#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 4.54 0.39 4.33 -1.94 -1.26 -1.94 119.30 123.41 3igv s MET 2 Ca 0.00 1.66 0.09 0.00 -1.71 0.00 0.00 55.69 55.73 3igv s MET 2 Cb 0.00 -3.34 0.78 0.00 2.01 0.00 0.00 34.83 34.28 3igv s MET 2 CO 0.00 -0.05 1.93 0.66 -0.01 0.00 0.00 175.02 177.56 3igv h SER 3 N 6.00 0.28 -3.99 3.03 4.64 -1.75 -3.40 113.55 118.36 3igv h SER 3 Ca -0.43 -0.05 -0.19 0.00 -0.47 0.00 0.00 61.79 60.65 3igv h SER 3 Cb 1.21 -0.07 -0.26 0.00 -0.31 0.00 0.00 62.40 62.97 3igv h SER 3 CO 0.76 0.39 -0.57 -0.31 -0.87 0.00 0.00 176.83 176.23 3igv s TYR 4 N -4.85 -0.09 -0.08 4.77 2.02 -1.26 -1.31 117.35 116.55 3igv s TYR 4 Ca -0.06 0.22 0.05 0.00 -0.37 0.00 0.00 57.07 56.91 3igv s TYR 4 Cb 0.16 0.02 -0.01 0.00 -0.40 0.00 0.00 41.96 41.73 3igv s TYR 4 CO 0.74 -0.10 -0.22 0.99 -1.57 0.00 0.00 175.55 175.38 3igv s THR 5 N -0.20 2.27 -0.09 -0.71 2.01 -0.64 -4.86 115.64 113.42 3igv s THR 5 Ca -0.03 -0.98 0.02 0.00 0.31 0.00 0.00 61.69 61.01 3igv s THR 5 Cb -0.02 -1.86 -0.02 0.00 0.01 0.00 0.00 72.50 70.61 3igv s THR 5 CO 0.00 0.56 -0.13 0.26 -0.69 0.00 0.00 174.62 174.63 3igv s TRP 6 N -0.01 2.77 0.04 4.92 0.52 -1.26 -0.09 118.94 125.82 3igv s TRP 6 Ca -0.07 -0.37 -0.18 0.00 0.02 0.00 0.00 56.10 55.50 3igv s TRP 6 Cb -0.15 -1.74 -0.19 0.00 -1.15 0.00 0.00 33.47 30.24 3igv s TRP 6 CO 0.05 0.01 1.20 1.79 0.02 0.00 0.00 176.95 180.02 3igv h THR 7 N 4.84 1.38 0.00 2.01 1.35 -1.40 -3.47 112.91 117.61 3igv h THR 7 Ca -0.37 -1.90 0.00 0.00 -0.55 0.00 0.00 66.41 63.59 3igv h THR 7 Cb 1.18 2.30 0.00 0.00 -1.73 0.00 0.00 68.15 69.90 3igv h THR 7 CO 0.53 0.57 0.00 0.61 -0.25 0.00 0.00 175.52 176.98 3igv n GLY 8 N 0.81 0.09 3.78 5.82 0.00 -1.26 -5.07 105.19 109.36 3igv n GLY 8 Ca -0.09 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.55 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 -0.98 3.33 0.48 4.61 0.00 -1.26 -5.04 121.76 122.89 3igv s ALA 9 Ca 0.00 0.44 -0.20 0.00 0.00 0.00 0.00 51.96 52.20 3igv s ALA 9 Cb 0.00 -3.07 -0.08 0.00 0.00 0.00 0.00 23.12 19.96 3igv s ALA 9 CO 0.00 0.24 1.04 -0.51 0.00 0.00 0.00 175.76 176.53 3igv s LEU 10 N -1.67 3.86 -0.10 0.00 1.43 -1.26 -4.76 118.68 116.18 3igv s LEU 10 Ca 0.44 1.95 -0.28 0.00 -1.03 0.00 0.00 54.13 55.21 3igv s LEU 10 Cb -0.21 -4.54 -0.02 0.00 0.03 0.00 0.00 46.19 41.46 3igv s LEU 10 CO 0.25 -0.79 0.92 -0.63 0.23 0.00 0.00 176.35 176.34 3igv s ILE 11 N -1.95 4.86 0.13 -0.59 1.01 -1.26 -4.82 121.20 118.57 3igv s ILE 11 Ca 0.67 1.86 0.09 0.00 0.00 0.00 0.00 60.65 63.27 3igv s ILE 11 Cb -0.17 -4.23 -0.04 0.00 0.01 0.00 0.00 42.46 38.02 3igv s ILE 11 CO 0.21 0.07 -0.16 0.42 0.00 0.00 0.00 174.94 175.47 3igv s THR 12 N 1.73 2.91 0.43 2.92 -4.23 -1.26 -4.86 115.64 113.29 3igv s THR 12 Ca 0.45 -1.53 -0.03 0.00 -1.18 0.00 0.00 61.69 59.40 3igv s THR 12 Cb -0.18 -2.36 -0.04 0.00 1.34 0.00 0.00 72.50 71.27 3igv s THR 12 CO 0.18 0.06 0.70 -2.16 -0.54 0.00 0.00 174.62 172.86 3igv s PRO 13 N -2.27 3.52 -0.12 3.99 0.04 -1.26 -4.30 135.00 134.61 3igv s PRO 13 Ca 0.19 0.00 -0.07 0.00 0.04 0.00 0.00 61.00 61.16 3igv s PRO 13 Cb -0.10 -2.48 -0.06 0.00 0.04 0.00 0.00 34.50 31.90 3igv s PRO 13 CO 0.11 -0.07 0.11 0.00 0.04 0.00 0.00 177.00 177.19 3igv n ALA 15 N -2.93 0.57 -1.78 0.00 0.00 -1.26 -5.10 120.51 110.01 3igv n ALA 15 Ca -0.04 -1.09 -0.35 0.00 0.00 0.00 0.00 53.44 51.95 3igv n ALA 15 Cb 0.16 0.35 -0.01 0.00 0.00 0.00 0.00 19.45 19.95 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 -2.37 2.79 -0.17 0.00 0.00 -1.26 -5.04 121.76 115.70 3igv s ALA 16 Ca 0.26 0.78 -0.01 0.00 0.00 0.00 0.00 51.96 52.99 3igv s ALA 16 Cb -0.02 -3.33 -0.01 0.00 0.00 0.00 0.00 23.12 19.76 3igv s ALA 16 CO 0.17 -0.62 -0.11 -1.21 0.00 0.00 0.00 175.76 173.99 3igv s GLU 17 N -3.16 3.33 -0.11 0.00 2.02 -1.26 -5.10 118.70 114.42 3igv s GLU 17 Ca 0.70 -0.68 -0.21 0.00 0.02 0.00 0.00 54.97 54.79 3igv s GLU 17 Cb -0.23 -2.76 -0.03 0.00 0.10 0.00 0.00 34.13 31.21 3igv s GLU 17 CO 0.26 0.01 0.63 -1.21 0.02 0.00 0.00 175.26 174.97 3igv s GLU 18 N 0.88 4.36 -0.21 1.61 2.02 -1.26 -4.94 118.70 121.16 3igv s GLU 18 Ca -0.03 0.71 0.16 0.00 0.02 0.00 0.00 54.97 55.83 3igv s GLU 18 Cb -0.15 -3.48 -0.24 0.00 0.10 0.00 0.00 34.13 30.37 3igv s GLU 18 CO -0.00 0.01 0.03 -1.13 0.02 0.00 0.00 175.26 174.19 3igv n SER 19 N 4.08 0.30 -4.72 -0.19 3.41 -1.26 -4.47 113.62 110.76 3igv n SER 19 Ca -0.03 -0.02 -0.41 0.00 -0.26 0.00 0.00 58.87 58.16 3igv n SER 19 Cb 0.51 0.81 -0.04 0.00 -0.26 0.00 0.00 64.21 65.23 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 -2.49 4.52 -0.20 4.33 -0.14 -1.26 -1.47 119.74 123.03 3igv s LYS 20 Ca -0.13 1.17 -0.36 0.00 -1.36 0.00 0.00 55.97 55.28 3igv s LYS 20 Cb 0.06 -3.43 -0.13 0.00 -1.68 0.00 0.00 37.83 32.66 3igv s LYS 20 CO 0.79 0.07 1.91 -0.11 -0.76 0.00 0.00 175.35 177.26 3igv n LEU 21 N 3.56 2.92 -4.76 3.17 7.94 -1.26 -4.93 117.00 123.64 3igv n LEU 21 Ca 0.02 0.88 -0.41 0.00 -1.11 0.00 0.00 56.01 55.39 3igv n LEU 21 Cb 0.51 -1.29 -0.01 0.00 0.53 0.00 0.00 43.42 43.15 3igv n LEU 21 CO 0.49 -0.29 1.11 -2.84 -1.11 0.00 0.00 177.39 174.75 3igv s PRO 22 N 4.39 4.21 -0.15 1.96 0.02 -1.26 -5.01 135.00 139.16 3igv s PRO 22 Ca 0.98 2.42 0.02 0.00 0.02 0.00 0.00 61.00 64.44 3igv s PRO 22 Cb -0.82 -3.04 0.01 0.00 0.02 0.00 0.00 34.50 30.68 3igv s PRO 22 CO 0.55 -0.44 -0.20 0.42 -0.33 0.00 0.00 177.00 177.01 3igv s ILE 23 N -0.68 1.92 0.18 2.83 -1.09 -1.26 -4.71 121.20 118.39 3igv s ILE 23 Ca 0.55 -0.88 0.01 0.00 -2.23 0.00 0.00 60.65 58.10 3igv s ILE 23 Cb -0.44 -1.72 -0.00 0.00 -1.58 0.00 0.00 42.46 38.72 3igv s ILE 23 CO 0.53 0.52 0.04 -0.46 -1.23 0.00 0.00 174.94 174.34 3igv n ASN 24 N 4.30 1.60 0.10 3.58 6.94 -1.26 -5.03 115.26 125.49 3igv n ASN 24 Ca -0.20 -1.91 0.08 0.00 -0.02 0.00 0.00 54.58 52.53 3igv n ASN 24 Cb 0.51 0.33 0.39 0.00 -2.36 0.00 0.00 39.78 38.65 3igv n ASN 24 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 3igv n ALA 25 N -2.24 1.26 0.61 -2.53 0.00 -1.26 -2.35 120.51 113.99 3igv n ALA 25 Ca -0.07 0.09 0.10 0.00 0.00 0.00 0.00 53.44 53.57 3igv n ALA 25 Cb 0.26 -1.25 -0.13 0.00 0.00 0.00 0.00 19.45 18.33 3igv n ALA 25 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3igv n LEU 26 N -1.98 0.61 0.10 0.00 4.77 -1.26 -4.62 117.00 114.61 3igv n LEU 26 Ca 0.00 -0.29 -0.13 0.00 -0.03 0.00 0.00 56.01 55.56 3igv n LEU 26 Cb 0.09 -0.00 -0.08 0.00 -2.33 0.00 0.00 43.42 41.10 3igv n LEU 26 CO 0.10 0.15 0.75 0.28 -1.33 0.00 0.00 177.39 177.34 3igv h SER 27 N 0.00 -0.16 0.00 -1.43 0.02 -1.83 -3.17 113.55 106.99 3igv h SER 27 Ca 0.00 -0.10 -0.00 0.00 -0.84 0.00 0.00 61.79 60.85 3igv h SER 27 Cb 0.70 0.04 -0.00 0.00 0.14 0.00 0.00 62.40 63.28 3igv h SER 27 CO 0.00 0.00 -0.00 0.78 -1.14 0.00 0.00 176.83 176.47 3igv h ASN 28 N -0.32 0.00 0.54 3.07 2.35 -1.79 0.41 115.58 119.84 3igv h ASN 28 Ca -0.02 0.00 -0.02 0.00 -0.55 0.00 0.00 56.30 55.71 3igv h ASN 28 Cb 0.26 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.62 3igv h ASN 28 CO 0.03 0.00 -0.08 0.77 -1.65 0.00 0.00 177.43 176.51 3igv h SER 29 N 0.00 0.00 0.00 5.81 4.64 -1.85 -3.27 113.55 118.87 3igv h SER 29 Ca -0.00 0.00 -0.37 0.00 -0.47 0.00 0.00 61.79 60.95 3igv h SER 29 Cb 0.01 0.00 -0.07 0.00 -0.31 0.00 0.00 62.40 62.03 3igv h SER 29 CO 0.00 0.08 -2.41 -0.11 -0.87 0.00 0.00 176.83 173.52 3igv n LEU 30 N -3.36 2.96 -3.65 5.97 7.94 -0.00 -4.65 117.00 122.21 3igv n LEU 30 Ca -0.01 -0.13 -0.05 0.00 -1.11 0.00 0.00 56.01 54.71 3igv n LEU 30 Cb 0.25 -0.86 -0.06 0.00 0.53 0.00 0.00 43.42 43.27 3igv n LEU 30 CO 0.28 0.91 0.31 -0.22 -1.11 0.00 0.00 177.39 177.56 3igv s LEU 31 N -6.46 -0.97 -0.20 -1.96 0.20 -0.39 -4.33 118.68 104.57 3igv s LEU 31 Ca -0.33 1.50 -0.20 0.00 0.69 0.00 0.00 54.13 55.79 3igv s LEU 31 Cb 0.09 2.31 -0.20 0.00 -0.43 0.00 0.00 46.19 47.96 3igv s LEU 31 CO 0.57 -0.23 0.23 0.03 -0.29 0.00 0.00 176.35 176.66 3igv h ARG 32 N 7.31 0.03 -5.96 1.98 2.47 -0.95 -3.36 114.38 115.89 3igv h ARG 32 Ca -0.27 -0.05 -0.61 0.00 -1.26 0.00 0.00 59.98 57.80 3igv h ARG 32 Cb 1.19 0.02 -0.09 0.00 -1.65 0.00 0.00 29.97 29.44 3igv h ARG 32 CO 0.15 1.02 1.75 -1.01 0.56 0.00 0.00 179.97 182.44 3igv s HIS 33 N -2.38 2.58 0.26 3.04 3.76 -0.64 -4.79 115.29 117.12 3igv s HIS 33 Ca -0.28 -1.05 0.14 0.00 -0.15 0.00 0.00 55.06 53.71 3igv s HIS 33 Cb 0.06 -4.67 0.54 0.00 1.11 0.00 0.00 32.58 29.62 3igv s HIS 33 CO 0.61 -1.85 1.69 0.45 -0.85 0.00 0.00 174.74 174.80 3igv h HIS 34 N 8.92 0.00 0.00 1.40 3.86 -1.85 -2.94 115.15 124.54 3igv h HIS 34 Ca 0.30 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.51 3igv h HIS 34 Cb 0.95 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.42 3igv h HIS 34 CO 1.34 0.49 0.00 0.27 0.86 0.00 0.00 177.93 180.89 3igv n ASN 35 N -3.76 0.34 0.16 2.45 0.23 -1.26 -2.56 115.26 110.86 3igv n ASN 35 Ca -0.01 0.61 0.08 0.00 -0.53 0.00 0.00 54.58 54.73 3igv n ASN 35 Cb 0.54 -0.67 0.08 0.00 -2.08 0.00 0.00 39.78 37.65 3igv n ASN 35 CO 0.00 0.00 0.00 0.24 -0.93 0.00 0.00 177.26 176.57 3igv h MET 36 N 0.00 0.00 -5.60 -3.83 2.86 -1.91 -3.46 114.93 102.99 3igv h MET 36 Ca 0.00 0.00 -0.66 0.00 -2.06 0.00 0.00 59.70 56.98 3igv h MET 36 Cb 0.19 0.00 -0.09 0.00 0.06 0.00 0.00 31.60 31.76 3igv h MET 36 CO 0.00 0.18 -0.49 0.08 1.06 0.00 0.00 176.91 177.73 3igv s VAL 37 N -3.13 5.38 0.14 -2.22 1.01 -1.06 -2.03 120.40 118.48 3igv s VAL 37 Ca 0.04 0.17 -0.16 0.00 0.00 0.00 0.00 61.98 62.03 3igv s VAL 37 Cb 0.07 -3.36 0.03 0.00 0.00 0.00 0.00 36.38 33.12 3igv s VAL 37 CO 0.72 0.59 0.41 -0.72 0.00 0.00 0.00 175.10 176.10 3igv s TYR 38 N -0.77 -0.13 -0.04 5.22 1.13 -1.02 -4.03 117.35 117.71 3igv s TYR 38 Ca 0.13 -0.20 0.07 0.00 -1.41 0.00 0.00 57.07 55.67 3igv s TYR 38 Cb -0.12 0.25 -0.02 0.00 -1.10 0.00 0.00 41.96 40.97 3igv s TYR 38 CO 0.03 -0.73 -0.25 0.00 -2.51 0.00 0.00 175.55 172.08 3igv s ALA 39 N -3.83 2.17 0.37 9.51 0.00 -0.54 -1.45 121.76 127.99 3igv s ALA 39 Ca 0.05 -1.08 -0.27 0.00 0.00 0.00 0.00 51.96 50.66 3igv s ALA 39 Cb 0.02 -0.62 -0.09 0.00 0.00 0.00 0.00 23.12 22.43 3igv s ALA 39 CO -0.10 0.47 1.21 0.95 0.00 0.00 0.00 175.76 178.30 3igv s THR 40 N -0.39 3.02 0.31 0.00 -4.23 -0.65 -4.39 115.64 109.32 3igv s THR 40 Ca 0.03 0.92 0.03 0.00 -1.18 0.00 0.00 61.69 61.49 3igv s THR 40 Cb -0.12 -3.54 -0.06 0.00 1.34 0.00 0.00 72.50 70.12 3igv s THR 40 CO 0.01 0.14 0.07 0.42 -0.54 0.00 0.00 174.62 174.72 3igv s THR 41 N -1.30 1.07 -0.23 3.99 -4.23 -1.26 -3.99 115.64 109.68 3igv s THR 41 Ca 0.54 -2.00 0.25 0.00 -1.18 0.00 0.00 61.69 59.30 3igv s THR 41 Cb -0.34 -2.77 0.26 0.00 1.34 0.00 0.00 72.50 71.00 3igv s THR 41 CO 0.43 -0.00 1.77 0.77 -0.54 0.00 0.00 174.62 177.05 3igv h SER 42 N 2.17 0.00 0.04 3.99 4.64 -1.89 -2.49 113.55 120.00 3igv h SER 42 Ca -0.40 