78 2.32 2.04 -1.18 -1.01 117.51 119.62 3igv h ILE 482 Ca 0.02 -0.24 -0.02 0.00 1.00 0.00 0.00 64.86 65.61 3igv h ILE 482 Cb 0.37 0.15 -0.04 0.00 -0.74 0.00 0.00 36.82 36.56 3igv h ILE 482 CO 0.00 0.13 0.39 0.78 0.00 0.00 0.00 178.15 179.45 3igv h ASN 483 N 0.71 1.00 -0.17 1.72 2.35 -1.22 -0.55 115.58 119.42 3igv h ASN 483 Ca 0.35 -0.10 -0.12 0.00 -0.55 0.00 0.00 56.30 55.88 3igv h ASN 483 Cb 0.30 -0.25 0.00 0.00 0.05 0.00 0.00 38.32 38.41 3igv h ASN 483 CO -0.23 0.83 -0.35 -0.09 -1.65 0.00 0.00 177.43 175.94 3igv h ARG 484 N 1.10 0.53 -0.13 0.81 2.43 -1.15 -1.02 114.38 116.95 3igv h ARG 484 Ca 0.27 -0.35 -0.00 0.00 -0.81 0.00 0.00 59.98 59.09 3igv h ARG 484 Cb 0.08 0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 29.67 3igv h ARG 484 CO -0.04 0.96 0.08 0.28 -1.51 0.00 0.00 179.97 179.74 3igv h VAL 485 N 0.17 1.07 -0.60 0.20 2.07 -1.11 -2.19 116.25 115.85 3igv h VAL 485 Ca 0.00 -0.18 -0.04 0.00 0.82 0.00 0.00 66.70 67.30 3igv h VAL 485 Cb 0.95 0.96 -0.03 0.00 -1.52 0.00 0.00 31.29 31.65 3igv h VAL 485 CO 0.08 0.06 0.22 0.00 0.02 0.00 0.00 177.57 177.95 3igv h ALA 486 N 1.00 0.79 -0.26 1.67 0.00 -1.12 -2.70 119.26 118.64 3igv h ALA 486 Ca 0.05 -0.19 -0.02 0.00 0.00 0.00 0.00 54.91 54.75 3igv h ALA 486 Cb 0.04 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.58 3igv h ALA 486 CO -0.01 0.43 0.07 1.03 0.00 0.00 0.00 179.25 180.77 3igv h SER 487 N 0.85 0.33 -0.34 0.00 0.87 -1.12 -2.36 113.55 111.78 3igv h SER 487 Ca 0.20 -0.03 -0.08 0.00 -1.23 0.00 0.00 61.79 60.65 3igv h SER 487 Cb 0.25 -0.08 -0.01 0.00 -0.44 0.00 0.00 62.40 62.11 3igv h SER 487 CO -0.01 0.34 -0.10 0.00 -0.53 0.00 0.00 176.83 176.53 3igv h LEU 489 N 0.44 1.05 -0.37 0.00 3.38 -1.17 -0.59 115.31 118.06 3igv h LEU 489 Ca 0.08 -0.31 0.00 0.00 0.09 0.00 0.00 57.88 57.75 3igv h LEU 489 Cb 0.60 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 41.05 3igv h LEU 489 CO 0.04 1.11 0.24 0.03 0.09 0.00 0.00 178.44 179.95 3igv h ARG 490 N 0.96 0.49 -0.30 1.13 3.08 -1.49 0.26 114.38 118.52 3igv h ARG 490 Ca 0.17 -0.03 -0.00 0.00 0.07 0.00 0.00 59.98 60.18 3igv h ARG 490 Cb 0.59 -0.11 -0.01 0.00 0.08 0.00 0.00 29.97 30.52 3igv h ARG 490 CO 0.04 0.33 0.19 -0.22 -1.07 0.00 0.00 179.97 179.24 3igv h LYS 491 N 0.50 0.40 0.00 0.04 3.64 -1.29 -3.22 116.57 116.64 3igv h LYS 491 Ca 0.13 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.48 3igv h LYS 491 Cb -0.04 -0.09 0.00 0.00 -0.41 0.00 0.00 32.23 31.69 3igv h LYS 491 CO -0.03 0.30 -0.48 1.28 -2.27 0.00 0.00 179.45 178.25 3igv n LEU 492 N -4.86 0.74 -1.56 5.20 4.77 -0.24 -4.86 117.00 116.19 3igv n LEU 492 Ca -0.01 0.31 -0.09 0.00 -0.03 0.00 0.00 56.01 56.18 3igv n LEU 492 Cb 0.04 -0.21 0.02 0.00 -2.33 0.00 0.00 43.42 40.95 3igv n LEU 492 CO 0.34 -0.09 0.05 0.61 -1.33 0.00 0.00 177.39 176.98 3igv n GLY 493 N 1.33 0.27 3.74 -0.72 0.00 0.80 -1.96 105.19 108.65 3igv n GLY 493 Ca 0.04 -0.36 -0.40 0.00 0.00 0.00 0.00 46.02 45.30 3igv n GLY 493 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3igv s VAL 494 N -2.96 4.79 0.48 1.61 1.01 -0.43 -1.06 120.40 123.83 3igv s VAL 494 Ca 0.18 1.56 -0.22 0.00 0.00 0.00 0.00 61.98 63.50 3igv s VAL 494 Cb -0.08 -4.08 -0.09 0.00 0.00 0.00 0.00 36.38 32.12 3igv s VAL 494 CO 0.22 0.36 0.92 -2.65 0.00 0.00 0.00 175.10 173.95 3igv n PRO 495 N 2.91 1.12 -0.74 2.72 -0.02 -1.26 -4.65 135.00 135.09 3igv n PRO 495 Ca -0.03 0.41 -0.32 0.00 -2.02 0.00 0.00 63.50 61.54 3igv n PRO 495 Cb 0.50 -2.01 0.15 0.00 -0.02 0.00 0.00 33.50 32.13 3igv n PRO 495 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 3igv n PRO 496 N -0.11 -0.37 0.05 0.52 -0.04 -1.26 -4.82 135.00 128.97 3igv n PRO 496 Ca 0.11 -0.05 0.10 0.00 -0.04 0.00 0.00 63.50 63.62 3igv n PRO 496 Cb 0.42 -2.23 0.42 0.00 -0.04 0.00 0.00 33.50 32.07 3igv n PRO 496 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 3igv n LEU 497 N -3.33 0.27 0.10 1.53 4.77 -1.26 -1.64 117.00 117.44 3igv n LEU 497 Ca 0.11 0.55 -0.04 0.00 -0.03 0.00 0.00 56.01 56.60 3igv n LEU 497 Cb 0.52 -0.50 0.02 0.00 -2.33 0.00 0.00 43.42 41.13 3igv n LEU 497 CO 0.49 -0.29 0.31 0.08 -1.33 0.00 0.00 177.39 176.66 3igv h ARG 498 N 0.00 0.00 -0.34 3.23 0.11 -2.00 -2.57 114.38 112.81 3igv h ARG 498 Ca 0.00 0.00 -0.17 0.00 0.10 0.00 0.00 59.98 59.91 3igv h ARG 498 Cb 0.37 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 31.45 3igv h ARG 498 CO 0.00 0.81 -0.44 0.28 0.10 0.00 0.00 179.97 180.71 3igv h VAL 499 N 0.00 1.27 -0.33 0.08 2.07 -1.66 -2.87 116.25 114.81 3igv h VAL 499 Ca -0.01 -1.62 -0.10 0.00 0.82 0.00 0.00 66.70 65.80 3igv h VAL 499 Cb 1.45 1.48 -0.02 0.00 -1.52 0.00 0.00 31.29 32.68 3igv h VAL 499 CO 0.10 0.54 -0.20 -0.50 0.02 0.00 0.00 177.57 177.54 3igv h TRP 500 N 0.71 0.69 -0.47 1.57 4.06 -1.53 -1.77 115.95 119.20 3igv h TRP 500 Ca 0.04 -0.14 -0.02 0.00 2.06 0.00 0.00 58.89 60.84 3igv h TRP 500 Cb 1.03 -0.17 -0.02 0.00 -1.00 0.00 0.00 29.16 29.00 3igv h TRP 500 CO 0.06 0.77 0.21 -0.09 -3.56 0.00 0.00 178.44 175.83 3igv h ARG 501 N 0.55 0.68 -0.26 0.49 2.43 -1.45 0.39 114.38 117.22 3igv h ARG 501 Ca 0.09 -0.11 0.00 0.00 -0.81 0.00 0.00 59.98 59.15 3igv h ARG 501 Cb 0.64 -0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 30.06 3igv h ARG 501 CO 0.05 0.59 0.17 1.25 -1.51 0.00 0.00 179.97 180.51 3igv h HIS 502 N 0.61 0.33 -0.59 2.20 2.76 -1.27 -1.56 115.15 117.63 