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 60.92 3igv h SER 42 Cb 1.24 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.33 3igv h SER 42 CO 0.68 0.00 -0.00 0.03 -0.87 0.00 0.00 176.83 176.67 3igv h ARG 43 N 0.00 0.00 -0.51 4.77 3.08 -1.96 -1.18 114.38 118.58 3igv h ARG 43 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 3igv h ARG 43 Cb 0.21 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.26 3igv h ARG 43 CO 0.00 0.00 0.00 -1.13 -1.07 0.00 0.00 179.97 177.77 3igv n SER 44 N -3.34 3.65 -0.08 7.04 3.41 -0.94 -4.59 113.62 118.77 3igv n SER 44 Ca -0.03 -2.17 0.00 0.00 -0.26 0.00 0.00 58.87 56.41 3igv n SER 44 Cb 0.08 -0.40 0.29 0.00 -0.26 0.00 0.00 64.21 63.92 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 3.04 1.44 -0.82 7.33 0.00 -1.35 -2.49 119.26 126.42 3igv h ALA 45 Ca 0.00 -0.12 0.12 0.00 0.00 0.00 0.00 54.91 54.91 3igv h ALA 45 Cb 1.00 -0.21 -0.06 0.00 0.00 0.00 0.00 17.79 18.53 3igv h ALA 45 CO 0.06 0.44 0.54 0.78 0.00 0.00 0.00 179.25 181.07 3igv h GLY 46 N 0.84 1.05 1.47 0.00 0.00 -1.81 -2.12 103.07 102.51 3igv h GLY 46 Ca 0.17 -0.28 -0.21 0.00 0.00 0.00 0.00 47.33 47.01 3igv h GLY 46 CO -0.02 0.12 -0.83 1.41 0.00 0.00 0.00 176.54 177.22 3igv h LEU 47 N 0.67 0.62 -0.45 3.11 4.07 -1.79 -3.15 115.31 118.38 3igv h LEU 47 Ca 0.40 -0.44 -0.10 0.00 0.08 0.00 0.00 57.88 57.82 3igv h LEU 47 Cb 0.61 -0.18 -0.01 0.00 1.08 0.00 0.00 40.66 42.15 3igv h LEU 47 CO -0.16 1.22 -0.11 -0.09 -1.08 0.00 0.00 178.44 178.21 3igv h ARG 48 N 0.32 0.87 -0.34 1.13 9.65 -1.44 -2.90 114.38 121.67 3igv h ARG 48 Ca -0.06 -0.34 0.07 0.00 -1.10 0.00 0.00 59.98 58.56 3igv h ARG 48 Cb 1.45 -0.05 -0.07 0.00 -1.39 0.00 0.00 29.97 29.90 3igv h ARG 48 CO 0.15 0.98 -0.14 1.96 2.80 0.00 0.00 179.97 185.71 3igv h GLN 49 N 0.71 -0.08 -0.50 0.20 4.20 -1.43 -0.71 115.11 117.49 3igv h GLN 49 Ca 0.11 0.01 0.09 0.00 0.06 0.00 0.00 58.65 58.92 3igv h GLN 49 Cb 0.66 0.02 -0.07 0.00 0.30 0.00 0.00 27.48 28.38 3igv h GLN 49 CO 0.05 -0.05 0.07 0.87 -0.67 0.00 0.00 178.83 179.10 3igv h LYS 50 N -0.08 0.20 -0.13 1.46 1.57 -1.50 -2.04 116.57 116.04 3igv h LYS 50 Ca 0.17 -0.01 0.02 0.00 -1.87 0.00 0.00 60.65 58.96 3igv h LYS 50 Cb 0.34 -0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.59 3igv h LYS 50 CO -0.40 0.13 0.01 0.87 -0.57 0.00 0.00 179.45 179.50 3igv h LYS 51 N 0.20 0.06 -0.02 3.15 1.57 -1.12 -3.17 116.57 117.24 3igv h LYS 51 Ca 0.25 -0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.03 3igv h LYS 51 Cb 0.36 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.65 3igv h LYS 51 CO -0.36 0.04 0.00 1.33 -0.57 0.00 0.00 179.45 179.89 3igv n VAL 52 N -5.10 0.02 -3.50 0.50 0.24 -0.36 -4.74 118.33 105.38 3igv n VAL 52 Ca -0.04 -0.19 -0.42 0.00 -2.04 0.00 0.00 64.34 61.64 3igv n VAL 52 Cb 0.07 0.23 -0.09 0.00 -1.47 0.00 0.00 33.84 32.58 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 -1.98 4.72 0.17 3.34 2.01 -0.79 -4.65 115.64 118.46 3igv s THR 53 Ca 0.40 -1.21 -0.19 0.00 0.31 0.00 0.00 61.69 61.00 3igv s THR 53 Cb 0.21 -3.84 0.05 0.00 0.01 0.00 0.00 72.50 68.93 3igv s THR 53 CO 0.33 -0.52 0.53 0.72 -0.69 0.00 0.00 174.62 174.99 3igv s PHE 54 N 1.53 -0.31 0.22 4.92 -0.71 -1.26 -4.95 117.98 117.43 3igv s PHE 54 Ca 0.03 0.02 -0.30 0.00 -1.04 0.00 0.00 56.93 55.64 3igv s PHE 54 Cb -0.23 0.44 -0.09 0.00 -1.21 0.00 0.00 43.02 41.93 3igv s PHE 54 CO 0.05 -0.85 0.99 0.34 -1.34 0.00 0.00 175.22 174.41 3igv s ASP 55 N -2.81 7.52 -0.20 1.98 2.15 -1.26 -2.22 116.67 121.83 3igv s ASP 55 Ca 0.04 2.01 -0.04 0.00 0.43 0.00 0.00 52.55 54.99 3igv s ASP 55 Cb -0.00 -2.61 -0.02 0.00 -0.30 0.00 0.00 42.92 39.99 3igv s ASP 55 CO -0.09 0.03 -0.04 -0.13 -0.17 0.00 0.00 175.17 174.78 3igv s ARG 56 N -1.00 3.50 -0.07 4.34 3.00 -0.82 -4.92 118.95 122.98 3igv s ARG 56 Ca 0.43 -0.58 -0.01 0.00 0.00 0.00 0.00 55.73 55.57 3igv s ARG 56 Cb -0.27 -2.98 -0.03 0.00 0.00 0.00 0.00 34.95 31.67 3igv s ARG 56 CO 0.34 -0.03 0.00 -0.51 0.00 0.00 0.00 175.30 175.11 3igv s LEU 57 N 1.06 3.58 -0.05 2.53 1.43 -1.26 -2.83 118.68 123.13 3igv s LEU 57 Ca 0.01 0.12 -0.01 0.00 -1.03 0.00 0.00 54.13 53.21 3igv s LEU 57 Cb -0.15 -1.87 0.03 0.00 0.03 0.00 0.00 46.19 44.23 3igv s LEU 57 CO 0.00 0.36 0.03 -1.58 0.23 0.00 0.00 176.35 175.39 3igv s GLN 58 N -1.04 0.24 -0.33 1.70 0.74 -1.26 -3.87 119.66 115.84 3igv s GLN 58 Ca 0.15 0.23 0.02 0.00 0.05 0.00 0.00 55.36 55.81 3igv s GLN 58 Cb -0.11 -0.68 0.10 0.00 1.10 0.00 0.00 33.01 33.41 3igv s GLN 58 CO 0.04 -0.29 0.07 0.08 -0.55 0.00 0.00 175.29 174.64 3igv s VAL 59 N 1.94 1.76 -0.31 1.34 1.01 0.40 -5.02 120.40 121.52 3igv s VAL 59 Ca 0.03 -2.01 -0.12 0.00 0.00 0.00 0.00 61.98 59.88 3igv s VAL 59 Cb -0.12 -2.31 -0.03 0.00 0.00 0.00 0.00 36.38 33.91 3igv s VAL 59 CO -0.04 -0.63 0.22 -0.76 0.00 0.00 0.00 175.10 173.89 3igv s LEU 60 N 1.15 4.30 0.00 3.92 1.43 -1.26 -4.43 118.68 123.79 3igv s LEU 60 Ca 0.11 -0.24 0.00 0.00 -1.03 0.00 0.00 54.13 52.97 3igv s LEU 60 Cb -0.18 -2.13 0.00 0.00 0.03 0.00 0.00 46.19 43.90 3igv s LEU 60 CO -0.14 -0.16 0.00 -0.90 0.23 0.00 0.00 176.35 175.38 3igv n ASP 61 N 5.09 0.00 -0.07 2.29 5.75 -1.26 -4.99 116.55 123.36 3igv n ASP 61 Ca -0.13 -0.50 -0.13 0.00 -0.01 0.00 0.00 54.79 54.02 3igv n ASP 61 Cb 0.51 0.00 -0.01 0.00 -1.03 0.00 0.00 41.12 40.58 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 0.00 0.91 -0.92 -1.12 3.32 -2.00 -3.11 116.42 113.50 3igv h ASP 62 Ca 0.00 -0.47 0.10 0.00 0.02 0.00 0.00 57.03 56.68 3igv h ASP 62 Cb 0.00 -0.26 -0.08 0.00 0.22 0.00 0.00 39.33 39.21 3igv h ASP 62 CO 0.00 1.25 0.56 0.45 -1.72 0.00 0.00 179.24 179.78 3igv h HIS 63 N 0.64 1.02 -0.15 4.55 3.86 -1.96 -0.91 115.15 122.20 3igv h HIS 63 Ca 0.02 0.03 0.02 0.00 -1.16 0.00 0.00 60.37 59.28 3igv h HIS 63 Cb 1.10 -0.32 -0.02 0.00 1.06 0.00 0.00 27.41 29.24 3igv h HIS 63 CO 0.06 0.44 0.04 -0.92 0.86 0.00 0.00 177.93 178.41 3igv h TYR 64 N 0.93 0.08 -0.07 2.45 3.20 -1.85 -2.23 116.97 119.48 3igv h TYR 64 Ca 0.44 0.01 -0.16 0.00 3.14 0.00 0.00 58.73 62.16 3igv h TYR 64 Cb 0.37 -0.01 -0.01 0.00 1.54 0.00 0.00 36.73 38.62 3igv h TYR 64 CO -0.03 0.04 -0.65 0.00 -1.64 0.00 0.00 178.16 175.88 3igv h ARG 65 N 0.11 0.28 -0.26 1.82 3.08 -1.37 -2.15 114.38 115.89 3igv h ARG 65 Ca 0.07 -0.20 -0.02 0.00 0.07 0.00 0.00 59.98 59.89 3igv h ARG 65 Cb 0.05 0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.12 3igv h ARG 65 CO -0.08 0.83 0.09 -0.44 -1.07 0.00 0.00 179.97 179.30 3igv h ASP 66 N 0.20 0.38 -0.22 7.04 3.32 -1.13 -0.46 116.42 125.54 3igv h ASP 66 Ca -0.01 -0.19 -0.02 0.00 0.02 0.00 0.00 57.03 56.82 3igv h ASP 66 Cb 1.18 -0.10 -0.01 0.00 0.22 0.00 0.00 39.33 40.62 3igv h ASP 66 CO 0.10 0.47 0.06 0.58 -1.72 0.00 0.00 179.24 178.73 3igv h VAL 67 N 0.26 1.20 -0.90 -1.35 2.07 -1.38 -2.36 116.25 113.80 3igv h VAL 67 Ca 0.09 -0.64 0.10 0.00 0.82 0.00 0.00 66.70 67.07 3igv h VAL 67 Cb 0.22 1.20 -0.07 0.00 -1.52 0.00 0.00 31.29 31.12 3igv h VAL 67 CO -0.00 0.20 0.54 0.25 0.02 0.00 0.00 177.57 178.58 3igv h LEU 68 N 0.19 0.80 -0.42 2.57 5.85 -1.34 -0.30 115.31 122.66 3igv h LEU 68 Ca 0.07 0.04 -0.01 0.00 0.84 0.00 0.00 57.88 58.82 3igv h LEU 68 Cb 0.25 -0.12 -0.02 0.00 0.37 0.00 0.00 40.66 41.14 3igv h LEU 68 CO -0.00 0.46 0.22 0.50 -0.34 0.00 0.00 178.44 179.28 3igv h LYS 69 N 0.91 0.60 -0.30 1.25 3.64 -0.87 -0.43 116.57 121.36 3igv h LYS 69 Ca 0.43 -0.08 0.00 0.00 -1.27 0.00 0.00 60.65 59.73 3igv h LYS 69 Cb 0.36 -0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 32.06 3igv h LYS 69 CO -0.24 0.50 0.19 0.93 -2.27 0.00 0.00 179.45 178.56 3igv h GLU 70 N 0.55 0.40 -0.59 1.90 5.08 -0.86 -1.76 114.58 119.29 3igv h GLU 70 Ca 0.15 -0.03 0.05 0.00 -1.00 0.00 0.00 59.36 58.53 3igv h GLU 70 Cb 0.08 -0.09 -0.05 0.00 0.50 0.00 0.00 28.75 29.20 3igv h GLU 70 CO -0.02 0.28 0.32 0.52 -1.00 0.00 0.00 179.01 179.10 3igv h MET 71 N 0.40 0.59 -0.82 2.33 2.86 -0.82 -2.43 114.93 117.04 3igv h MET 71 Ca 0.11 -0.04 -0.01 0.00 -2.06 0.00 0.00 59.70 57.70 3igv h MET 71 Cb -0.03 -0.13 -0.04 0.00 0.06 0.00 0.00 31.60 31.46 3igv h MET 71 CO -0.02 0.39 0.46 0.87 1.06 0.00 0.00 176.91 179.67 3igv h LYS 72 N 0.60 1.13 -0.36 1.72 1.57 -0.81 0.16 116.57 120.58 3igv h LYS 72 Ca 0.26 -0.12 0.01 0.00 -1.87 0.00 0.00 60.65 58.93 3igv h LYS 72 Cb 0.15 -0.23 -0.02 0.00 0.08 0.00 0.00 32.23 32.21 3igv h LYS 72 CO -0.17 0.82 0.22 0.00 -0.57 0.00 0.00 179.45 179.75 3igv h ALA 73 N 1.25 0.45 -0.29 3.86 0.00 -0.85 -0.71 119.26 122.98 3igv h ALA 73 Ca 0.29 -0.01 -0.12 0.00 0.00 0.00 0.00 54.91 55.07 3igv h ALA 73 Cb 0.01 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 17.68 3igv h ALA 73 CO -0.05 -0.12 -0.28 0.87 0.00 0.00 0.00 179.25 179.67 3igv h LYS 74 N 0.45 0.70 -0.64 0.00 1.57 -1.30 -3.12 116.57 114.22 3igv h LYS 74 Ca 0.14 -0.36 0.12 0.00 -1.87 0.00 0.00 60.65 58.67 3igv h LYS 74 Cb -0.01 0.01 -0.04 0.00 0.08 0.00 0.00 32.23 32.27 3igv h LYS 74 CO -0.05 0.98 0.43 0.00 -0.57 0.00 0.00 179.45 180.23 3igv h ALA 75 N 0.71 2.07 0.00 3.86 0.00 -0.63 -0.47 119.26 124.80 3igv h ALA 75 Ca 0.05 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.95 3igv h ALA 75 Cb 0.84 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.56 3igv h ALA 75 CO 0.07 -0.23 0.00 -1.13 0.00 0.00 0.00 179.25 177.96 3igv n SER 76 N -4.47 0.00 0.01 0.00 3.41 -0.30 -1.92 113.62 110.36 3igv n SER 76 Ca 0.11 -1.33 0.12 0.00 -0.26 0.00 0.00 58.87 57.51 3igv n SER 76 Cb 0.43 0.00 0.14 0.00 -0.26 0.00 0.00 64.21 64.52 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 -0.82 0.07 -2.79 6.66 -2.24 -0.18 -4.69 114.28 110.28 3igv n THR 77 Ca 0.15 -0.08 -0.41 0.00 -2.27 0.00 0.00 64.05 61.44 3igv n THR 77 Cb 0.07 0.32 -0.05 0.00 -2.10 0.00 0.00 70.33 68.57 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 -3.06 4.51 -0.21 2.28 1.01 -0.81 -4.94 120.40 119.19 3igv s VAL 78 Ca 0.09 1.97 -0.02 0.00 0.00 0.00 0.00 61.98 64.01 3igv s VAL 78 Cb 0.16 -4.28 0.00 0.00 0.00 0.00 0.00 36.38 32.27 3igv s VAL 78 CO 0.75 0.35 -0.09 -0.75 0.00 0.00 0.00 175.10 175.36 3igv s LYS 79 N -0.14 3.24 0.12 2.72 2.20 -1.26 -0.21 119.74 126.42 3igv s LYS 79 Ca 0.44 -0.70 0.10 0.00 -0.36 0.00 0.00 55.97 55.46 3igv s LYS 79 Cb -0.23 -2.88 -0.04 0.00 -1.51 0.00 0.00 37.83 33.17 3igv s LYS 79 CO 0.28 -0.21 -0.22 0.00 -0.36 0.00 0.00 175.35 174.84 3igv s ALA 80 N 1.42 2.55 0.25 3.13 0.00 -0.85 -4.96 121.76 123.29 3igv s ALA 80 Ca 0.05 -1.41 0.09 0.00 0.00 0.00 0.00 51.96 50.69 3igv s ALA 80 Cb -0.14 -0.52 -0.04 0.00 0.00 0.00 0.00 23.12 22.42 3igv s ALA 80 CO -0.06 0.57 0.00 -1.59 0.00 0.00 0.00 175.76 174.67 3igv s LYS 81 N -2.12 2.32 0.04 0.00 -2.85 -1.26 -4.52 119.74 111.35 3igv s LYS 81 Ca 0.16 -1.36 -0.30 0.00 -1.00 0.00 0.00 55.97 53.47 3igv s LYS 81 Cb -0.10 -2.20 -0.04 