3igv h HIS 502 Ca 0.16 0.01 -0.04 0.00 -2.20 0.00 0.00 60.37 58.29 3igv h HIS 502 Cb 0.14 -0.11 -0.03 0.00 1.55 0.00 0.00 27.41 28.97 3igv h HIS 502 CO -0.00 0.22 0.20 0.00 -1.30 0.00 0.00 177.93 177.05 3igv h ARG 503 N 0.34 0.87 -0.59 5.26 3.08 -1.19 -2.82 114.38 119.32 3igv h ARG 503 Ca 0.09 -0.15 -0.07 0.00 0.07 0.00 0.00 59.98 59.93 3igv h ARG 503 Cb -0.02 -0.14 -0.03 0.00 0.08 0.00 0.00 29.97 29.86 3igv h ARG 503 CO -0.02 0.74 0.11 0.00 -1.07 0.00 0.00 179.97 179.73 3igv h ALA 504 N 1.37 1.07 -0.68 0.04 0.00 -0.46 -1.69 119.26 118.90 3igv h ALA 504 Ca 0.20 -0.24 0.10 0.00 0.00 0.00 0.00 54.91 54.97 3igv h ALA 504 Cb 0.22 -0.23 -0.08 0.00 0.00 0.00 0.00 17.79 17.70 3igv h ALA 504 CO -0.01 0.60 0.30 0.00 0.00 0.00 0.00 179.25 180.14 3igv h ARG 505 N 0.90 0.49 0.86 0.00 3.08 -1.04 0.13 114.38 118.80 3igv h ARG 505 Ca 0.19 -0.03 -0.04 0.00 0.07 0.00 0.00 59.98 60.16 3igv h ARG 505 Cb 0.38 -0.11 0.01 0.00 0.08 0.00 0.00 29.97 30.33 3igv h ARG 505 CO 0.01 0.32 -0.42 1.03 -1.07 0.00 0.00 179.97 179.84 3igv h SER 506 N 0.50 -0.98 -0.72 7.04 0.87 -1.41 -2.13 113.55 116.72 3igv h SER 506 Ca 0.35 0.03 0.15 0.00 -1.23 0.00 0.00 61.79 61.09 3igv h SER 506 Cb 0.42 0.25 -0.10 0.00 -0.44 0.00 0.00 62.40 62.53 3igv h SER 506 CO -0.31 -0.65 0.18 0.58 -0.53 0.00 0.00 176.83 176.11 3igv h VAL 507 N -1.27 0.55 0.56 2.23 2.07 -1.06 0.06 116.25 119.38 3igv h VAL 507 Ca -0.12 -0.10 -0.02 0.00 0.82 0.00 0.00 66.70 67.28 3igv h VAL 507 Cb 0.89 0.24 -0.00 0.00 -1.52 0.00 0.00 31.29 30.90 3igv h VAL 507 CO 0.19 0.05 -0.34 -0.09 0.02 0.00 0.00 177.57 177.41 3igv h ARG 508 N 0.29 -0.82 -0.74 1.57 2.43 -0.73 -1.27 114.38 115.11 3igv h ARG 508 Ca 0.40 0.06 0.09 0.00 -0.81 0.00 0.00 59.98 59.72 3igv h ARG 508 Cb 0.66 0.19 -0.07 0.00 -0.42 0.00 0.00 29.97 30.33 3igv h ARG 508 CO -0.48 -0.54 0.39 0.00 -1.51 0.00 0.00 179.97 177.82 3igv h ALA 509 N -0.47 1.03 -0.72 2.80 0.00 -0.70 0.88 119.26 122.08 3igv h ALA 509 Ca -0.07 0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.86 3igv h ALA 509 Cb 0.68 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.37 3igv h ALA 509 CO 0.08 -0.01 0.35 0.00 0.00 0.00 0.00 179.25 179.67 3igv h ARG 510 N 0.65 1.02 -0.13 0.00 3.08 -0.87 0.03 114.38 118.16 3igv h ARG 510 Ca 0.36 -0.14 -0.05 0.00 0.07 0.00 0.00 59.98 60.22 3igv h ARG 510 Cb 0.36 -0.19 -0.00 0.00 0.08 0.00 0.00 29.97 30.22 3igv h ARG 510 CO -0.26 0.78 -0.13 -0.07 -1.07 0.00 0.00 179.97 179.22 3igv h LEU 511 N 1.01 0.33 -0.62 3.04 3.38 -0.22 -3.23 115.31 119.00 3igv h LEU 511 Ca 0.25 -0.48 0.04 0.00 0.09 0.00 0.00 57.88 57.78 3igv h LEU 511 Cb 0.10 -0.09 -0.04 0.00 0.09 0.00 0.00 40.66 40.71 3igv