0.00 -2.06 0.00 0.00 37.83 33.43 3igv s LYS 81 CO 0.08 0.38 1.02 -0.51 0.10 0.00 0.00 175.35 176.42 3igv s LEU 82 N -3.56 4.40 0.13 2.77 1.43 -1.26 -4.59 118.68 118.00 3igv s LEU 82 Ca 0.31 1.77 -0.30 0.00 -1.03 0.00 0.00 54.13 54.88 3igv s LEU 82 Cb -0.07 -3.58 -0.06 0.00 0.03 0.00 0.00 46.19 42.51 3igv s LEU 82 CO 0.20 -0.26 1.00 -0.76 0.23 0.00 0.00 176.35 176.76 3igv s LEU 83 N 0.75 4.51 0.71 1.79 1.02 -0.78 -5.05 118.68 121.62 3igv s LEU 83 Ca 0.52 1.88 -0.13 0.00 0.02 0.00 0.00 54.13 56.42 3igv s LEU 83 Cb -0.23 -3.59 0.02 0.00 0.02 0.00 0.00 46.19 42.41 3igv s LEU 83 CO 0.29 -0.09 1.10 -0.94 0.02 0.00 0.00 176.35 176.73 3igv s SER 84 N -0.09 4.87 0.24 2.29 1.04 -1.26 -4.62 113.70 116.17 3igv s SER 84 Ca 0.47 1.90 -0.10 0.00 0.48 0.00 0.00 55.95 58.70 3igv s SER 84 Cb -0.25 -2.53 0.36 0.00 0.10 0.00 0.00 66.02 63.69 3igv s SER 84 CO 0.31 -1.79 1.61 0.58 0.98 0.00 0.00 173.24 174.93 3igv h VAL 85 N -0.50 0.27 0.16 5.02 2.07 -1.97 -1.86 116.25 119.44 3igv h VAL 85 Ca -0.45 -0.01 0.01 0.00 0.82 0.00 0.00 66.70 67.07 3igv h VAL 85 Cb 1.24 0.24 -0.03 0.00 -1.52 0.00 0.00 31.29 31.22 3igv h VAL 85 CO 0.53 0.00 -0.24 -0.33 0.02 0.00 0.00 177.57 177.55 3igv h GLU 86 N 0.03 -0.45 -0.50 1.57 3.07 -1.99 -0.82 114.58 115.49 3igv h GLU 86 Ca 0.38 0.03 0.05 0.00 -0.50 0.00 0.00 59.36 59.32 3igv h GLU 86 Cb 0.62 0.10 -0.05 0.00 -0.84 0.00 0.00 28.75 28.58 3igv h GLU 86 CO -0.75 -0.30 0.24 0.93 -1.40 0.00 0.00 179.01 177.73 3igv h GLU 87 N -0.47 0.46 -0.74 2.33 5.08 -1.81 -2.17 114.58 117.27 3igv h GLU 87 Ca 0.02 -0.03 -0.02 0.00 -1.00 0.00 0.00 59.36 58.33 3igv h GLU 87 Cb 0.47 -0.10 -0.04 0.00 0.50 0.00 0.00 28.75 29.58 3igv h GLU 87 CO -0.11 0.30 0.39 0.00 -1.00 0.00 0.00 179.01 178.59 3igv h ALA 88 N 1.28 1.30 -0.70 3.43 0.00 -1.04 -2.32 119.26 121.20 3igv h ALA 88 Ca 0.22 -0.12 -0.04 0.00 0.00 0.00 0.00 54.91 54.97 3igv h ALA 88 Cb 0.15 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 17.61 3igv h ALA 88 CO -0.17 0.56 0.28 0.00 0.00 0.00 0.00 179.25 179.93 3igv h LYS 90 N 1.01 0.00 -0.00 0.00 1.79 -0.88 -2.28 116.57 116.21 3igv h LYS 90 Ca 0.24 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.71 3igv h LYS 90 Cb 0.19 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.84 3igv h LYS 90 CO -0.02 0.00 -0.26 1.28 -1.08 0.00 0.00 179.45 179.37 3igv n LEU 91 N -2.98 0.64 -4.69 2.94 4.77 -0.77 -4.84 117.00 112.07 3igv n LEU 91 Ca -0.01 -0.05 -0.42 0.00 -0.03 0.00 0.00 56.01 55.49 3igv n LEU 91 Cb 0.18 -0.20 -0.03 0.00 -2.33 0.00 0.00 43.42 41.04 3igv n LEU 91 CO 0.22 0.13 0.79 -0.89 -1.33 0.00 0.00 177.39 176.31 3igv s THR 92 N -2.67 4.70 0.33 -5.08 2.01 -0.86 -0.69 115.64 113.39 3igv s THR 92 Ca 0.21 1.96 -0.28 0.00 0.31 0.00 0.00 61.69 63.89 3igv s THR 92 Cb 0.19 -4.26 -0.12 0.00 0.01 0.00 0.00 72.50 68.32 3igv s THR 92 CO 0.56 0.04 1.35 -2.65 -0.69 0.00 0.00 174.62 173.23 3igv n PRO 93 N 4.74 2.24 0.20 4.92 -0.02 -1.26 -4.78 135.00 141.03 3igv n PRO 93 Ca 0.08 0.79 0.04 0.00 -2.02 0.00 0.00 63.50 62.39 3igv n PRO 93 Cb 0.49 -2.41 0.46 0.00 -0.02 0.00 0.00 33.50 32.01 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 2.92 0.04 -0.64 0.52 0.11 -1.95 -2.18 132.00 130.82 3igv h PRO 94 Ca -0.47 -0.01 -0.14 0.00 0.11 0.00 0.00 66.00 65.49 3igv h PRO 94 Cb 1.27 -0.01 -0.09 0.00 0.11 0.00 0.00 31.00 32.29 3igv h PRO 94 CO 0.65 0.25 0.17 0.72 -0.21 0.00 0.00 178.00 179.58 3igv n HIS 95 N -4.28 2.16 -2.32 0.65 8.25 -1.26 -4.36 115.22 114.06 3igv n HIS 95 Ca -0.02 -1.09 -0.35 0.00 -0.26 0.00 0.00 57.72 56.00 3igv n HIS 95 Cb 0.28 -0.60 -0.01 0.00 1.12 0.00 0.00 29.99 30.77 3igv n HIS 95 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 3igv s SER 96 N -1.15 6.00 0.19 0.41 0.15 -0.82 -4.96 113.70 113.51 3igv s SER 96 Ca 0.53 2.16 -0.33 0.00 0.70 0.00 0.00 55.95 59.01 3igv s SER 96 Cb 0.43 -2.58 -0.13 0.00 -1.71 0.00 0.00 66.02 62.02 3igv s SER 96 CO 0.13 -1.03 1.60 0.00 1.20 0.00 0.00 173.24 175.14 3igv n ALA 97 N -0.97 1.78 -0.96 5.45 0.00 -1.26 -4.34 120.51 120.21 3igv n ALA 97 Ca 0.10 0.43 -0.31 0.00 0.00 0.00 0.00 53.44 53.65 3igv n ALA 97 Cb 0.50 -2.39 0.13 0.00 0.00 0.00 0.00 19.45 17.69 3igv n ALA 97 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 177.50 175.91 3igv s LYS 98 N 0.78 1.55 0.58 0.00 -2.85 -1.26 -4.62 119.74 113.93 3igv s LYS 98 Ca 0.76 1.46 -0.11 0.00 -1.00 0.00 0.00 55.97 57.09 3igv s LYS 98 Cb -0.62 -1.79 -0.04 0.00 -2.06 0.00 0.00 37.83 33.31 3igv s LYS 98 CO 0.38 -2.22 0.98 0.45 0.10 0.00 0.00 175.35 175.04 3igv s SER 99 N -2.80 6.28 0.00 0.03 0.15 -0.44 -4.63 113.70 112.29 3igv s SER 99 Ca 0.66 1.35 0.28 0.00 0.70 0.00 0.00 55.95 58.94 3igv s SER 99 Cb -0.22 -2.44 1.31 0.00 -1.71 0.00 0.00 66.02 62.97 3igv s SER 99 CO 0.55 -0.79 1.89 0.29 1.20 0.00 0.00 173.24 176.38 3igv n LYS 100 N -2.53 1.39 -0.95 5.44 5.02 -1.26 -4.03 118.16 121.23 3igv n LYS 100 Ca 0.05 -0.57 -0.08 0.00 -2.02 0.00 0.00 58.31 55.69 3igv n LYS 100 Cb 0.54 -1.46 0.18 0.00 -0.02 0.00 0.00 35.03 34.27 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 -0.29 1.41 -2.38 2.13 3.72 -1.26 -4.96 117.46 115.83 3igv n PHE 101 Ca 0.20 -1.74 -0.06 0.00 -0.05 0.00 0.00 57.45 55.80 3igv n PHE 101 Cb 0.24 -0.56 0.01 0.00 -0.94 0.00 0.00 39.48 38.23 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 0.29 3.25 1.37 0.00 -1.26 -5.03 105.19 102.72 3igv n GLY 102 Ca 0.37 -0.56 -0.13 0.00 0.00 0.00 0.00 46.02 45.70 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 -2.60 -0.30 0.10 1.61 -0.85 -1.26 -4.98 117.35 109.07 3igv s TYR 103 Ca 0.06 0.64 0.01 0.00 -0.52 0.00 0.00 57.07 57.27 3igv s TYR 103 Cb -0.03 0.12 0.01 0.00 0.38 0.00 0.00 41.96 42.45 3igv s TYR 103 CO 0.08 -0.30 0.10 0.41 -1.52 0.00 0.00 175.55 174.32 3igv n GLY 104 N 2.07 2.65 0.26 5.49 0.00 -1.26 -1.32 105.19 113.08 3igv n GLY 104 Ca -0.17 -2.18 -0.05 0.00 0.00 0.00 0.00 46.02 43.62 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 0.64 1.02 -0.59 4.61 0.00 -1.83 -2.59 119.26 120.51 3igv h ALA 105 Ca -0.06 -0.33 -0.02 0.00 0.00 0.00 0.00 54.91 54.50 3igv h ALA 105 Cb 0.23 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.84 3igv h ALA 105 CO 0.09 0.59 0.29 0.87 0.00 0.00 0.00 179.25 181.09 3igv h LYS 106 N 0.62 0.85 -0.75 0.00 6.56 -1.90 -1.34 116.57 120.61 3igv h LYS 106 Ca 0.10 -0.12 -0.02 0.00 -1.06 0.00 0.00 60.65 59.55 3igv h LYS 106 Cb 0.62 -0.15 -0.04 0.00 -0.57 0.00 0.00 32.23 32.09 3igv h LYS 106 CO 0.04 0.69 0.40 -0.44 -2.06 0.00 0.00 179.45 178.08 3igv h ASP 107 N 0.81 0.94 0.12 0.86 3.32 -1.92 -0.21 116.42 120.34 3igv h ASP 107 Ca 0.20 -0.10 -0.01 0.00 0.02 0.00 0.00 57.03 57.14 3igv h ASP 107 Cb 0.11 -0.24 0.00 0.00 0.22 0.00 0.00 39.33 39.42 3igv h ASP 107 CO -0.03 0.78 -0.06 0.58 -1.72 0.00 0.00 179.24 178.80 3igv h VAL 108 N 1.04 0.89 -0.62 -1.35 2.07 -1.13 -1.84 116.25 115.32 3igv h VAL 108 Ca 0.26 -0.03 0.00 0.00 0.82 0.00 0.00 66.70 67.75 3igv h VAL 108 Cb 0.05 0.92 -0.03 0.00 -1.52 0.00 0.00 31.29 30.71 3igv h VAL 108 CO -0.04 0.01 0.40 0.03 0.02 0.00 0.00 177.57 177.99 3igv h ARG 109 N -0.17 0.82 0.00 1.57 3.08 -1.08 -2.16 114.38 116.44 3igv h ARG 109 Ca -0.02 -0.06 0.00 0.00 0.07 0.00 0.00 59.98 59.98 3igv h ARG 109 Cb 0.13 -0.18 0.00 0.00 0.08 0.00 0.00 29.97 30.00 3igv h ARG 109 CO 0.03 0.56 0.00 -0.91 -1.07 0.00 0.00 179.97 178.57 3igv h ASN 110 N 0.84 0.00 -3.22 7.04 2.35 -0.88 -3.46 115.58 118.25 3igv h ASN 110 Ca 0.23 0.00 -0.26 0.00 -0.55 0.00 0.00 56.30 55.72 3igv h ASN 110 Cb -0.08 0.00 0.05 0.00 0.05 0.00 0.00 38.32 38.34 3igv h ASN 110 CO -0.05 0.00 -0.40 0.18 -1.65 0.00 0.00 177.43 175.51 3igv n LEU 111 N -2.54 -2.38 -4.75 1.61 4.77 -0.75 -5.01 117.00 107.95 3igv n LEU 111 Ca 0.00 -0.21 -0.33 0.00 -0.03 0.00 0.00 56.01 55.44 3igv n LEU 111 Cb 0.17 -2.10 0.07 0.00 -2.33 0.00 0.00 43.42 39.23 3igv n LEU 111 CO 0.18 0.20 0.76 -0.94 -1.33 0.00 0.00 177.39 176.26 3igv s SER 112 N -2.88 4.62 0.30 -1.43 1.04 -0.87 -4.76 113.70 109.72 3igv s SER 112 Ca 0.23 2.13 0.02 0.00 0.48 0.00 0.00 55.95 58.80 3igv s SER 112 Cb -0.10 -2.56 0.46 0.00 0.10 0.00 0.00 66.02 63.92 3igv s SER 112 CO 0.28 -1.96 1.79 0.77 0.98 0.00 0.00 173.24 175.09 3igv h SER 113 N -0.26 0.56 -0.60 7.02 4.64 -1.95 0.14 113.55 123.11 3igv h SER 113 Ca -0.47 -0.14 -0.06 0.00 -0.47 0.00 0.00 61.79 60.65 3igv h SER 113 Cb 1.26 -0.15 -0.02 0.00 -0.31 0.00 0.00 62.40 63.18 3igv h SER 113 CO 0.52 0.69 0.15 0.50 -0.87 0.00 0.00 176.83 177.82 3igv h LYS 114 N 0.54 0.95 -0.04 4.77 3.11 -1.96 0.83 116.57 124.77 3igv h LYS 114 Ca 0.10 -0.22 -0.05 0.00 -2.81 0.00 0.00 60.65 57.67 3igv h LYS 114 Cb 0.49 -0.13 0.00 0.00 -1.00 0.00 0.00 32.23 31.59 3igv h LYS 114 CO 0.03 0.87 -0.16 0.00 -2.81 0.00 0.00 179.45 177.38 3igv h ALA 115 N 1.04 0.08 -0.17 5.00 0.00 -1.84 -2.86 119.26 120.50 3igv h ALA 115 Ca 0.19 -0.38 -0.08 0.00 0.00 0.00 0.00 54.91 54.64 3igv h ALA 115 Cb 0.34 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 3igv h ALA 115 CO 0.00 0.01 -0.24 0.28 0.00 0.00 0.00 179.25 179.30 3igv h VAL 116 N -0.38 1.24 -0.13 0.00 2.07 -0.95 -2.38 116.25 115.73 3igv h VAL 116 Ca -0.01 -1.13 -0.19 0.00 0.82 0.00 0.00 66.70 66.19 3igv h VAL 116 Cb 0.80 1.38 0.01 0.00 -1.52 0.00 0.00 31.29 31.96 3igv h VAL 116 CO 0.03 0.35 -0.67 0.78 0.02 0.00 0.00 177.57 178.08 3igv h ASN 117 N 0.27 0.81 -0.48 0.57 -0.26 -0.91 -3.08 115.58 112.50 3igv h ASN 117 Ca 0.04 -0.64 -0.10 0.00 -0.56 0.00 0.00 56.30 55.05 3igv h ASN 117 Cb 0.58 -0.24 -0.02 0.00 -1.06 0.00 0.00 38.32 37.58 3igv h ASN 117 CO 0.04 1.32 -0.06 -0.74 -1.06 0.00 0.00 177.43 176.93 3igv h HIS 118 N 0.36 1.03 -0.63 1.19 2.76 -1.44 -2.71 115.15 115.70 3igv h HIS 118 Ca -0.05 -0.18 0.00 0.00 -2.20 0.00 0.00 60.37 57.94 3igv h HIS 118 Cb 1.31 -0.27 -0.03 0.00 1.55 0.00 0.00 27.41 29.97 3igv h HIS 118 CO 0.10 0.95 0.41 0.82 -1.30 0.00 0.00 177.93 178.91 3igv h ILE 119 N 0.85 1.17 -0.31 6.26 2.04 -1.50 -1.61 117.51 124.41 3igv h ILE 119 Ca 0.15 -0.31 -0.11 0.00 1.00 0.00 0.00 64.86 65.59 3igv h ILE 119 Cb 0.58 0.24 -0.01 0.00 -0.74 0.00 0.00 36.82 36.89 3igv h ILE 119 CO 0.04 0.16 -0.27 0.45 0.00 0.00 0.00 178.15 178.53 3igv h HIS 120 N 0.86 0.72 0.00 1.37 3.86 -1.39 -1.63 115.15 118.94 3igv h HIS 120 Ca 0.23 -0.17 -0.12 0.00 -1.16 0.00 0.00 60.37 59.15 3igv h HIS 120 Cb -0.09 -0.17 -0.02 0.00 1.06 0.00 0.00 27.41 28.19 3igv h HIS 120 CO 0.00 0.84 -0.59 0.66 0.86 0.00 0.00 177.93 179.69 3igv h SER 121 N 0.55 0.00 -0.18 2.45 4.64 -1.16 0.07 113.55 119.91 3igv h SER 121 Ca 0.07 0.00 -0.21 0.00 -0.47 0.00 0.00 61.79 61.18 3igv h SER 121 Cb 0.75 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.85 3igv h SER 121 CO 0.06 0.59 -0.73 0.58 -0.87 0.00 0.00 176.83 176.47 3igv h VAL 122 N 0.00 1.28 -0.55 0.95 