h LEU 511 CO -0.03 0.74 0.36 -0.07 0.09 0.00 0.00 178.44 179.54 3igv h LEU 512 N -0.07 0.57 -2.88 1.67 3.38 -0.58 -2.12 115.31 115.29 3igv h LEU 512 Ca 0.02 0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.00 3igv h LEU 512 Cb 0.65 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 41.29 3igv h LEU 512 CO 0.03 0.39 0.02 0.28 0.09 0.00 0.00 178.44 179.26 3igv h SER 513 N 0.70 0.00 0.68 -0.43 0.02 -1.05 -1.74 113.55 111.74 3igv h SER 513 Ca 0.26 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.21 3igv h SER 513 Cb 0.08 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.62 3igv h SER 513 CO -0.13 0.00 -0.86 0.00 -1.14 0.00 0.00 176.83 174.70 3igv n GLN 514 N -3.04 0.33 0.00 3.45 6.02 -0.82 -5.07 117.38 118.26 3igv n GLN 514 Ca -0.03 0.05 0.00 0.00 -0.01 0.00 0.00 57.00 57.01 3igv n GLN 514 Cb 0.09 -1.66 0.00 0.00 1.02 0.00 0.00 30.24 29.69 3igv n GLN 514 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3igv n GLY 515 N 1.33 -0.90 7.00 1.08 0.00 -0.65 -4.83 105.19 108.22 3igv n GLY 515 Ca 0.02 -1.12 0.00 0.00 0.00 0.00 0.00 46.02 44.93 3igv n GLY 515 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3igv n GLY 516 N 0.00 1.99 0.28 -0.02 0.00 -1.26 -1.57 105.19 104.61 3igv n GLY 516 Ca 0.00 -0.41 0.16 0.00 0.00 0.00 0.00 46.02 45.77 3igv n GLY 516 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 3igv h ARG 517 N 0.00 0.00 -0.14 1.61 3.08 -1.95 -2.82 114.38 114.16 3igv h ARG 517 Ca 0.00 0.00 -0.04 0.00 0.07 0.00 0.00 59.98 60.01 3igv h ARG 517 Cb 0.00 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.05 3igv h ARG 517 CO 0.00 0.07 -0.08 0.00 -1.07 0.00 0.00 179.97 178.89 3igv h ALA 518 N 1.93 0.20 -0.68 0.04 0.00 -1.74 -2.00 119.26 117.01 3igv h ALA 518 Ca -0.00 -0.27 0.00 0.00 0.00 0.00 0.00 54.91 54.64 3igv h ALA 518 Cb 0.37 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.08 3igv h ALA 518 CO 0.01 0.01 0.43 0.00 0.00 0.00 0.00 179.25 179.70 3igv h ALA 519 N 0.66 1.49 -0.54 0.00 0.00 -1.06 -1.05 119.26 118.75 3igv h ALA 519 Ca 0.03 -0.06 0.04 0.00 0.00 0.00 0.00 54.91 54.92 3igv h ALA 519 Cb 0.55 -0.28 -0.04 0.00 0.00 0.00 0.00 17.79 18.03 3igv h ALA 519 CO 0.02 0.46 0.31 1.15 0.00 0.00 0.00 179.25 181.19 3igv h THR 520 N 0.93 1.01 -0.42 0.00 2.02 -1.37 0.29 112.91 115.36 3igv h THR 520 Ca 0.25 -0.21 0.02 0.00 0.77 0.00 0.00 66.41 67.24 3igv h THR 520 Cb -0.08 0.36 -0.03 0.00 -1.74 0.00 0.00 68.15 66.66 3igv h THR 520 CO -0.05 0.11 0.25 0.00 0.37 0.00 0.00 175.52 176.20 3igv h GLY 522 N 0.51 1.09 0.95 0.00 0.00 -0.66 -0.56 103.07 104.41 3igv h GLY 522 Ca 0.17 -0.59 -0.03 0.00 0.00 0.00 0.00 47.33 46.88 3igv h GLY 522 CO -0.07 0.56 -0.30 1.70 0.00 0.00 0.00 176.54 178.43 3igv h LYS 523 N 0.97 -0.80 0.03 4.80 3.64 -0.23 -3.05 116.57 121.93 3igv h LYS 523 Ca 0.23 0.05 -0.07 0.00 -1.27 0.00 0.00 60.65 59.59 3igv h LYS 523 Cb 0.20 0.18 -0.00 0.00 -0.41 0.00 0.00 32.23 32.20 3igv h LYS 523 CO -0.02 -0.51 -0.37 1.88 -2.27 0.00 0.00 179.45 178.16 3igv h TYR 524 N -0.89 0.11 0.00 1.91 0.05 -1.37 -3.09 116.97 113.69 3igv h TYR 524 Ca -0.08 -0.08 -0.02 0.00 0.05 0.00 0.00 58.73 58.60 3igv h TYR 524 Cb 0.66 -0.00 -0.00 0.00 1.01 0.00 0.00 36.73 38.39 3igv h TYR 524 CO -0.02 1.14 -0.08 -0.07 -1.05 0.00 0.00 178.16 178.09 3igv h LEU 525 N -0.86 0.00 -2.58 3.88 3.38 -1.26 -3.31 115.31 114.56 3igv h LEU 525 Ca -0.08 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.89 3igv h LEU 525 Cb 1.19 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.94 3igv h LEU 525 CO 0.00 0.08 -0.15 0.49 0.09 0.00 0.00 178.44 178.95 3igv n PHE 526 N -3.17 0.00 0.28 1.13 3.72 -1.15 -4.72 117.46 113.54 3igv n PHE 526 Ca 0.01 -0.58 0.13 0.00 -0.05 0.00 0.00 57.45 56.97 3igv n PHE 526 Cb 0.41 -0.10 0.80 0.00 -0.94 0.00 0.00 39.48 39.65 3igv n PHE 526 CO 0.00 0.00 0.00 -0.97 -0.05 0.00 0.00 176.76 175.74 3igv h ASN 527 N 0.00 0.00 -0.37 4.37 -1.24 -1.63 -2.44 115.58 114.27 3igv h ASN 527 Ca 0.00 0.00 -0.00 0.00 0.71 0.00 0.00 56.30 57.01 3igv h ASN 527 Cb 1.06 0.00 -0.02 0.00 0.73 0.00 0.00 38.32 40.09 3igv h ASN 527 CO 0.00 0.07 0.23 4.11 -1.29 0.00 0.00 177.43 180.56 3igv h TRP 528 N 0.00 0.49 0.00 0.67 5.08 -1.85 -3.20 115.95 117.15 3igv h TRP 528 Ca -0.00 0.01 0.00 0.00 1.08 0.00 0.00 58.89 59.98 3igv h TRP 528 Cb 0.20 -0.16 0.00 0.00 -3.00 0.00 0.00 29.16 26.20 3igv h TRP 528 CO 0.00 0.33 0.00 0.00 -1.28 0.00 0.00 178.44 177.49 3igv h ALA 529 N 1.73 1.00 -3.46 0.11 0.00 -1.80 -3.44 119.26 113.41 3igv h ALA 529 Ca 0.14 0.00 -0.67 0.00 0.00 0.00 0.00 54.91 54.38 3igv h ALA 529 Cb -0.02 0.00 -0.15 0.00 0.00 0.00 0.00 17.79 17.62 3igv h ALA 529 CO -0.03 0.00 -0.67 0.14 0.00 0.00 0.00 179.25 178.70 3igv s VAL 530 N -3.62 3.95 0.04 0.00 -7.23 -1.21 -4.85 120.40 107.49 3igv s VAL 530 Ca 0.02 -0.67 -0.19 0.00 -1.81 0.00 0.00 61.98 59.32 3igv s VAL 530 Cb 0.09 -2.75 -0.15 0.00 0.56 0.00 0.00 36.38 34.13 3igv s VAL 530 CO 0.54 0.38 1.30 0.11 -0.31 0.00 0.00 175.10 177.13 3igv h LYS 531 N 4.42 0.42 -5.87 4.82 1.57 -1.88 -3.38 116.57 116.67 3igv h LYS 531 Ca -0.49 -0.26 -0.60 0.00 -1.87 0.00 0.00 60.65 57.43 3igv h LYS 531 Cb 1.17 0.03 -0.08 0.00 0.08 0.00 0.00 32.23 33.43 3igv h LYS 531 CO 0.56 0.86 1.82 -0.08 -0.57 0.00 0.00 179.45 182.03 3igv s THR 532 N -4.07 3.97 0.25 -0.16 -1.32 -1.26 -4.97 115.64 108.07 3igv s THR 532 Ca -0.14 -1.43 -0.30 0.00 -1.21 0.00 0.00 61.69 58.62 3igv s THR 532 Cb 0.05 -5.03 -0.09 0.00 -1.51 0.00 0.00 72.50 65.92 3igv s THR 532 CO 0.78 -1.83 1.29 -0.75 -2.21 0.00 0.00 174.62 171.90 3igv s LYS 533 N 4.83 4.40 0.00 7.08 2.20 -1.26 -5.04 119.74 131.95 3igv s LYS 533 Ca 0.55 2.08 -0.08 0.00 -0.36 0.00 0.00 55.97 58.16 3igv s LYS 533 Cb 0.02 -3.15 -0.05 0.00 -1.51 0.00 0.00 37.83 33.14 3igv s LYS 533 CO 0.04 -0.19 0.28 -0.51 -0.36 0.00 0.00 175.35 174.61 3igv s LEU 534 N -0.75 4.38 0.14 5.43 1.02 -1.26 -5.07 118.68 122.57 3igv s LEU 534 Ca 0.53 0.62 -0.30 0.00 0.02 0.00 0.00 54.13 55.00 3igv s LEU 534 Cb -0.37 -2.63 -0.07 0.00 0.02 0.00 0.00 46.19 43.14 3igv s LEU 534 CO 0.43 0.27 1.12 -0.75 0.02 0.00 0.00 176.35 177.44 3igv s LYS 535 N -1.62 4.55 -0.57 1.70 2.47 -1.26 -5.00 119.74 120.02 3igv s LYS 535 Ca 0.26 1.72 -0.07 0.00 -1.56 0.00 0.00 55.97 56.32 3igv s LYS 535 Cb -0.13 -3.30 0.15 0.00 -1.46 0.00 0.00 37.83 33.08 3igv s LYS 535 CO 0.15 -0.01 0.43 -0.51 0.16 0.00 0.00 175.35 175.57 3igv s LEU 536 N 0.00 5.69 0.65 5.43 1.43 -1.26 -5.07 118.68 125.55 3igv s LEU 536 Ca 0.52 -2.35 -0.03 0.00 -1.03 0.00 0.00 54.13 51.24 3igv s LEU 536 Cb -0.29 -1.98 0.06 0.00 0.03 0.00 0.00 46.19 44.01 3igv s LEU 536 CO 0.33 -0.56 0.91 0.42 0.23 0.00 0.00 176.35 177.69 3igv s THR 537 N 0.69 2.42 0.51 5.49 -4.23 -1.26 -5.05 115.64 114.21 3igv s THR 537 Ca 0.12 -0.48 -0.22 0.00 -1.18 0.00 0.00 61.69 59.93 3igv s THR 537 Cb -0.21 -2.94 -0.07 0.00 1.34 0.00 0.00 72.50 70.62 3igv s THR 537 CO -0.03 0.00 1.04 -2.65 -0.54 0.00 0.00 174.62 172.44 3igv n PRO 538 N -2.68 1.24 -2.77 3.99 -0.02 -1.26 -4.94 135.00 128.56 3igv n PRO 538 Ca 0.09 0.46 -0.42 0.00 -2.02 0.00 0.00 63.50 61.61 3igv n PRO 538 Cb 0.60 -2.18 -0.03 0.00 -0.02 0.00 0.00 33.50 31.87 3igv n PRO 538 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 3igv s ILE 539 N -1.38 4.83 0.25 4.25 1.01 -1.26 -4.98 121.20 123.93 3igv s ILE 539 Ca 0.69 1.88 -0.13 0.00 0.00 0.00 0.00 60.65 63.09 3igv s ILE 539 Cb -0.47 -4.24 0.34 0.00 0.01 0.00 0.00 42.46 38.10 3igv s ILE 539 CO 0.52 0.03 1.56 -0.65 0.00 0.00 0.00 174.94 176.41 3igv h PRO 540 N 7.13 -0.01 -1.15 2.79 0.11 -2.05 -2.49 132.00 136.33 3igv h PRO 540 Ca -0.31 0.00 -0.59 0.00 0.11 0.00 0.00 66.00 65.21 3igv h PRO 540 Cb 1.15 0.00 -0.41 0.00 0.11 0.00 0.00 31.00 31.85 3igv h PRO 540 CO 0.84 -0.01 -0.56 0.00 -0.21 0.00 0.00 178.00 178.07 3igv n ALA 541 N -3.50 5.22 0.09 -0.75 0.00 -1.26 -4.72 120.51 115.59 3igv n ALA 541 Ca 0.13 -4.01 -0.22 0.00 0.00 0.00 0.00 53.44 49.34 3igv n ALA 541 Cb 0.44 -0.61 -0.15 0.00 0.00 0.00 0.00 19.45 19.14 3igv n ALA 541 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3igv