2.07 -1.18 -0.48 116.25 118.34 3igv h VAL 122 Ca -0.01 -1.92 -0.07 0.00 0.82 0.00 0.00 66.70 65.53 3igv h VAL 122 Cb 1.14 1.91 -0.02 0.00 -1.52 0.00 0.00 31.29 32.80 3igv h VAL 122 CO 0.08 0.61 0.06 -0.25 0.02 0.00 0.00 177.57 178.09 3igv h TRP 123 N 0.56 0.99 -0.50 1.57 2.91 -1.18 -1.17 115.95 119.14 3igv h TRP 123 Ca -0.04 -0.15 -0.05 0.00 1.13 0.00 0.00 58.89 59.78 3igv h TRP 123 Cb 1.35 -0.27 -0.02 0.00 -0.51 0.00 0.00 29.16 29.72 3igv h TRP 123 CO 0.09 0.89 0.12 -0.22 -1.03 0.00 0.00 178.44 178.28 3igv h LYS 124 N 0.81 0.79 -0.68 2.65 3.64 -0.99 -2.60 116.57 120.20 3igv h LYS 124 Ca 0.16 -0.19 0.06 0.00 -1.27 0.00 0.00 60.65 59.41 3igv h LYS 124 Cb 0.45 -0.10 -0.05 0.00 -0.41 0.00 0.00 32.23 32.11 3igv h LYS 124 CO 0.02 0.77 0.38 0.22 -2.27 0.00 0.00 179.45 178.57 3igv h ASP 125 N 0.68 0.57 -0.53 4.20 3.58 -0.97 -2.56 116.42 121.39 3igv h ASP 125 Ca 0.16 0.03 -0.03 0.00 0.42 0.00 0.00 57.03 57.60 3igv h ASP 125 Cb 0.33 -0.09 -0.03 0.00 1.72 0.00 0.00 39.33 41.27 3igv h ASP 125 CO 0.00 0.37 0.22 -0.07 -2.88 0.00 0.00 179.24 176.88 3igv h LEU 126 N 0.71 0.76 -0.45 2.28 3.38 -0.92 -0.86 115.31 120.21 3igv h LEU 126 Ca 0.30 -0.10 -0.17 0.00 0.09 0.00 0.00 57.88 58.00 3igv h LEU 126 Cb 0.17 -0.20 -0.00 0.00 0.09 0.00 0.00 40.66 40.72 3igv h LEU 126 CO -0.18 0.69 -0.55 -0.07 0.09 0.00 0.00 178.44 178.43 3igv h LEU 127 N 0.82 0.73 -0.01 1.67 3.38 -1.20 -3.30 115.31 117.40 3igv h LEU 127 Ca 0.19 -0.39 -0.26 0.00 0.09 0.00 0.00 57.88 57.51 3igv h LEU 127 Cb 0.18 -0.21 0.02 0.00 0.09 0.00 0.00 40.66 40.73 3igv h LEU 127 CO -0.02 1.13 -1.09 -0.33 0.09 0.00 0.00 178.44 178.22 3igv h GLU 128 N 0.50 0.52 -5.10 1.13 5.08 -1.17 -3.45 114.58 112.09 3igv h GLU 128 Ca 0.01 -0.63 -0.67 0.00 -1.00 0.00 0.00 59.36 57.07 3igv h GLU 128 Cb 1.11 0.20 -0.32 0.00 0.50 0.00 0.00 28.75 30.23 3igv h GLU 128 CO 0.11 1.25 -0.82 0.34 -1.00 0.00 0.00 179.01 178.89 3igv s ASP 129 N -7.24 3.48 -0.10 1.42 -1.08 -0.35 -4.99 116.67 107.80 3igv s ASP 129 Ca -0.08 -0.55 0.13 0.00 -0.52 0.00 0.00 52.55 51.54 3igv s ASP 129 Cb 0.07 -1.54 0.25 0.00 -1.46 0.00 0.00 42.92 40.23 3igv s ASP 129 CO 0.90 0.03 1.15 0.35 0.52 0.00 0.00 175.17 178.12 3igv n THR 130 N 4.44 1.67 0.00 1.71 -2.24 -1.26 -4.60 114.28 113.99 3igv n THR 130 Ca -0.20 -1.84 0.00 0.00 -2.27 0.00 0.00 64.05 59.74 3igv n THR 130 Cb 0.51 -0.02 0.00 0.00 -2.10 0.00 0.00 70.33 68.72 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 -0.99 0.00 -1.99 2.28 0.24 -1.26 -4.66 118.33 111.94 3igv n VAL 131 Ca 0.12 0.00 -0.43 0.00 -2.04 0.00 0.00 64.34 62.00 3igv n VAL 131 Cb 0.56 -0.35 -0.03 0.00 -1.47 0.00 0.00 33.84 32.56 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 -1.48 3.46 0.35 3.34 2.01 -1.26 -4.76 115.64 117.30 3igv s THR 132 Ca 0.00 0.45 -0.26 0.00 0.31 0.00 0.00 61.69 62.19 3igv s THR 132 Cb 0.00 -3.64 -0.12 0.00 0.01 0.00 0.00 72.50 68.75 3igv s THR 132 CO 0.00 -0.42 1.06 -2.65 -0.69 0.00 0.00 174.62 171.92 3igv n PRO 133 N 8.47 1.51 -3.69 4.92 -0.02 -1.26 -4.77 135.00 140.16 3igv n PRO 133 Ca 0.23 0.53 -0.37 0.00 -2.02 0.00 0.00 63.50 61.87 3igv n PRO 133 Cb 0.47 -2.02 -0.07 0.00 -0.02 0.00 0.00 33.50 31.87 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 -1.16 5.33 0.24 4.25 1.01 -0.10 -4.94 121.20 125.84 3igv s ILE 134 Ca 0.60 0.44 -0.31 0.00 0.00 0.00 0.00 60.65 61.38 3igv s ILE 134 Cb -0.62 -3.54 -0.11 0.00 0.01 0.00 0.00 42.46 38.21 3igv s ILE 134 CO 0.59 0.53 1.57 -0.62 0.00 0.00 0.00 174.94 177.01 3igv s ASP 135 N -0.48 6.49 0.22 3.58 2.15 -1.26 -4.44 116.67 122.92 3igv s ASP 135 Ca 0.16 2.80 0.10 0.00 0.43 0.00 0.00 52.55 56.04 3igv s ASP 135 Cb -0.13 -2.62 -0.05 0.00 -0.30 0.00 0.00 42.92 39.82 3igv s ASP 135 CO 0.05 -0.85 -0.20 0.42 -0.17 0.00 0.00 175.17 174.42 3igv s THR 136 N 0.45 2.18 -0.14 1.71 -4.23 -1.18 -4.12 115.64 110.30 3igv s THR 136 Ca 0.66 -2.19 -0.04 0.00 -1.18 0.00 0.00 61.69 58.94 3igv s THR 136 Cb -0.46 -2.12 -0.03 0.00 1.34 0.00 0.00 72.50 71.23 3igv s THR 136 CO 0.40 -0.35 0.01 -0.89 -0.54 0.00 0.00 174.62 173.25 3igv s THR 137 N -2.30 4.32 -0.25 3.99 2.01 0.12 -1.84 115.64 121.69 3igv s THR 137 Ca 0.24 -0.22 -0.08 0.00 0.31 0.00 0.00 61.69 61.94 3igv s THR 137 Cb -0.05 -2.88 -0.03 0.00 0.01 0.00 0.00 72.50 69.55 3igv s THR 137 CO 0.11 0.52 0.09 -0.51 -0.69 0.00 0.00 174.62 174.14 3igv s ILE 138 N -0.08 4.45 0.14 1.82 2.07 0.62 -1.81 121.20 128.40 3igv s ILE 138 Ca 0.04 -0.12 0.09 0.00 -1.41 0.00 0.00 60.65 59.25 3igv s ILE 138 Cb -0.13 -3.09 -0.04 0.00 0.13 0.00 0.00 42.46 39.34 3igv s ILE 138 CO 0.02 0.33 -0.22 -0.04 -1.91 0.00 0.00 174.94 173.12 3igv s MET 139 N 1.61 1.28 -0.20 3.50 -1.94 0.09 -4.46 119.30 119.17 3igv s MET 139 Ca 0.06 -1.32 -0.15 0.00 -1.71 0.00 0.00 55.69 52.57 3igv s MET 139 Cb -0.15 -1.55 -0.04 0.00 2.01 0.00 0.00 34.83 35.10 3igv s MET 139 CO 0.05 0.35 0.38 0.00 -0.01 0.00 0.00 175.02 175.78 3igv s ALA 140 N -1.44 3.56 0.26 3.03 0.00 -1.26 0.19 121.76 126.10 3igv s ALA 140 Ca 0.12 -0.55 -0.29 0.00 0.00 0.00 0.00 51.96 51.24 3igv s ALA 140 Cb -0.09 -2.60 -0.09 0.00 0.00 0.00 0.00 23.12 20.34 3igv s ALA 140 CO 0.06 -0.28 0.98 0.15 0.00 0.00 0.00 175.76 176.67 3igv s LYS 141 N 1.26 4.77 -0.63 0.00 1.02 0.11 -4.67 119.74 121.61 3igv s LYS 141 Ca 0.18 1.54 -0.20 0.00 0.02 0.00 0.00 55.97 57.51 3igv s LYS 141 Cb -0.15 -3.19 0.10 0.00 -0.52 0.00 0.00 37.83 34.07 3igv s LYS 141 CO 0.08 0.41 0.80 -0.80 -0.92 0.00 0.00 175.35 174.92 3igv s ASN 142 N -1.18 6.21 -0.03 2.83 0.01 -1.26 -4.32 114.94 117.20 3igv s ASN 142 Ca 0.43 -1.35 0.07 0.00 -0.71 0.00 0.00 52.86 51.30 3igv s ASN 142 Cb -0.26 -2.34 -0.02 0.00 0.41 0.00 0.00 41.25 39.04 3igv s ASN 142 CO 0.33 -1.20 -0.24 -1.61 -1.51 0.00 0.00 177.10 172.86 3igv s GLU 143 N 3.05 2.08 -0.18 -0.60 2.02 -1.26 -4.88 118.70 118.93 3igv s GLU 143 Ca 0.15 -0.88 -0.17 0.00 0.02 0.00 0.00 54.97 54.10 3igv s GLU 143 Cb -0.21 -1.96 -0.04 0.00 0.10 0.00 0.00 34.13 32.02 3igv s GLU 143 CO 0.06 0.50 0.43 0.08 0.02 0.00 0.00 175.26 176.35 3igv s VAL 144 N -0.49 5.19 0.41 2.63 1.01 -1.26 -1.63 120.40 126.25 3igv s VAL 144 Ca 0.07 0.79 0.05 0.00 0.00 0.00 0.00 61.98 62.89 3igv s VAL 144 Cb -0.10 -3.76 -0.02 0.00 0.00 0.00 0.00 36.38 32.50 3igv s VAL 144 CO -0.00 0.27 0.18 0.49 0.00 0.00 0.00 175.10 176.04 3igv n PHE 145 N 4.25 -0.04 -4.96 5.22 3.72 -0.53 -4.68 117.46 120.43 3igv n PHE 145 Ca -0.08 -2.76 -0.32 0.00 -0.05 0.00 0.00 57.45 54.25 3igv n PHE 145 Cb 0.51 0.05 -0.14 0.00 -0.94 0.00 0.00 39.48 38.97 3igv n PHE 145 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3igv s VAL 147 N -0.73 2.26 0.00 0.00 -7.23 -0.86 -4.92 120.40 108.91 3igv s VAL 147 Ca 0.12 0.20 0.00 0.00 -1.81 0.00 0.00 61.98 60.48 3igv s VAL 147 Cb -0.10 -3.10 0.00 0.00 0.56 0.00 0.00 36.38 33.73 3igv s VAL 147 CO 0.01 0.00 0.00 0.00 -0.31 0.00 0.00 175.10 174.80 3igv n GLN 148 N -0.82 0.53 -3.98 4.82 6.02 -1.26 -5.08 117.38 117.61 3igv n GLN 148 Ca 0.09 0.00 -0.35 0.00 -0.01 0.00 0.00 57.00 56.73 3igv n GLN 148 Cb 0.45 -0.63 -0.13 0.00 1.02 0.00 0.00 30.24 30.95 3igv n GLN 148 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 177.06 177.08 3igv s ARG 154 N -1.27 3.58 0.03 -1.09 0.52 -1.26 -5.31 118.95 114.16 3igv s ARG 154 Ca 0.00 -0.53 -0.19 0.00 -0.52 0.00 0.00 55.73 54.49 3igv s ARG 154 Cb 0.00 -3.11 -0.06 0.00 0.52 0.00 0.00 34.95 32.29 3igv s ARG 154 CO 0.00 -0.06 0.55 0.15 0.02 0.00 0.00 175.30 175.96 3igv s LYS 155 N 1.20 4.21 0.52 3.54 1.02 -1.26 -5.08 119.74 123.89 3igv s LYS 155 Ca 0.03 0.68 -0.20 0.00 0.02 0.00 0.00 55.97 56.50 3igv s LYS 155 Cb -0.15 -3.27 -0.07 0.00 -0.52 0.00 0.00 37.83 33.83 3igv s LYS 155 CO 0.01 0.55 1.12 -2.14 -0.92 0.00 0.00 175.35 173.97 3igv s PRO 156 N -0.77 3.49 0.31 -1.68 0.02 -1.26 -4.81 135.00 130.30 3igv s PRO 156 Ca 0.29 1.59 -0.30 0.00 0.02 0.00 0.00 61.00 62.60 3igv s PRO 156 Cb -0.19 -2.08 -0.12 0.00 0.02 0.00 0.00 34.50 32.14 3igv s PRO 156 CO 0.17 -0.73 1.56 0.00 -0.33 0.00 0.00 177.00 177.67 3igv n ALA 157 N -1.12 2.42 -1.79 -1.55 0.00 -1.26 -4.94 120.51 112.27 3igv n ALA 157 Ca 0.11 0.37 -0.35 0.00 0.00 0.00 0.00 53.44 53.56 3igv n ALA 157 Cb 0.51 -2.44 -0.03 0.00 0.00 0.00 0.00 19.45 17.49 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 -0.89 3.86 -0.00 0.00 0.52 -1.26 -4.71 118.95 116.46 3igv s ARG 158 Ca 0.62 1.49 -0.18 0.00 -0.52 0.00 0.00 55.73 57.14 3igv s ARG 158 Cb -0.50 -2.26 -0.06 0.00 0.52 0.00 0.00 34.95 32.65 3igv s ARG 158 CO 0.52 -0.40 0.49 -0.51 0.02 0.00 0.00 175.30 175.42 3igv s LEU 159 N -3.20 4.44 -0.15 2.53 1.02 -1.26 0.08 118.68 122.14 3igv s LEU 159 Ca 0.64 1.05 0.01 0.00 0.02 0.00 0.00 54.13 55.85 3igv s LEU 159 Cb -0.20 -2.74 -0.00 0.00 0.02 0.00 0.00 46.19 43.26 3igv s LEU 159 CO 0.25 0.22 -0.16 -0.51 0.02 0.00 0.00 176.35 176.17 3igv s ILE 160 N -0.63 2.63 -0.16 -0.59 1.10 0.13 -4.86 121.20 118.82 3igv s ILE 160 Ca 0.27 -0.79 0.01 0.00 -0.51 0.00 0.00 60.65 59.62 3igv s ILE 160 Cb -0.17 -2.10 0.00 0.00 0.15 0.00 0.00 42.46 40.34 3igv s ILE 160 CO 0.15 0.52 -0.16 -0.69 -2.11 0.00 0.00 174.94 172.65 3igv s VAL 161 N 0.73 2.54 -0.07 4.00 1.01 -1.26 -0.74 120.40 126.62 3igv s VAL 161 Ca -0.07 -0.81 -0.16 0.00 0.00 0.00 0.00 61.98 60.94 3igv s VAL 161 Cb -0.16 -2.07 0.03 0.00 0.00 0.00 0.00 36.38 34.19 3igv s VAL 161 CO 0.01 0.52 0.39 0.72 0.00 0.00 0.00 175.10 176.74 3igv s PHE 162 N 0.87 -0.33 0.74 5.22 -0.71 -0.75 -0.20 117.98 122.81 3igv s PHE 162 Ca -0.04 0.67 -0.09 0.00 -1.04 0.00 0.00 56.93 56.42 3igv s PHE 162 Cb -0.15 0.15 0.06 0.00 -1.21 0.00 0.00 43.02 41.87 3igv s PHE 162 CO -0.01 -0.35 1.08 -1.25 -1.34 0.00 0.00 175.22 173.34 3igv s PRO 163 N -0.75 2.21 0.64 1.99 0.04 -1.26 0.16 135.00 138.03 3igv s PRO 163 Ca -0.08 -0.03 -0.18 0.00 0.04 0.00 0.00 61.00 60.75 3igv s PRO 163 Cb -0.04 -2.08 -0.01 0.00 0.04 0.00 0.00 34.50 32.41 3igv s PRO 163 CO 0.04 -1.33 1.24 0.34 0.04 0.00 0.00 177.00 177.32 3igv s ASP 164 N -4.51 4.80 0.40 6.66 2.15 -1.26 -4.70 116.67 120.21 3igv s ASP 164 Ca 0.60 2.46 0.20 0.00 0.43 0.00 0.00 52.55 56.25 3igv s ASP 164 Cb -0.11 -2.60 1.17 0.00 -0.30 0.00 0.00 42.92 41.08 3igv s ASP 164 CO 0.47 -1.86 1.72 0.25 -0.17 0.00 0.00 175.17 175.58 3igv h LEU 165 N 0.55 0.42 -0.76 -1.34 5.85 -1.82 0.13 115.31 118.35 3igv h LEU 165 Ca -0.50 0.11 0.04 0.00 0.84 0.00 0.00 57.88 58.37 3igv h LEU 165 Cb 1.31 0.06 -0.05 0.00 0.37 0.00 0.00 40.66 42.35 3igv h LEU 165 CO 0.53 -0.01 0.47 1.23 -0.34 0.00 0.00 178.44 180.33 3igv h GLY 166 N 0.32 1.10 0.79 3.75 0.00 -1.95 -2.07 103.07 105.01 3igv h GLY 166 Ca 0.67 -0.36 -0.03 0.00 0.00 0.00 0.00 47.33 47.61 3igv h GLY 166 CO -0.37 0.29 -0.01 -2.08 0.00 0.00 0.00 176.54 174.37 3igv h VAL 167 N 0.91 1.27 -0.91 4.60 2.07 -1.08 -2.71 116.25 120.39 