h ALA 542 N 2.38 0.11 0.00 0.00 0.00 -1.83 -3.34 119.26 116.58 3igv h ALA 542 Ca 0.37 -1.07 0.00 0.00 0.00 0.00 0.00 54.91 54.21 3igv h ALA 542 Cb 1.15 0.36 0.00 0.00 0.00 0.00 0.00 17.79 19.30 3igv h ALA 542 CO 0.89 0.98 0.00 0.43 0.00 0.00 0.00 179.25 181.55 3igv n SER 543 N -3.59 0.00 0.10 0.00 7.64 -1.26 -3.21 113.62 113.30 3igv n SER 543 Ca -0.21 -1.60 -0.19 0.00 1.01 0.00 0.00 58.87 57.89 3igv n SER 543 Cb 1.08 0.00 -0.15 0.00 -1.01 0.00 0.00 64.21 64.13 3igv n SER 543 CO 0.00 0.00 0.00 1.56 -3.01 0.00 0.00 175.04 173.59 3igv h GLN 544 N 0.00 0.33 -6.63 1.43 1.08 -1.93 -3.47 115.11 105.93 3igv h GLN 544 Ca 0.00 -0.57 -0.52 0.00 -1.45 0.00 0.00 58.65 56.11 3igv h GLN 544 Cb 0.00 0.21 0.06 0.00 -0.05 0.00 0.00 27.48 27.70 3igv h GLN 544 CO 0.00 1.24 1.03 1.28 -0.95 0.00 0.00 178.83 181.43 3igv n LEU 545 N -3.55 4.02 -4.54 1.46 4.77 -1.20 -4.92 117.00 113.04 3igv n LEU 545 Ca -0.14 1.05 -0.41 0.00 -0.03 0.00 0.00 56.01 56.47 3igv n LEU 545 Cb 1.05 -1.57 -0.03 0.00 -2.33 0.00 0.00 43.42 40.54 3igv n LEU 545 CO 0.54 0.19 1.14 -0.62 -1.33 0.00 0.00 177.39 177.31 3igv s ASP 546 N 1.42 6.17 -0.34 -1.43 3.68 -1.26 -4.85 116.67 120.06 3igv s ASP 546 Ca 0.76 -0.48 0.08 0.00 2.13 0.00 0.00 52.55 55.05 3igv s ASP 546 Cb -0.50 -2.55 0.63 0.00 -1.45 0.00 0.00 42.92 39.05 3igv s ASP 546 CO 0.33 -1.80 1.70 0.18 0.13 0.00 0.00 175.17 175.71 3igv n LEU 547 N 9.23 5.47 -4.81 -1.34 4.77 -1.26 -4.97 117.00 124.09 3igv n LEU 547 Ca 0.03 -3.50 -0.33 0.00 -0.03 0.00 0.00 56.01 52.18 3igv n LEU 547 Cb 0.49 -0.72 -0.02 0.00 -2.33 0.00 0.00 43.42 40.84 3igv n LEU 547 CO 0.70 1.01 0.70 -0.94 -1.33 0.00 0.00 177.39 177.54 3igv s SER 548 N -1.68 6.26 0.00 -1.43 1.04 -1.26 -3.56 113.70 113.07 3igv s SER 548 Ca 0.51 1.77 0.00 0.00 0.48 0.00 0.00 55.95 58.71 3igv s SER 548 Cb 0.43 -2.53 0.00 0.00 0.10 0.00 0.00 66.02 64.02 3igv s SER 548 CO 0.08 -0.84 0.00 0.61 0.98 0.00 0.00 173.24 174.07 3igv n GLY 549 N -0.91 2.86 0.18 7.32 0.00 -1.26 -4.85 105.19 108.53 3igv n GLY 549 Ca 0.08 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.02 3igv n GLY 549 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 173.32 174.81 3igv h TRP 550 N 0.00 0.53 -2.13 1.61 4.06 -1.94 -3.34 115.95 114.75 3igv h TRP 550 Ca 0.00 -0.00 -0.54 0.00 2.06 0.00 0.00 58.89 60.40 3igv h TRP 550 Cb 0.00 -0.17 -0.41 0.00 -1.00 0.00 0.00 29.16 27.58 3igv h TRP 550 CO 0.00 0.38 -0.91 1.19 -3.56 0.00 0.00 178.44 175.54 3igv n PHE 551 N -4.76 1.92 -0.05 0.49 3.72 -1.26 -4.81 117.46 112.69 3igv n PHE 551 Ca 0.00 -3.89 -0.10 0.00 -0.05 0.00 0.00 57.45 53.41 3igv n PHE 551 Cb 0.06 -0.45 -0.03 0.00 -0.94 0.00 0.00 