3igv h VAL 167 Ca 0.31 -0.90 0.12 0.00 0.82 0.00 0.00 66.70 67.05 3igv h VAL 167 Cb 0.04 1.53 -0.07 0.00 -1.52 0.00 0.00 31.29 31.27 3igv h VAL 167 CO -0.12 0.27 0.58 0.03 0.02 0.00 0.00 177.57 178.35 3igv h ARG 168 N 0.03 0.80 -0.58 1.57 3.08 -1.25 0.29 114.38 118.31 3igv h ARG 168 Ca 0.05 -0.05 -0.09 0.00 0.07 0.00 0.00 59.98 59.95 3igv h ARG 168 Cb 0.41 -0.18 -0.02 0.00 0.08 0.00 0.00 29.97 30.26 3igv h ARG 168 CO 0.01 0.53 -0.01 0.28 -1.07 0.00 0.00 179.97 179.71 3igv h VAL 169 N 0.83 1.26 -0.60 2.04 2.07 -1.33 -2.68 116.25 117.84 3igv h VAL 169 Ca 0.44 -1.14 -0.07 0.00 0.82 0.00 0.00 66.70 66.75 3igv h VAL 169 Cb 0.55 0.82 -0.02 0.00 -1.52 0.00 0.00 31.29 31.12 3igv h VAL 169 CO -0.21 0.41 0.09 0.00 0.02 0.00 0.00 177.57 177.89 3igv h GLU 171 N 0.90 0.51 -0.75 0.00 5.08 -0.38 -0.19 114.58 119.75 3igv h GLU 171 Ca 0.18 -0.03 -0.04 0.00 -1.00 0.00 0.00 59.36 58.47 3igv h GLU 171 Cb 0.43 -0.12 -0.03 0.00 0.50 0.00 0.00 28.75 29.53 3igv h GLU 171 CO 0.01 0.34 0.30 0.87 -1.00 0.00 0.00 179.01 179.54 3igv h LYS 172 N 0.53 1.12 -0.10 2.33 1.57 -1.27 -0.93 116.57 119.82 3igv h LYS 172 Ca 0.47 -0.19 -0.00 0.00 -1.87 0.00 0.00 60.65 59.05 3igv h LYS 172 Cb 0.72 -0.19 -0.00 0.00 0.08 0.00 0.00 32.23 32.84 3igv h LYS 172 CO -0.41 0.90 0.05 0.52 -0.57 0.00 0.00 179.45 179.95 3igv h MET 173 N 1.09 0.14 0.00 3.15 2.86 -0.65 -2.65 114.93 118.87 3igv h MET 173 Ca 0.25 -0.02 -0.21 0.00 -2.06 0.00 0.00 59.70 57.67 3igv h MET 173 Cb 0.20 -0.03 -0.03 0.00 0.06 0.00 0.00 31.60 31.80 3igv h MET 173 CO -0.02 0.20 -1.00 0.00 1.06 0.00 0.00 176.91 177.15 3igv h ALA 174 N 0.93 0.41 0.00 6.32 0.00 -1.37 -2.07 119.26 123.48 3igv h ALA 174 Ca 0.03 -0.90 0.00 0.00 0.00 0.00 0.00 54.91 54.04 3igv h ALA 174 Cb 0.10 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.78 3igv h ALA 174 CO -0.00 1.21 0.00 1.28 0.00 0.00 0.00 179.25 181.74 3igv n LEU 175 N -3.32 0.10 -0.34 0.00 4.77 -0.36 -4.74 117.00 113.12 3igv n LEU 175 Ca -0.01 -0.26 -0.00 0.00 -0.03 0.00 0.00 56.01 55.71 3igv n LEU 175 Cb 0.93 0.00 0.16 0.00 -2.33 0.00 0.00 43.42 42.18 3igv n LEU 175 CO 0.46 0.03 1.28 0.22 -1.33 0.00 0.00 177.39 178.05 3igv h TYR 176 N 0.00 1.17 -0.21 -1.77 3.20 -1.55 -0.94 116.97 116.88 3igv h TYR 176 Ca 0.00 0.03 -0.07 0.00 3.14 0.00 0.00 58.73 61.83 3igv h TYR 176 Cb 0.08 -0.39 -0.00 0.00 1.54 0.00 0.00 36.73 37.95 3igv h TYR 176 CO 0.00 0.71 -0.15 0.22 -1.64 0.00 0.00 178.16 177.30 3igv h ASP 177 N 1.23 0.49 0.54 -2.11 3.58 -1.81 -2.53 116.42 115.82 3igv h ASP 177 Ca 0.36 -0.45 -0.02 0.00 0.42 0.00 0.00 57.03 57.34 3igv h ASP 177 Cb -0.07 -0.14 -0.01 0.00 1.72 0.00 0.00 39.33 40.83 3igv h ASP 177 CO -0.09 0.83 -0.43 0.58 -2.88 0.00 0.00 179.24 177.24 3igv h VAL 178 N 0.15 0.00 0.00 2.25 2.07 -1.77 -1.93 116.25 117.02 3igv h VAL 178 Ca 0.04 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.55 3igv h VAL 178 Cb 0.67 0.00 -0.00 0.00 -1.52 0.00 0.00 31.29 30.44 3igv h VAL 178 CO 0.04 0.00 -0.02 -0.37 0.02 0.00 0.00 177.57 177.24 3igv h VAL 179 N -0.95 0.18 0.00 2.57 -1.51 -1.27 0.37 116.25 115.64 3igv h VAL 179 Ca -0.07 -0.20 -0.16 0.00 -1.23 0.00 0.00 66.70 65.04 3igv h VAL 179 Cb 0.79 1.16 -0.02 0.00 -2.13 0.00 0.00 31.29 31.09 3igv h VAL 179 CO 0.01 0.02 -0.78 0.28 -1.23 0.00 0.00 177.57 175.87 3igv h SER 180 N 0.00 0.00 0.00 4.19 0.02 -1.30 -3.42 113.55 113.03 3igv h SER 180 Ca -0.00 0.00 -0.13 0.00 -0.84 0.00 0.00 61.79 60.82 3igv h SER 180 Cb 0.16 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 62.68 3igv h SER 180 CO 0.00 0.74 -1.46 0.41 -1.14 0.00 0.00 176.83 175.38 3igv n THR 181 N -3.27 0.46 -0.23 -2.27 -1.04 -0.13 -4.63 114.28 103.17 3igv n THR 181 Ca 0.00 -0.15 -0.06 0.00 -2.04 0.00 0.00 64.05 61.80 3igv n THR 181 Cb 0.84 -1.13 0.04 0.00 -1.82 0.00 0.00 70.33 68.26 3igv n THR 181 CO 0.00 0.00 0.00 0.25 -0.64 0.00 0.00 175.07 174.68 3igv h LEU 182 N -0.13 0.82 -0.87 -4.42 6.46 -0.57 -3.18 115.31 113.42 3igv h LEU 182 Ca -0.19 -0.10 0.05 0.00 -0.12 0.00 0.00 57.88 57.51 3igv h LEU 182 Cb 1.24 -0.21 -0.06 0.00 -0.73 0.00 0.00 40.66 40.90 3igv h LEU 182 CO -0.07 0.69 0.55 -0.65 -0.62 0.00 0.00 178.44 178.34 3igv h PRO 183 N 0.88 1.01 -0.31 5.25 0.11 -1.81 0.36 132.00 137.49 3igv h PRO 183 Ca 0.23 -0.06 -0.13 0.00 0.11 0.00 0.00 66.00 66.14 3igv h PRO 183 Cb 0.06 -0.23 -0.01 0.00 0.11 0.00 0.00 31.00 30.93 3igv h PRO 183 CO -0.03 0.67 -0.34 0.37 -0.21 0.00 0.00 178.00 178.45 3igv h GLN 184 N 1.04 0.70 -0.46 1.05 -0.00 -1.86 -1.32 115.11 114.27 3igv h GLN 184 Ca 0.36 -0.33 -0.09 0.00 -0.00 0.00 0.00 58.65 58.58 3igv h GLN 184 Cb 0.07 -0.01 -0.01 0.00 0.00 0.00 0.00 27.48 27.53 3igv h GLN 184 CO -0.14 0.94 -0.08 0.28 0.00 0.00 0.00 178.83 179.83 3igv h VAL 185 N 0.58 1.27 -0.21 2.39 2.07 -1.34 0.17 116.25 121.19 3igv h VAL 185 Ca 0.06 -1.19 -0.14 0.00 0.82 0.00 0.00 66.70 66.25 3igv h VAL 185 Cb 0.87 1.10 0.00 0.00 -1.52 0.00 0.00 31.29 31.74 3igv h VAL 185 CO 0.08 0.41 -0.42 0.58 0.02 0.00 0.00 177.57 178.23 3igv h VAL 186 N 0.70 1.32 -0.00 2.57 2.07 -0.90 -3.37 116.25 118.64 3igv h VAL 186 Ca 0.12 -1.65 0.00 0.00 0.82 0.00 0.00 66.70 65.99 3igv h VAL 186 Cb 0.62 1.84 0.00 0.00 -1.52 0.00 0.00 31.29 32.23 3igv h VAL 186 CO 0.04 0.51 -0.53 0.23 0.02 0.00 0.00 177.57 177.84 3igv n MET 187 N -4.21 2.89 0.00 1.57 2.81 -0.50 -4.88 117.12 114.80 3igv n MET 187 Ca -0.06 -0.08 0.00 0.00 -1.81 0.00 0.00 57.70 55.75 3igv n MET 187 Cb 0.55 -1.08 0.00 0.00 -0.71 0.00 0.00 33.22 31.98 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 1.25 3.62 0.00 3.03 0.00 0.58 -2.13 105.19 111.55 3igv n GLY 188 Ca 0.03 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.17 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 5.40 0.00 0.25 1.61 3.41 -1.26 -2.56 113.62 120.47 3igv n SER 189 Ca 0.00 0.21 0.14 0.00 -0.26 0.00 0.00 58.87 58.96 3igv n SER 189 Cb 0.00 -0.39 0.49 0.00 -0.26 0.00 0.00 64.21 64.05 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 -3.29 4.04 0.02 -1.59 -3.43 113.55 109.30 3igv h SER 190 Ca 0.00 0.00 -0.56 0.00 -0.84 0.00 0.00 61.79 60.39 3igv h SER 190 Cb 0.32 0.00 -0.06 0.00 0.14 0.00 0.00 62.40 62.80 3igv h SER 190 CO 0.00 0.07 1.03 -0.47 -1.14 0.00 0.00 176.83 176.32 3igv s TYR 191 N -3.52 2.51 -1.58 3.45 5.04 -1.06 -0.16 117.35 122.02 3igv s TYR 191 Ca 0.03 0.61 0.31 0.00 -2.44 0.00 0.00 57.07 55.57 3igv s TYR 191 Cb 0.08 -4.40 1.61 0.00 0.35 0.00 0.00 41.96 39.61 3igv s TYR 191 CO 0.60 -1.74 2.10 0.41 -1.34 0.00 0.00 175.55 175.58 3igv n GLY 192 N 5.06 -1.20 0.17 8.97 0.00 0.09 -3.51 105.19 114.77 3igv n GLY 192 Ca 0.13 -0.16 0.13 0.00 0.00 0.00 0.00 46.02 46.13 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 -1.20 0.00 0.60 1.61 3.72 -1.26 -3.37 117.46 117.56 3igv n PHE 193 Ca 0.17 0.00 0.13 0.00 -0.05 0.00 0.00 57.45 57.69 3igv n PHE 193 Cb 0.21 -0.17 0.33 0.00 -0.94 0.00 0.00 39.48 38.92 3igv n PHE 193 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3igv n GLN 194 N -0.85 0.28 -3.44 -1.08 10.64 -1.23 -3.30 117.38 118.40 3igv n GLN 194 Ca 0.13 0.18 -0.37 0.00 -1.83 0.00 0.00 57.00 55.10 3igv n GLN 194 Cb 0.32 -1.78 -0.06 0.00 -0.86 0.00 0.00 30.24 27.86 3igv n GLN 194 CO 0.00 0.00 0.00 0.71 -1.83 0.00 0.00 177.06 175.94 3igv s TYR 195 N -3.12 3.54 0.75 2.61 2.02 -1.22 -4.72 117.35 117.22 3igv s TYR 195 Ca 0.09 0.80 -0.12 0.00 -0.37 0.00 0.00 57.07 57.48 3igv s TYR 195 Cb 0.12 -2.42 0.04 0.00 -0.40 0.00 0.00 41.96 39.31 3igv s TYR 195 CO 0.63 0.30 1.13 -1.54 -1.57 0.00 0.00 175.55 174.50 3igv s SER 196 N 0.20 5.04 0.22 2.29 1.04 -1.26 -4.76 113.70 116.47 3igv s SER 196 Ca 0.22 0.98 -0.09 0.00 0.48 0.00 0.00 55.95 57.54 3igv s SER 196 Cb -0.15 -1.65 0.34 0.00 0.10 0.00 0.00 66.02 64.66 3igv s SER 196 CO 0.09 -1.59 1.69 -0.65 0.98 0.00 0.00 173.24 173.76 3igv h PRO 197 N -0.83 0.23 -0.72 4.02 0.11 -1.92 0.17 132.00 133.06 3igv h PRO 197 Ca -0.45 -0.01 -0.06 0.00 0.11 0.00 0.00 66.00 65.59 3igv h PRO 197 Cb 1.29 -0.05 -0.03 0.00 0.11 0.00 0.00 31.00 32.31 3igv h PRO 197 CO 0.65 0.15 0.23 0.78 -0.21 0.00 0.00 178.00 179.60 3igv h GLY 198 N 0.24 1.18 1.60 -0.55 0.00 -1.56 -1.63 103.07 102.35 3igv h GLY 198 Ca 0.34 -0.69 -0.10 0.00 0.00 0.00 0.00 47.33 46.88 3igv h GLY 198 CO -0.45 0.64 -0.30 1.46 0.00 0.00 0.00 176.54 177.89 3igv h GLN 199 N 1.06 0.46 -0.04 4.80 4.20 -1.35 -1.58 115.11 122.66 3igv h GLN 199 Ca 0.23 -0.19 -0.04 0.00 0.06 0.00 0.00 58.65 58.71 3igv h GLN 199 Cb 0.29 -0.02 0.00 0.00 0.30 0.00 0.00 27.48 28.05 3igv h GLN 199 CO -0.01 0.72 -0.12 -0.09 -0.67 0.00 0.00 178.83 178.66 3igv h ARG 200 N 0.40 0.16 -0.36 1.46 2.43 -0.51 -1.44 114.38 116.52 3igv h ARG 200 Ca 0.05 -0.11 0.07 0.00 -0.81 0.00 0.00 59.98 59.18 3igv h ARG 200 Cb 0.73 0.02 -0.07 0.00 -0.42 0.00 0.00 29.97 30.24 3igv h ARG 200 CO 0.06 0.72 -0.06 0.28 -1.51 0.00 0.00 179.97 179.46 3igv h VAL 201 N -0.38 0.67 -0.44 0.20 2.07 -1.33 0.17 116.25 117.21 3igv h VAL 201 Ca -0.00 -0.01 0.04 0.00 0.82 0.00 0.00 66.70 67.55 3igv h VAL 201 Cb 0.73 0.64 -0.04 0.00 -1.52 0.00 0.00 31.29 31.09 3igv h VAL 201 CO 0.03 0.01 0.20 -0.08 0.02 0.00 0.00 177.57 177.74 3igv h GLU 202 N 0.03 0.39 0.09 1.57 4.81 -1.29 -0.95 114.58 119.22 3igv h GLU 202 Ca 0.17 -0.02 -0.00 0.00 -0.13 0.00 0.00 59.36 59.38 3igv h GLU 202 Cb 0.26 -0.09 0.00 0.00 0.63 0.00 0.00 28.75 29.55 3igv h GLU 202 CO -0.35 0.25 -0.04 0.35 -0.73 0.00 0.00 179.01 178.50 3igv h PHE 203 N 0.40 -0.11 -0.21 0.92 3.57 -0.76 -1.14 116.94 119.61 3igv h PHE 203 Ca 0.19 -0.00 0.03 0.00 3.53 0.00 0.00 57.97 61.72 3igv h PHE 203 Cb 0.13 0.04 -0.03 0.00 2.79 0.00 0.00 35.95 38.88 3igv h PHE 203 CO -0.12 0.12 0.01 -0.07 -2.23 0.00 0.00 178.31 176.02 3igv h LEU 204 N -0.33 -0.06 0.12 0.59 3.38 -0.51 0.10 115.31 118.60 3igv h LEU 204 Ca -0.01 0.04 -0.01 0.00 0.09 0.00 0.00 57.88 57.99 3igv h LEU 204 Cb 0.28 0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.10 3igv h LEU 204 CO 0.02 -0.00 -0.06 0.58 0.09 0.00 0.00 178.44 179.07 3igv h VAL 205 N 0.08 0.97 -0.99 1.22 2.07 -1.20 -0.09 116.25 118.31 3igv h VAL 205 Ca 0.10 -0.36 0.08 0.00 0.82 0.00 0.00 66.70 67.33 3igv h VAL 205 Cb 0.11 1.20 -0.07 0.00 -1.52 0.00 0.00 31.29 31.01 3igv h VAL 205 CO -0.15 0.09 0.63 0.78 0.02 0.00 0.00 177.57 178.94 3igv h ASN 206 N -0.33 1.00 -0.31 0.57 2.35 -1.12 0.31 115.58 118.05 3igv h ASN 206 Ca -0.02 0.02 -0.02 0.00 -0.55 0.00 0.00 56.30 55.73 3igv h ASN 206 Cb 0.27 -0.19 -0.01 0.00 0.05 0.00 0.00 38.32 38.43 3igv h ASN 206 CO 0.03 0.62 0.10 0.74 -1.65 0.00 0.00 177.43 177.27 3igv h THR 207 N 1.12 1.20 -0.86 2.81 2.02 -0.83 -0.00 112.91 118.36 3igv h THR 207 Ca 0.44 -0.63 -0.01 0.00 0.77 0.00 0.00 66.41 66.98 3igv h THR 207 Cb 0.23 1.03 -0.04 0.00 -1.74 0.00 0.00 68.15 67.62 3igv h THR 207 CO -0.19 0.22 0.50 -0.25 0.37 0.00 0.00 175.52 176.16 3igv h TRP 208 N 0.35 1.15 0.00 3.16 2.91 -0.19 -2.99 115.95 120.35 3igv h TRP 208 Ca 0.10 -0.01 -0.13 0.00 1.13 0.00 0.00 58.89 59.98 3igv h TRP 208 Cb 0.23 -0.38 -0.02 0.00 -0.51 0.00 0.00 29.16 28.49 3igv h TRP 208 CO 0.00 0.78 -0.63 0.87 -1.03 0.00 0.00 178.44 178.44 3igv h LYS 209 N 1.20 0.00 0.00 2.65 1.57 -0.11 -3.19 116.57 118.68 3igv h LYS 209 Ca 0.31 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.09 3igv h LYS 209 Cb -0.02 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.29 3igv h LYS 209 CO -0.05 0.63 0.00 -1.13 -0.57 0.00 0.00 179.45 178.32 3igv n SER 210 N -3.56 0.00 -4.70 0.86 3.41 -0.04 -4.74 113.62 104.84 3igv n SER 210 Ca -0.00 -0.91 -0.35 0.00 -0.26 0.00 0.00 58.87 57.34 3igv n SER 210 Cb 0.68 0.00 -0.09 0.00 -0.26 0.00 0.00 64.21 64.54 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 3.79 0.04 4.33 -0.14 -1.21 -5.03 119.74 119.52 3igv s LYS 211 Ca 0.39 -0.29 -0.29 0.00 -1.36 0.00 0.00 55.97 54.42 3igv s LYS 211 Cb 0.18 -3.19 -0.17 0.00 -1.68 0.00 0.00 37.83 32.96 3igv s LYS 211 CO 0.30 0.43 1.45 0.87 -0.76 0.00 0.00 175.35 177.64 3igv h LYS 212 N 6.16 -0.66 -3.65 1.68 1.57 -1.89 -3.35 116.57 116.43 3igv h LYS 212 Ca -0.43 0.05 -0.68 0.00 -1.87 0.00 0.00 60.65 57.72 3igv h LYS 212 Cb 1.18 0.15 -0.37 0.00 0.08 0.00 0.00 32.23 33.27 3igv h LYS 212 CO 0.67 -0.38 -0.48 -0.80 -0.57 0.00 0.00 179.45 177.89 3igv s ASN 213 N -4.68 4.92 0.08 0.86 -0.87 -1.26 -5.06 114.94 108.93 3igv s ASN 213 Ca -0.16 -2.81 -0.31 0.00 -1.57 0.00 0.00 52.86 48.01 3igv s ASN 213 Cb 0.03 -1.77 -0.06 0.00 -0.02 0.00 0.00 41.25 39.42 3igv s ASN 213 CO 0.58 -0.34 1.26 -2.16 -2.57 0.00 0.00 177.10 173.87 3igv s PRO 214 N -0.00 4.39 0.01 -0.60 0.04 -1.26 0.99 135.00 138.57 3igv s PRO 214 Ca 0.16 1.87 0.03 0.00 0.04 0.00 0.00 61.00 63.09 3igv s PRO 214 Cb -0.22 -3.32 -0.01 0.00 0.04 0.00 0.00 34.50 30.99 3igv s PRO 214 CO -0.03 -0.32 -0.09 1.41 0.04 0.00 0.00 177.00 178.01 3igv s MET 215 N 1.11 0.68 0.05 4.56 1.75 -0.70 -4.75 119.30 122.00 3igv s MET 215 Ca 0.61 -0.42 -0.04 0.00 -1.25 0.00 0.00 55.69 54.59 3igv s MET 215 Cb -0.32 -0.64 -0.02 0.00 2.84 0.00 0.00 34.83 36.70 3igv s MET 215 CO 0.29 0.17 0.06 0.20 -0.65 0.00 0.00 175.02 175.09 3igv s GLY 216 N -0.50 0.26 -0.25 2.11 0.00 -0.35 -0.88 107.32 107.71 3igv s GLY 216 Ca 0.01 -0.77 -0.24 0.00 0.00 0.00 0.00 44.72 43.72 3igv s GLY 216 CO 0.00 -0.91 0.68 -0.11 0.00 0.00 0.00 173.10 172.77 3igv s PHE 217 N -3.14 -0.74 0.30 1.90 -0.71 -0.36 0.12 117.98 115.35 3igv s PHE 217 Ca -0.00 1.79 -0.13 0.00 -1.04 0.00 0.00 56.93 57.55 3igv s PHE 217 Cb 0.02 0.26 -0.08 0.00 -1.21 0.00 0.00 43.02 42.01 3igv s PHE 217 CO -0.07 -0.37 0.68 -1.54 -1.34 0.00 0.00 175.22 172.58 3igv s SER 218 N 0.28 6.70 -0.23 1.98 1.04 -1.26 -1.37 113.70 120.84 3igv s SER 218 Ca -0.01 1.14 -0.00 0.00 0.48 0.00 0.00 55.95 57.57 3igv s SER 218 Cb -0.05 -2.32 0.03 0.00 0.10 0.00 0.00 66.02 63.78 3igv s SER 218 CO 0.01 -0.18 -0.11 -0.47 0.98 0.00 0.00 173.24 173.47 3igv s TYR 219 N -1.97 3.00 -0.39 5.02 5.04 -0.29 -4.71 117.35 123.05 3igv s TYR 219 Ca 0.52 -1.67 -0.13 0.00 -2.44 0.00 0.00 57.07 53.34 3igv s TYR 219 Cb -0.10 -1.99 0.02 0.00 0.35 0.00 0.00 41.96 40.23 3igv s TYR 219 CO 0.20 -0.77 0.26 0.34 -1.34 0.00 0.00 175.55 174.24 3igv s ASP 220 N 1.29 5.96 0.25 4.32 2.15 -1.26 -4.10 116.67 125.27 3igv s ASP 220 Ca 0.01 -0.86 -0.25 0.00 0.43 0.00 0.00 52.55 51.88 3igv s ASP 220 Cb -0.16 -2.11 -0.09 0.00 -0.30 0.00 0.00 42.92 40.27 3igv s ASP 220 CO -0.07 -0.39 0.85 -0.89 -0.17 0.00 0.00 175.17 174.49 3igv s THR 221 N 1.64 4.31 -0.76 1.71 2.01 -1.26 -0.21 115.64 123.09 3igv s THR 221 Ca 0.04 1.71 -0.27 0.00 0.31 0.00 0.00 61.69 63.48 3igv s THR 221 Cb -0.19 -4.06 0.03 0.00 0.01 0.00 0.00 72.50 68.29 3igv s THR 221 CO 0.09 0.31 1.32 -0.60 -0.69 0.00 0.00 174.62 175.05 3igv s ARG 222 N -1.66 3.19 -0.74 4.92 3.52 -0.61 -4.25 118.95 123.33 3igv s ARG 222 Ca 0.43 -0.27 -0.03 0.00 -0.13 0.00 0.00 55.73 55.73 3igv s ARG 222 Cb -0.20 -4.28 0.00 0.00 -1.56 0.00 0.00 34.95 28.91 3igv s ARG 222 CO 0.25 -2.19 0.65 0.00 -0.81 0.00 0.00 175.30 173.21 3igv h PHE 224 N 0.37 0.34 -1.00 0.00 3.57 -1.96 -0.46 116.94 117.81 3igv h PHE 224 Ca -0.27 0.04 0.19 0.00 3.53 0.00 0.00 57.97 61.46 3igv h PHE 224 Cb 1.17 -0.03 -0.10 0.00 2.79 0.00 0.00 35.95 39.77 3igv h PHE 224 CO 0.19 -0.06 0.61 -0.44 -2.23 0.00 0.00 178.31 176.38 3igv h ASP 225 N 0.30 0.76 0.59 0.41 5.19 -1.91 -0.86 116.42 120.91 3igv h ASP 225 Ca 0.43 0.09 -0.13 0.00 -0.62 0.00 0.00 57.03 56.80 3igv h ASP 225 Cb 0.73 -0.04 -0.02 0.00 0.18 0.00 0.00 39.33 40.18 3igv h ASP 225 CO -0.50 0.26 -0.62 0.28 -3.12 0.00 0.00 179.24 175.54 3igv h SER 226 N 0.73 0.04 1.11 6.45 0.02 -1.39 -2.76 113.55 117.76 3igv h SER 226 Ca 0.58 -0.02 -0.10 0.00 -0.84 0.00 0.00 61.79 61.40 3igv h SER 226 Cb 0.94 -0.01 -0.01 0.00 0.14 0.00 0.00 62.40 63.45 3igv h SER 226 CO -0.37 0.65 -0.49 0.71 -1.14 0.00 0.00 176.83 176.20 3igv h THR 227 N 0.03 0.96 -2.34 -2.27 1.35 -1.02 -3.45 112.91 106.16 3igv h THR 227 Ca -0.01 -1.98 -0.56 0.00 -0.55 0.00 0.00 66.41 63.31 3igv h THR 227 Cb 1.11 2.21 0.00 0.00 -1.73 0.00 0.00 68.15 69.75 3igv h THR 227 CO 0.08 0.48 1.28 -0.69 -0.25 0.00 0.00 175.52 176.42 3igv s VAL 228 N -3.27 3.18 0.78 6.82 1.01 -1.09 -4.84 120.40 122.98 3igv s VAL 228 Ca 0.02 0.20 -0.07 0.00 0.00 0.00 0.00 61.98 62.13 3igv s VAL 228 Cb 0.10 -3.17 0.12 0.00 0.00 0.00 0.00 36.38 33.43 3igv s VAL 228 CO 0.72 -0.06 1.09 0.42 0.00 0.00 0.00 175.10 177.27 3igv s THR 229 N 5.73 2.17 0.30 3.92 -4.23 -1.26 -4.05 115.64 118.21 3igv s THR 229 Ca 0.88 -0.31 -0.01 0.00 -1.18 0.00 0.00 61.69 61.07 3igv s THR 229 Cb -0.36 -2.86 0.20 0.00 1.34 0.00 0.00 72.50 70.83 3igv s THR 229 CO 0.37 0.00 1.89 -0.08 -0.54 0.00 0.00 174.62 176.26 3igv h GLU 230 N -0.84 0.90 -0.38 3.99 4.81 -1.87 -2.56 114.58 118.64 3igv h GLU 230 Ca -0.42 -0.12 0.04 0.00 -0.13 0.00 0.00 59.36 58.73 3igv h GLU 230 Cb 1.28 -0.17 -0.04 0.00 0.63 0.00 0.00 28.75 30.45 3igv h GLU 230 CO 0.48 0.71 0.13 -0.97 -0.73 0.00 0.00 179.01 178.63 3igv h ASN 231 N 0.90 0.14 -1.00 1.04 -1.24 -1.96 -2.02 115.58 111.44 3igv h ASN 231 Ca 0.22 0.04 0.02 0.00 0.71 0.00 0.00 56.30 57.29 3igv h ASN 231 Cb 0.12 0.03 -0.05 0.00 0.73 0.00 0.00 38.32 39.14 3igv h ASN 231 CO -0.03 0.11 0.66 0.44 -1.29 0.00 0.00 177.43 177.33 3igv h ASP 232 N 0.28 1.13 0.33 1.15 3.32 -1.83 0.14 116.42 120.93 3igv h ASP 232 Ca 0.17 -0.02 -0.14 0.00 0.02 0.00 0.00 57.03 57.06 3igv h ASP 232 Cb 0.15 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 39.41 3igv h ASP 232 CO -0.18 0.81 -0.56 0.40 -1.72 0.00 0.00 179.24 177.99 3igv h ILE 233 N 1.33 1.37 -0.17 0.35 2.04 -1.36 0.41 117.51 121.48 3igv h ILE 233 Ca 0.37 -1.87 -0.20 0.00 1.00 0.00 0.00 64.86 64.17 3igv h ILE 233 Cb -0.12 1.92 0.01 0.00 -0.74 0.00 0.00 36.82 37.89 3igv h ILE 233 CO -0.09 0.55 -0.66 0.03 0.00 0.00 0.00 178.15 177.98 3igv h ARG 234 N 0.19 0.74 -0.09 2.37 3.08 -0.79 -1.97 114.38 117.92 3igv h ARG 234 Ca 0.00 -0.58 -0.00 0.00 0.07 0.00 0.00 59.98 59.47 3igv h ARG 234 Cb 1.04 0.11 -0.00 0.00 0.08 0.00 0.00 29.97 31.19 3igv h ARG 234 CO 0.09 1.19 0.04 0.28 -1.07 0.00 0.00 179.97 180.50 3igv h VAL 235 N 0.46 1.12 -0.77 2.04 2.07 -0.65 -0.86 116.25 119.66 3igv h VAL 235 Ca -0.04 -0.35 0.18 0.00 0.82 0.00 0.00 66.70 67.32 3igv h VAL 235 Cb 1.29 1.19 -0.12 0.00 -1.52 0.00 0.00 31.29 32.12 3igv h VAL 235 CO 0.14 0.10 0.11 -0.08 0.02 0.00 0.00 177.57 177.86 3igv h GLU 236 N 0.02 0.18 -0.47 1.57 4.81 -0.97 -1.73 114.58 117.98 3igv h GLU 236 Ca 0.03 -0.01 -0.12 0.00 -0.13 0.00 0.00 59.36 59.13 3igv h GLU 236 Cb 0.13 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.45 3igv h GLU 236 CO -0.00 0.12 -0.19 1.49 -0.73 0.00 0.00 179.01 179.70 3igv h GLU 237 N 0.18 0.92 0.00 1.92 4.81 -0.78 -2.52 114.58 119.12 3igv h GLU 237 Ca 0.44 -0.37 -0.07 0.00 -0.13 0.00 0.00 59.36 59.23 3igv h GLU 237 Cb 0.79 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 30.11 3igv h GLU 237 CO -0.60 1.02 -0.34 0.66 -0.73 0.00 0.00 179.01 179.02 3igv h SER 238 N 0.80 0.00 -0.51 1.04 4.64 -0.58 -0.02 113.55 118.92 3igv h SER 238 Ca 0.11 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.40 3igv h SER 238 Cb 0.74 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.80 3igv h SER 238 CO 0.06 0.34 0.20 0.40 -0.87 0.00 0.00 176.83 176.96 3igv h ILE 239 N 0.00 1.22 -0.80 0.95 2.04 -1.13 -2.70 117.51 117.09 3igv h ILE 239 Ca -0.00 -0.67 -0.02 0.00 1.00 0.00 0.00 64.86 65.16 3igv h ILE 239 Cb 0.69 0.71 -0.04 0.00 -0.74 0.00 0.00 36.82 37.44 3igv h ILE 239 CO 0.04 0.25 0.41 1.88 0.00 0.00 0.00 178.15 180.74 3igv h TYR 240 N 0.68 1.13 0.00 1.37 0.05 -0.86 -2.82 116.97 116.52 3igv h TYR 240 Ca 0.17 -0.04 0.00 0.00 0.05 0.00 0.00 58.73 58.91 3igv h TYR 240 Cb 0.20 -0.35 0.00 0.00 1.01 0.00 0.00 36.73 37.59 3igv h TYR 240 CO 0.01 0.81 0.00 1.04 -1.05 0.00 0.00 178.16 178.96 3igv n GLN 241 N -4.38 0.20 0.24 4.88 1.13 -0.12 -2.15 117.38 117.18 3igv n GLN 241 Ca 0.08 0.43 0.10 0.00 -1.94 0.00 0.00 57.00 55.67 3igv n GLN 241 Cb 0.12 -1.89 0.60 0.00 0.11 0.00 0.00 30.24 29.18 3igv n GLN 241 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 3igv s ASP 244 N -2.63 6.05 0.12 0.00 -1.08 0.71 -4.98 116.67 114.85 3igv s ASP 244 Ca 0.68 0.14 0.08 0.00 -0.52 0.00 0.00 52.55 52.93 3igv s ASP 244 Cb -0.23 -2.55 -0.04 0.00 -1.46 0.00 0.00 42.92 38.64 3igv s ASP 244 CO 0.52 -1.80 -0.19 -0.76 0.52 0.00 0.00 175.17 173.46 3igv s LEU 245 N 6.30 2.35 0.39 -1.34 1.43 -1.26 -2.01 118.68 124.53 3igv s LEU 245 Ca 0.50 -0.74 -0.27 0.00 -1.03 0.00 0.00 54.13 52.60 3igv s LEU 245 Cb -0.10 -0.80 -0.09 0.00 0.03 0.00 0.00 46.19 45.22 3igv s LEU 245 CO 0.23 0.00 1.35 0.00 0.23 0.00 0.00 176.35 178.15 3igv s ALA 246 N -1.51 3.36 0.58 4.21 0.00 -1.26 -4.85 121.76 122.29 3igv s ALA 246 Ca 0.08 1.32 0.28 0.00 0.00 0.00 0.00 51.96 53.64 3igv s ALA 246 Cb -0.08 -3.52 1.56 0.00 0.00 0.00 0.00 23.12 21.08 3igv s ALA 246 CO 0.05 -0.86 2.04 -1.35 0.00 0.00 0.00 175.76 175.63 3igv h PRO 247 N 2.85 0.00 -0.49 0.00 0.11 -2.00 0.30 132.00 132.78 3igv h PRO 247 Ca -0.50 0.00 -0.08 0.00 0.11 0.00 0.00 66.00 65.54 3igv h PRO 247 Cb 1.24 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.33 3igv h PRO 247 CO 0.63 0.00 -0.01 0.93 -0.21 0.00 0.00 178.00 179.35 3igv h GLU 248 N 0.00 0.82 -0.31 1.05 5.08 -2.00 -2.62 114.58 116.60 3igv h GLU 248 Ca 0.14 -0.23 -0.17 0.00 -1.00 0.00 0.00 59.36 58.10 3igv h GLU 248 Cb 0.72 -0.09 -0.00 0.00 0.50 0.00 0.00 28.75 29.87 3igv h GLU 248 CO -0.00 0.83 -0.47 0.00 -1.00 0.00 0.00 179.01 178.36 3igv h ALA 249 N 1.22 0.56 -0.33 3.43 0.00 -0.79 -2.44 119.26 