39.48 38.11 3igv n PHE 551 CO 0.00 0.00 0.00 0.28 -0.05 0.00 0.00 176.76 176.99 3igv n VAL 552 N 0.31 1.21 -4.08 -4.37 0.31 -1.21 -4.16 118.33 106.34 3igv n VAL 552 Ca 0.27 0.06 -0.10 0.00 -0.01 0.00 0.00 64.34 64.56 3igv n VAL 552 Cb 0.52 -1.92 -0.09 0.00 -0.91 0.00 0.00 33.84 31.44 3igv n VAL 552 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3igv s ALA 553 N -2.45 0.54 0.27 3.52 0.00 -1.25 -3.87 121.76 118.52 3igv s ALA 553 Ca -0.20 -1.26 -0.06 0.00 0.00 0.00 0.00 51.96 50.44 3igv s ALA 553 Cb 0.05 0.89 -0.06 0.00 0.00 0.00 0.00 23.12 24.00 3igv s ALA 553 CO 0.27 -0.56 0.55 0.20 0.00 0.00 0.00 175.76 176.23 3igv s GLY 554 N -3.02 1.98 0.00 0.00 0.00 -1.26 -4.91 107.32 100.10 3igv s GLY 554 Ca 0.22 -0.48 0.13 0.00 0.00 0.00 0.00 44.72 44.59 3igv s GLY 554 CO 0.02 -0.36 1.05 -1.72 0.00 0.00 0.00 173.10 172.08 3igv n TYR 555 N -0.72 0.00 -1.69 1.90 4.01 0.70 -4.61 117.16 116.75 3igv n TYR 555 Ca -0.01 -0.40 -0.53 0.00 -0.16 0.00 0.00 57.90 56.80 3igv n TYR 555 Cb 0.53 0.09 -0.06 0.00 -0.31 0.00 0.00 39.34 39.59 3igv n TYR 555 CO 0.00 0.00 0.00 0.45 -0.46 0.00 0.00 176.86 176.85 3igv n SER 556 N 0.25 2.69 0.00 7.72 2.88 -1.25 -0.32 113.62 125.58 3igv n SER 556 Ca -0.06 1.05 0.00 0.00 -1.33 0.00 0.00 58.87 58.53 3igv n SER 556 Cb 0.91 -1.24 0.00 0.00 -0.75 0.00 0.00 64.21 63.13 3igv n SER 556 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3igv n GLY 557 N 4.04 0.27 0.53 0.46 0.00 -1.26 -4.24 105.19 104.99 3igv n GLY 557 Ca 0.24 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.34 3igv n GLY 557 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3igv n GLY 558 N -1.04 0.27 3.46 -0.02 0.00 0.56 -3.12 105.19 105.30 3igv n GLY 558 Ca 0.00 -0.37 -0.22 0.00 0.00 0.00 0.00 46.02 45.43 3igv n GLY 558 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 3igv n ASP 559 N 0.28 -6.09 -4.21 1.61 2.03 -1.26 -4.54 116.55 104.37 3igv n ASP 559 Ca 0.14 -0.80 -0.25 0.00 0.52 0.00 0.00 54.79 54.40 3igv n ASP 559 Cb 0.29 -4.21 -0.14 0.00 -0.72 0.00 0.00 41.12 36.33 3igv n ASP 559 CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 3igv s ILE 560 N -3.37 1.51 -0.07 5.18 -1.09 -1.26 -4.52 121.20 117.59 3igv s ILE 560 Ca 0.40 -1.01 -0.03 0.00 -2.23 0.00 0.00 60.65 57.79 3igv s ILE 560 Cb -0.10 -1.30 0.04 0.00 -1.58 0.00 0.00 42.46 39.52 3igv s ILE 560 CO 0.80 0.26 0.13 -0.47 -1.23 0.00 0.00 174.94 174.43 3igv s TYR 561 N -0.66 -0.12 -2.07 3.97 5.04 -0.30 -0.83 117.35 122.39 3igv s TYR 561 Ca 0.07 0.48 0.17 0.00 -2.44 0.00 0.00 57.07 55.34 3igv s TYR 561 Cb -0.08 -0.25 0.13 0.00 0.35 0.00 0.00 41.96 42.11 3igv s TYR 561 CO 0.01 -0.22 1.02 0.72 -1.34 0.00 0.00 175.55 175.75