120.92 3igv h ALA 249 Ca 0.15 -0.49 -0.01 0.00 0.00 0.00 0.00 54.91 54.56 3igv h ALA 249 Cb 0.47 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.15 3igv h ALA 249 CO 0.02 0.68 0.17 0.00 0.00 0.00 0.00 179.25 180.12 3igv h ARG 250 N 0.67 0.46 -0.24 0.00 3.08 -1.27 -0.54 114.38 116.55 3igv h ARG 250 Ca 0.03 -0.06 -0.01 0.00 0.07 0.00 0.00 59.98 60.02 3igv h ARG 250 Cb 1.06 -0.09 -0.01 0.00 0.08 0.00 0.00 29.97 31.02 3igv h ARG 250 CO 0.11 0.41 0.12 0.37 -1.07 0.00 0.00 179.97 179.90 3igv h GLN 251 N 0.40 0.34 -0.72 0.04 5.75 -1.51 -2.06 115.11 117.35 3igv h GLN 251 Ca 0.11 -0.05 -0.03 0.00 -0.15 0.00 0.00 58.65 58.53 3igv h GLN 251 Cb 0.09 -0.06 -0.03 0.00 1.07 0.00 0.00 27.48 28.54 3igv h GLN 251 CO -0.02 0.35 0.33 0.00 -2.65 0.00 0.00 178.83 176.84 3igv h ALA 252 N 0.98 0.93 -0.07 3.38 0.00 -1.28 -0.45 119.26 122.75 3igv h ALA 252 Ca 0.08 -0.16 -0.00 0.00 0.00 0.00 0.00 54.91 54.83 3igv h ALA 252 Cb 0.12 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 17.62 3igv h ALA 252 CO -0.01 0.50 0.03 0.82 0.00 0.00 0.00 179.25 180.59 3igv h ILE 253 N 1.01 1.14 -0.54 0.00 2.04 -1.04 -0.93 117.51 119.19 3igv h ILE 253 Ca 0.24 -0.42 0.01 0.00 1.00 0.00 0.00 64.86 65.70 3igv h ILE 253 Cb 0.14 1.30 -0.03 0.00 -0.74 0.00 0.00 36.82 37.49 3igv h ILE 253 CO -0.03 0.12 0.35 0.50 0.00 0.00 0.00 178.15 179.09 3igv h LYS 254 N -0.05 0.68 0.17 2.37 3.64 -1.20 -1.22 116.57 120.96 3igv h LYS 254 Ca 0.02 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.36 3igv h LYS 254 Cb 0.17 -0.15 -0.01 0.00 -0.41 0.00 0.00 32.23 31.82 3igv h LYS 254 CO -0.00 0.45 -0.14 1.03 -2.27 0.00 0.00 179.45 178.51 3igv h SER 255 N 0.70 -0.37 -0.55 4.20 0.87 -1.00 -1.72 113.55 115.68 3igv h SER 255 Ca 0.20 0.03 -0.00 0.00 -1.23 0.00 0.00 61.79 60.79 3igv h SER 255 Cb -0.05 0.13 -0.03 0.00 -0.44 0.00 0.00 62.40 62.01 3igv h SER 255 CO -0.06 -0.22 0.34 -0.07 -0.53 0.00 0.00 176.83 176.29 3igv h LEU 256 N -0.33 0.66 0.24 2.23 3.38 -1.01 0.04 115.31 120.52 3igv h LEU 256 Ca -0.00 -0.03 -0.01 0.00 0.09 0.00 0.00 57.88 57.92 3igv h LEU 256 Cb 0.30 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 40.89 3igv h LEU 256 CO -0.02 0.51 -0.12 0.74 0.09 0.00 0.00 178.44 179.64 3igv h THR 257 N 0.77 0.81 -0.32 0.22 2.02 -1.01 0.13 112.91 115.52 3igv h THR 257 Ca 0.20 -0.30 -0.11 0.00 0.77 0.00 0.00 66.41 66.98 3igv h THR 257 Cb -0.04 0.98 -0.01 0.00 -1.74 0.00 0.00 68.15 67.34 3igv h THR 257 CO -0.04 0.07 -0.24 -0.33 0.37 0.00 0.00 175.52 175.35 3igv h GLU 258 N -0.48 0.62 0.00 6.66 4.39 -0.98 -0.18 114.58 124.61 3igv h GLU 258 Ca -0.03 -0.24 -0.23 0.00 0.34 0.00 0.00 59.36 59.19 3igv h GLU 258 Cb 0.36 -0.03 -0.04 0.00 -0.10 0.00 0.00 28.75 28.93 3igv h GLU 258 CO 0.05 0.81 -1.90 0.54 -1.16 0.00 0.00 179.01 177.35 3igv n ARG 259 N -4.11 0.65 0.06 2.33 1.74 -0.03 -4.68 116.66 112.62 3igv n ARG 259 Ca -0.00 0.08 0.00 0.00 -0.77 0.00 0.00 57.85 57.16 3igv n ARG 259 Cb 0.42 -1.66 0.00 0.00 -1.02 0.00 0.00 32.46 30.21 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 -2.76 0.65 -0.22 0.55 7.94 -0.11 -0.92 117.00 122.13 3igv n LEU 260 Ca -0.18 0.19 -0.08 0.00 -1.11 0.00 0.00 56.01 54.82 3igv n LEU 260 Cb 0.94 -0.12 0.03 0.00 0.53 0.00 0.00 43.42 44.80 3igv n LEU 260 CO 0.44 -0.65 0.88 1.88 -1.11 0.00 0.00 177.39 178.83 3igv h TYR 261 N 0.00 1.07 -0.84 1.96 0.05 -1.04 -2.67 116.97 115.50 3igv h TYR 261 Ca 0.00 -0.15 -0.02 0.00 0.05 0.00 0.00 58.73 58.62 3igv h TYR 261 Cb 0.14 -0.29 -0.04 0.00 1.01 0.00 0.00 36.73 37.55 3igv h TYR 261 CO 0.00 0.92 0.47 0.82 -1.05 0.00 0.00 178.16 179.32 3igv h ILE 262 N 0.91 1.24 0.00 -2.88 2.04 -1.28 -3.42 117.51 114.12 3igv h ILE 262 Ca 0.18 -0.60 0.00 0.00 1.00 0.00 0.00 64.86 65.45 3igv h ILE 262 Cb 0.42 0.10 0.00 0.00 -0.74 0.00 0.00 36.82 36.60 3igv h ILE 262 CO 0.01 0.27 0.00 0.61 0.00 0.00 0.00 178.15 179.04 3igv n GLY 263 N -1.17 -0.94 0.00 5.37 0.00 -1.01 -3.94 105.19 103.50 3igv n GLY 263 Ca 0.09 -1.31 0.00 0.00 0.00 0.00 0.00 46.02 44.80 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 -0.95 0.18 3.77 -0.02 0.00 -0.94 -4.04 105.19 103.20 3igv n GLY 264 Ca 0.00 -1.13 -0.36 0.00 0.00 0.00 0.00 46.02 44.53 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 3.51 -0.13 1.61 0.04 -1.26 -1.66 135.00 135.10 3igv s PRO 265 Ca 0.00 1.74 -0.02 0.00 0.04 0.00 0.00 61.00 62.75 3igv s PRO 265 Cb 0.00 -2.20 -0.03 0.00 0.04 0.00 0.00 34.50 32.31 3igv s PRO 265 CO 0.00 -0.75 -0.06 -0.51 0.04 0.00 0.00 177.00 175.72 3igv s LEU 266 N -3.44 3.17 -0.06 -3.56 1.43 -0.30 -3.13 118.68 112.80 3igv s LEU 266 Ca 0.69 -0.13 0.04 0.00 -1.03 0.00 0.00 54.13 53.70 3igv s LEU 266 Cb -0.27 -1.74 0.00 0.00 0.03 0.00 0.00 46.19 44.21 3igv s LEU 266 CO 0.32 0.21 -0.16 -0.89 0.23 0.00 0.00 176.35 176.06 3igv s THR 267 N 0.10 1.42 0.96 5.49 2.01 -0.77 -0.23 115.64 124.61 3igv s THR 267 Ca -0.02 -0.68 -0.15 0.00 0.31 0.00 0.00 61.69 61.16 3igv s THR 267 Cb -0.14 -1.24 0.18 0.00 0.01 0.00 0.00 72.50 71.31 3igv s THR 267 CO 0.03 0.41 1.23 0.54 -0.69 0.00 0.00 174.62 176.14 3igv s ASN 268 N 0.29 3.15 0.52 3.53 2.20 -0.19 -0.28 114.94 124.17 3igv s ASN 268 Ca -0.10 0.56 0.35 0.00 -0.94 0.00 0.00 52.86 52.73 3igv s ASN 268 Cb -0.14 -0.82 1.73 0.00 -2.00 0.00 0.00 41.25 40.02 3igv s ASN 268 CO 0.04 -2.73 2.06 0.77 -2.94 0.00 0.00 177.10 174.29 3igv h SER 269 N -1.63 0.00 0.37 3.54 4.64 -1.78 -2.00 113.55 116.69 3igv h SER 269 Ca -0.46 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.86 3igv h SER 269 Cb 1.28 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.37 3igv h SER 269 CO 0.48 0.00 -0.76 0.29 -0.87 0.00 0.00 176.83 175.96 3igv n LYS 270 N -2.84 0.08 0.00 4.77 5.02 -1.26 -4.97 118.16 118.96 3igv n LYS 270 Ca -0.01 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.28 3igv n LYS 270 Cb 0.16 -1.53 0.00 0.00 -0.02 0.00 0.00 35.03 33.64 3igv n LYS 270 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3igv n GLY 271 N 1.46 0.85 3.84 0.72 0.00 -0.75 -5.10 105.19 106.22 3igv n GLY 271 Ca 0.04 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.73 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 -0.75 4.03 0.03 1.61 -0.21 -1.26 -4.82 119.66 118.29 3igv s GLN 272 Ca 0.00 0.66 -0.30 0.00 0.02 0.00 0.00 55.36 55.73 3igv s GLN 272 Cb 0.00 -2.58 -0.04 0.00 1.00 0.00 0.00 33.01 31.38 3igv s GLN 272 CO 0.00 0.24 1.11 1.21 -2.12 0.00 0.00 175.29 175.74 3igv s ASN 273 N -2.12 7.19 -0.03 5.90 3.04 -1.26 -1.02 114.94 126.65 3igv s ASN 273 Ca 0.50 1.86 0.19 0.00 0.04 0.00 0.00 52.86 55.45 3igv s ASN 273 Cb -0.12 -2.57 -0.30 0.00 -1.54 0.00 0.00 41.25 36.72 3igv s ASN 273 CO 0.19 -0.40 0.43 0.00 -3.04 0.00 0.00 177.10 174.28 3igv n GLY 275 N 1.41 0.17 3.00 0.00 0.00 -1.24 -1.06 105.19 107.46 3igv n GLY 275 Ca -0.03 -1.12 -0.09 0.00 0.00 0.00 0.00 46.02 44.78 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 -4.00 0.25 -0.07 1.61 5.04 0.86 -1.15 117.35 119.90 3igv s TYR 276 Ca 0.00 -0.51 0.04 0.00 -2.44 0.00 0.00 57.07 54.16 3igv s TYR 276 Cb 0.00 -0.18 -0.01 0.00 0.35 0.00 0.00 41.96 42.11 3igv s TYR 276 CO 0.00 -0.21 -0.21 0.50 -1.34 0.00 0.00 175.55 174.30 3igv s ARG 277 N -1.55 2.69 -0.14 4.97 3.52 -0.67 -1.61 118.95 126.15 3igv s ARG 277 Ca -0.15 -0.82 0.15 0.00 -0.13 0.00 0.00 55.73 54.78 3igv s ARG 277 Cb -0.09 -2.29 0.39 0.00 -1.56 0.00 0.00 34.95 31.40 3igv s ARG 277 CO -0.01 0.40 1.19 0.54 -0.81 0.00 0.00 175.30 176.61 3igv n ARG 278 N 2.91 1.11 -2.95 5.12 1.74 -0.43 -2.21 116.66 121.96 3igv n ARG 278 Ca -0.17 -2.83 -0.08 0.00 -0.77 0.00 0.00 57.85 53.99 3igv n ARG 278 Cb 0.52 -1.17 -0.03 0.00 -1.02 0.00 0.00 32.46 30.75 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 -2.57 4.15 0.15 0.00 6.06 -1.04 -4.64 118.95 121.05 3igv s ARG 280 Ca 0.17 2.55 -0.29 0.00 -2.50 0.00 0.00 55.73 55.66 3igv s ARG 280 Cb 0.01 -3.31 -0.07 0.00 0.06 0.00 0.00 34.95 31.64 3igv s ARG 280 CO 0.12 -0.76 0.92 0.00 -2.50 0.00 0.00 175.30 173.08 3igv s ALA 281 N 1.83 3.31 -0.07 6.12 0.00 -1.26 -4.79 121.76 126.90 3igv s ALA 281 Ca 0.76 0.54 0.18 0.00 0.00 0.00 0.00 51.96 53.44 3igv s ALA 281 Cb -0.47 -3.20 0.34 0.00 0.00 0.00 0.00 23.12 19.79 3igv s ALA 281 CO 0.33 0.09 1.57 0.66 0.00 0.00 0.00 175.76 178.41 3igv h SER 282 N 5.03 0.00 -1.35 0.00 4.64 -1.90 -3.37 113.55 116.61 3igv h SER 282 Ca -0.44 0.00 -0.66 0.00 -0.47 0.00 0.00 61.79 60.22 3igv h SER 282 Cb 1.21 0.00 -0.34 0.00 -0.31 0.00 0.00 62.40 62.96 3igv h SER 282 CO 0.70 0.40 0.29 0.61 -0.87 0.00 0.00 176.83 177.96 3igv n GLY 283 N 0.86 5.90 3.39 -0.77 0.00 0.71 -4.15 105.19 111.13 3igv n GLY 283 Ca 0.01 -2.52 -0.20 0.00 0.00 0.00 0.00 46.02 43.31 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 -5.00 1.67 0.41 1.61 -7.23 -1.20 -4.41 120.40 106.25 3igv s VAL 284 Ca 0.55 -2.16 0.10 0.00 -1.81 0.00 0.00 61.98 58.66 3igv s VAL 284 Cb 0.45 -2.26 0.19 0.00 0.56 0.00 0.00 36.38 35.32 3igv s VAL 284 CO -0.16 -0.44 1.97 0.25 -0.31 0.00 0.00 175.10 176.41 3igv h LEU 285 N 2.42 0.21 -0.34 1.32 5.85 -1.81 -2.56 115.31 120.39 3igv h LEU 285 Ca -0.39 -0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.30 3igv h LEU 285 Cb 1.23 -0.05 0.00 0.00 0.37 0.00 0.00 40.66 42.20 3igv h LEU 285 CO 0.65 0.32 -0.01 0.35 -0.34 0.00 0.00 178.44 179.40 3igv n THR 286 N -4.34 0.00 -0.04 1.05 -2.24 -1.26 -4.26 114.28 103.20 3igv n THR 286 Ca -0.01 -0.09 -0.08 0.00 -2.27 0.00 0.00 64.05 61.61 3igv n THR 286 Cb 0.22 -0.13 -0.02 0.00 -2.10 0.00 0.00 70.33 68.30 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 0.83 0.61 0.24 4.28 2.02 -1.72 0.24 112.91 119.41 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 0.21 0.61 0.00 0.00 -1.74 0.00 0.00 68.15 67.24 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 -0.12 -0.27 -0.98 4.18 0.87 -1.74 -2.12 113.55 113.37 3igv h SER 288 Ca 0.12 -0.25 0.02 0.00 -1.23 0.00 0.00 61.79 60.45 3igv h SER 288 Cb 0.30 0.07 -0.05 0.00 -0.44 0.00 0.00 62.40 62.28 3igv h SER 288 CO -0.28 0.22 0.65 0.00 -0.53 0.00 0.00 176.83 176.88 3igv h GLY 290 N 1.30 0.84 1.02 0.00 0.00 -0.61 -0.71 103.07 104.93 3igv h GLY 290 Ca 0.37 -0.92 -0.09 0.00 0.00 0.00 0.00 47.33 46.69 3igv h GLY 290 CO -0.09 0.82 -0.06 3.43 0.00 0.00 0.00 176.54 180.64 3igv h ASN 291 N 0.61 0.88 0.41 0.19 2.35 -1.15 -1.44 115.58 117.44 3igv h ASN 291 Ca 0.03 -0.34 -0.02 0.00 -0.55 0.00 0.00 56.30 55.42 3igv h ASN 291 Cb 1.04 -0.24 0.00 0.00 0.05 0.00 0.00 38.32 39.18 3igv h ASN 291 CO 0.10 1.01 -0.20 0.74 -1.65 0.00 0.00 177.43 177.44 3igv h THR 292 N 0.74 0.60 -0.94 2.81 2.02 -0.99 0.17 112.91 117.32 3igv h THR 292 Ca 0.13 -0.09 0.07 0.00 0.77 0.00 0.00 66.41 67.29 3igv h THR 292 Cb 0.60 0.65 -0.07 0.00 -1.74 0.00 0.00 68.15 67.59 3igv h THR 292 CO 0.04 0.02 0.59 -0.07 0.37 0.00 0.00 175.52 176.47 3igv h LEU 293 N -0.60 0.93 -0.18 2.58 3.38 -1.16 0.05 115.31 120.30 3igv h LEU 293 Ca -0.06 0.02 -0.19 0.00 0.09 0.00 0.00 57.88 57.74 3igv h LEU 293 Cb 0.45 -0.17 0.01 0.00 0.09 0.00 0.00 40.66 41.04 3igv h LEU 293 CO 0.09 0.57 -0.65 0.74 0.09 0.00 0.00 178.44 179.29 3igv h THR 294 N 1.05 1.30 -0.16 0.22 2.02 -1.04 -1.73 112.91 114.57 3igv h THR 294 Ca 0.42 -1.86 -0.02 0.00 0.77 0.00 0.00 66.41 65.72 3igv h THR 294 Cb 0.23 1.94 -0.01 0.00 -1.74 0.00 0.00 68.15 68.57 3igv h THR 294 CO -0.19 0.59 0.03 0.00 0.37 0.00 0.00 175.52 176.32 3igv h TYR 296 N 0.05 0.39 0.15 0.00 3.20 -1.01 0.60 116.97 120.35 3igv h TYR 296 Ca 0.05 0.01 0.01 0.00 3.14 0.00 0.00 58.73 61.94 3igv h TYR 296 Cb 0.29 -0.12 -0.02 0.00 1.54 0.00 0.00 36.73 38.41 3igv h TYR 296 CO 0.01 0.23 -0.19 1.25 -1.64 0.00 0.00 178.16 177.83 3igv h LEU 297 N 0.42 -0.51 -0.04 2.82 5.85 -1.30 -0.01 115.31 122.54 3igv h LEU 297 Ca 0.14 0.05 -0.00 0.00 0.84 0.00 0.00 57.88 58.91 3igv h LEU 297 Cb -0.01 0.19 -0.00 0.00 0.37 0.00 0.00 40.66 41.21 3igv h LEU 297 CO -0.06 -0.28 0.01 0.11 -0.34 0.00 0.00 178.44 177.89 3igv h LYS 298 N -0.39 0.06 -0.45 1.25 1.57 -1.24 -2.12 116.57 115.25 3igv h LYS 298 Ca 0.01 -0.01 0.01 0.00 -1.87 0.00 0.00 60.65 58.79 3igv h LYS 298 Cb 0.38 -0.01 -0.03 0.00 0.08 0.00 0.00 32.23 32.66 3igv h LYS 298 CO -0.07 0.24 0.28 0.00 -0.57 0.00 0.00 179.45 179.32 3igv h ALA 299 N 0.82 0.57 -0.76 3.86 0.00 -0.89 -0.82 119.26 122.04 3igv h ALA 299 Ca 0.01 -0.02 0.03 0.00 0.00 0.00 0.00 54.91 54.94 3igv h ALA 299 Cb 0.20 -0.15 -0.05 0.00 0.00 0.00 0.00 17.79 17.79 3igv h ALA 299 CO -0.00 -0.02 0.48 0.77 0.00 0.00 0.00 179.25 180.48 3igv h SER 300 N 0.57 0.78 0.75 0.00 0.02 -0.89 0.47 113.55 115.25 3igv h SER 300 Ca 0.17 0.00 -0.10 0.00 -0.84 0.00 0.00 61.79 61.02 3igv h SER 300 Cb -0.03 -0.17 -0.01 0.00 0.14 0.00 0.00 62.40 62.33 3igv h SER 300 CO -0.06 0.53 -0.50 0.00 -1.14 0.00 0.00 176.83 175.67 3igv h ALA 301 N 1.33 0.97 0.00 3.77 0.00 -1.21 -2.87 119.26 121.25 3igv h ALA 301 Ca 0.31 -0.45 -0.10 0.00 0.00 0.00 0.00 54.91 54.66 3igv h ALA 301 Cb 0.03 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 3igv h ALA 301 CO -0.12 0.62 -0.49 0.00 0.00 0.00 0.00 179.25 179.27 3igv h ALA 302 N 1.50 0.77 -0.24 0.00 0.00 -0.33 -1.20 119.26 119.77 3igv h ALA 302 Ca -0.00 -0.44 -0.15 0.00 0.00 0.00 0.00 54.91 54.31 3igv h ALA 302 Cb 1.01 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.72 3igv h ALA 302 CO 0.06 0.61 -0.45 0.00 0.00 0.00 0.00 179.25 179.48 3igv h ARG 304 N 0.44 0.53 -0.23 0.00 3.08 -1.43 -1.32 114.38 115.45 3igv h ARG 304 Ca 0.01 -0.09 0.03 0.00 0.07 0.00 0.00 59.98 60.00 3igv h ARG 304 Cb 1.05 -0.09 -0.03 0.00 0.08 0.00 0.00 29.97 30.99 3igv h ARG 304 CO 0.10 0.50 0.07 0.00 -1.07 0.00 0.00 179.97 179.58 3igv h ALA 305 N 1.00 0.26 0.00 0.04 0.00 -1.23 -2.59 119.26 116.73 3igv h ALA 305 Ca 0.12 0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.06 3igv h ALA 305 Cb 0.16 0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.97 3igv h ALA 305 CO -0.01 -0.34 0.00 0.00 0.00 0.00 0.00 179.25 178.89 3igv n ALA 306 N -2.26 2.16 -3.83 0.00 0.00 -0.36 -4.89 120.51 111.32 3igv n ALA 306 Ca -0.02 -0.11 -0.26 0.00 0.00 0.00 0.00 53.44 53.05 3igv n ALA 306 Cb 0.09 -1.35 0.02 0.00 0.00 0.00 0.00 19.45 18.21 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 -1.22 -5.06 -2.39 0.00 5.02 -0.58 -4.81 118.16 109.11 3igv n LYS 307 Ca 0.12 0.59 -0.41 0.00 -2.02 0.00 0.00 58.31 56.58 3igv n LYS 307 Cb 0.15 -5.27 -0.03 0.00 -0.02 0.00 0.00 35.03 29.85 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 -6.99 4.45 -0.34 -0.35 1.43 -0.69 -4.98 118.68 111.21 3igv s LEU 308 Ca 0.32 2.21 -0.27 0.00 -1.03 0.00 0.00 54.13 55.37 3igv s LEU 308 Cb -0.16 -3.61 0.01 0.00 0.03 0.00 0.00 46.19 42.47 3igv s LEU 308 CO 0.83 -0.36 0.96 -1.10 0.23 0.00 0.00 176.35 176.91 3igv s GLN 309 N -0.24 3.94 -0.75 1.70 -1.52 -1.26 -4.40 119.66 117.13 3igv s GLN 309 Ca 0.52 0.75 -0.01 0.00 -1.95 0.00 0.00 55.36 54.67 3igv s GLN 309 Cb -0.32 -3.77 0.00 0.00 -0.22 0.00 0.00 33.01 28.70 3igv s GLN 309 CO 0.36 -0.90 0.67 -3.47 -0.25 0.00 0.00 175.29 171.70 3igv n ASP 310 N 6.74 -6.96 -4.73 5.90 2.03 -1.26 -0.80 116.55 117.47 3igv n ASP 310 Ca 0.08 -0.30 -0.41 0.00 0.52 0.00 0.00 54.79 54.69 3igv n ASP 310 Cb 0.48 -4.25 -0.04 0.00 -0.72 0.00 0.00 41.12 36.59 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 0.23 2.04 -0.00 0.00 2.01 0.50 -5.01 115.64 115.41 3igv s THR 312 Ca 0.51 -0.95 -0.00 0.00 0.31 0.00 0.00 61.69 61.56 3igv s THR 312 Cb -0.27 -1.86 -0.04 0.00 0.01 0.00 0.00 72.50 70.34 3igv s THR 312 CO 0.32 0.52 0.09 -0.04 -0.69 0.00 0.00 174.62 174.82 3igv s MET 313 N 1.29 3.09 -0.09 4.92 -1.94 -1.26 -1.47 119.30 123.84 3igv s MET 313 Ca 0.05 -0.48 0.00 0.00 -1.71 0.00 0.00 55.69 53.55 3igv s MET 313 Cb -0.13 -2.87 0.02 0.00 2.01 0.00 0.00 34.83 33.85 3igv s MET 313 CO -0.13 0.65 -0.08 -1.17 -0.01 0.00 0.00 175.02 174.28 3igv s LEU 314 N -1.78 1.29 -0.04 -0.03 2.96 -0.34 -4.19 118.68 116.56 3igv s LEU 314 Ca 0.23 -0.27 0.03 0.00 -0.22 0.00 0.00 54.13 53.90 3igv s LEU 314 Cb -0.12 -0.78 0.00 0.00 0.50 0.00 0.00 46.19 45.79 3igv s LEU 314 CO 0.15 -0.07 -0.14 -0.69 -1.32 0.00 0.00 176.35 174.28 3igv s VAL 315 N 1.36 1.17 -0.40 1.68 1.01 0.77 -1.60 120.40 124.38 3igv s VAL 315 Ca -0.02 -0.55 0.01 0.00 0.00 0.00 0.00 61.98 61.42 3igv s VAL 315 Cb -0.14 -1.03 0.14 0.00 0.00 0.00 0.00 36.38 35.36 3igv s VAL 315 CO -0.04 0.35 0.24 0.20 0.00 0.00 0.00 175.10 175.85 3igv s ASN 316 N 0.23 3.20 1.86 3.32 -0.87 -0.06 -0.73 114.94 121.90 3igv s ASN 316 Ca -0.06 -2.49 0.00 0.00 -1.57 0.00 0.00 52.86 48.74 3igv s ASN 316 Cb -0.12 -0.72 0.00 0.00 -0.02 0.00 0.00 41.25 40.40 3igv s ASN 316 CO 0.02 -0.27 0.00 0.61 -2.57 0.00 0.00 177.10 174.89 3igv n GLY 317 N 3.68 3.68 0.22 0.66 0.00 -1.26 -1.53 105.19 110.63 3igv n GLY 317 Ca 0.12 0.11 0.13 0.00 0.00 0.00 0.00 46.02 46.38 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 9.43 0.99 -4.68 1.61 5.75 -1.26 -3.49 116.55 124.90 3igv n ASP 318 Ca 0.00 -0.83 -0.42 0.00 -0.01 0.00 0.00 54.79 53.54 3igv n ASP 318 Cb 0.00 0.17 -0.03 0.00 -1.03 0.00 0.00 41.12 40.23 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 -2.57 7.12 -0.06 -1.12 -1.08 -0.58 -4.73 116.67 113.65 3igv s ASP 319 Ca 0.22 1.38 0.01 0.00 -0.52 0.00 0.00 52.55 53.64 3igv s ASP 319 Cb 0.19 -2.51 0.02 0.00 -1.46 0.00 0.00 42.92 39.16 3igv s ASP 319 CO 0.55 -0.39 -0.07 -0.22 0.52 0.00 0.00 175.17 175.56 3igv s LEU 320 N 1.91 1.40 -0.03 -1.34 2.96 -1.26 -0.88 118.68 121.44 3igv s LEU 320 Ca 0.44 -0.20 0.03 0.00 -0.22 0.00 0.00 54.13 54.18 3igv s LEU 320 Cb -0.18 -0.60 0.00 0.00 0.50 0.00 0.00 46.19 45.91 3igv s LEU 320 CO 0.16 -0.03 -0.11 0.54 -1.32 0.00 0.00 176.35 175.59 3igv s VAL 321 N 0.93 0.94 -0.10 1.68 0.11 -0.63 -1.14 120.40 122.17 3igv s VAL 321 Ca -0.11 -0.43 0.03 0.00 -2.93 0.00 0.00 61.98 58.54 3igv s VAL 321 Cb -0.15 -0.83 0.01 0.00 -1.53 0.00 0.00 36.38 33.88 3igv s VAL 321 CO 0.01 0.29 -0.19 -0.69 -3.33 0.00 0.00 175.10 171.18 3igv s VAL 322 N 0.25 1.76 -0.05 2.04 1.01 -0.47 -1.20 120.40 123.74 3igv s VAL 322 Ca -0.05 -0.82 0.06 0.00 0.00 0.00 0.00 61.98 61.17 3igv s VAL 322 Cb -0.10 -1.55 -0.02 0.00 0.00 0.00 0.00 36.38 34.71 3igv s VAL 322 CO 0.01 0.49 -0.24 -0.63 0.00 0.00 0.00 175.10 174.73 3igv s ILE 323 N 0.67 2.19 0.05 2.22 1.01 -0.54 -1.22 121.20 125.57 3igv s ILE 323 Ca -0.12 -1.03 -0.01 0.00 0.00 0.00 0.00 60.65 59.48 3igv s ILE 323 Cb -0.16 -1.79 0.00 0.00 0.01 0.00 0.00 42.46 40.52 3igv s ILE 323 CO 0.03 0.57 0.08 0.00 0.00 0.00 0.00 174.94 175.63 3igv s GLU 325 N -2.07 4.35 0.19 0.00 0.41 0.02 -1.73 118.70 119.87 3igv s GLU 325 Ca 0.03 0.71 -0.29 0.00 -0.41 0.00 0.00 54.97 55.01 3igv s GLU 325 Cb -0.00 -3.39 -0.08 0.00 -1.78 0.00 0.00 34.13 28.88 3igv s GLU 325 CO 0.02 0.24 0.91 0.45 -0.49 0.00 0.00 175.26 176.40 3igv s SER 326 N 0.25 7.56 -0.31 -0.19 0.15 0.28 -4.42 113.70 117.02 3igv s SER 326 Ca 0.32 1.85 0.08 0.00 0.70 0.00 0.00 55.95 58.90 3igv s SER 326 Cb -0.17 -2.58 0.53 0.00 -1.71 0.00 0.00 66.02 62.08 3igv s SER 326 CO 0.16 0.11 1.51 0.00 1.20 0.00 0.00 173.24 176.22 3igv n ALA 327 N 1.84 4.42 0.00 5.45 0.00 -1.26 -4.79 120.51 126.17 3igv n ALA 327 Ca -0.02 -3.10 0.00 0.00 0.00 0.00 0.00 53.44 50.32 3igv n ALA 327 Cb 0.48 -0.81 0.00 0.00 0.00 0.00 0.00 19.45 19.12 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 -1.11 2.24 0.30 0.00 0.00 -1.26 -4.53 105.19 100.83 3igv n GLY 328 Ca 0.36 -1.82 -0.11 0.00 0.00 0.00 0.00 46.02 44.44 3igv n GLY 328 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 3igv h THR 329 N 0.00 0.39 -0.14 2.61 2.02 -2.00 -2.10 112.91 113.69 3igv h THR 329 Ca 0.00 0.00 -0.15 0.00 0.77 0.00 0.00 66.41 67.03 3igv h THR 329 Cb 0.00 0.39 -0.01 0.00 -1.74 0.00 0.00 68.15 66.79 3igv h THR 329 CO 0.00 0.00 -0.54 -0.61 0.37 0.00 0.00 175.52 174.74 3igv h GLN 330 N -0.40 0.41 -0.26 6.66 4.15 -2.00 -2.83 115.11 120.85 3igv h GLN 330 Ca 0.07 -0.26 -0.15 0.00 0.77 0.00 0.00 58.65 59.09 3igv h GLN 330 Cb 0.50 0.03 -0.00 0.00 0.21 0.00 0.00 27.48 28.21 3igv h GLN 330 CO -0.25 0.85 -0.41 0.93 -1.93 0.00 0.00 178.83 178.03 3igv h GLU 331 N 0.32 0.73 -0.76 1.69 4.39 -1.77 -2.66 114.58 116.53 3igv h GLU 331 Ca 0.01 -0.44 0.02 0.00 0.34 0.00 0.00 59.36 59.28 3igv h GLU 331 Cb 1.05 0.04 -0.04 0.00 -0.10 0.00 0.00 28.75 29.70 3igv h GLU 331 CO 0.09 1.07 0.50 -0.44 -1.16 0.00 0.00 179.01 179.07 3igv h ASP 332 N 0.47 0.84 0.19 1.42 3.32 -1.36 -0.89 116.42 120.40 3igv h ASP 332 Ca 0.02 -0.02 -0.08 0.00 0.02 0.00 0.00 57.03 56.97 3igv h ASP 332 Cb 1.00 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 40.34 3igv h ASP 332 CO 0.09 0.59 -0.32 0.00 -1.72 0.00 0.00 179.24 177.89 3igv h ALA 333 N 1.54 1.27 -0.06 3.45 0.00 -1.31 -1.42 119.26 122.72 3igv h ALA 333 Ca 0.29 -0.34 -0.23 0.00 0.00 0.00 0.00 54.91 54.63 3igv h ALA 333 Cb -0.04 -0.09 0.01 0.00 0.00 0.00 0.00 17.79 17.67 3igv h ALA 333 CO -0.07 0.50 -0.89 0.00 0.00 0.00 0.00 179.25 178.78 3igv h ALA 334 N 1.50 0.30 -0.84 0.00 0.00 -1.07 -3.01 119.26 116.14 3igv h ALA 334 Ca 0.02 -0.66 0.03 0.00 0.00 0.00 0.00 54.91 54.30 3igv h ALA 334 Cb 0.66 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.40 3igv h ALA 334 CO 0.05 0.72 0.54 0.77 0.00 0.00 0.00 179.25 181.34 3igv h SER 335 N 0.39 0.91 -0.42 0.00 0.02 -0.83 -2.19 113.55 111.44 3igv h SER 335 Ca -0.08 -0.01 -0.10 0.00 -0.84 0.00 0.00 61.79 60.76 3igv h SER 335 Cb 1.52 -0.21 -0.02 0.00 0.14 0.00 0.00 62.40 63.83 3igv h SER 335 CO 0.17 0.64 -0.10 -0.07 -1.14 0.00 0.00 176.83 176.33 3igv h LEU 336 N 1.07 0.87 -0.56 5.07 3.38 -1.31 -1.11 115.31 122.72 3igv h LEU 336 Ca 0.33 -0.27 -0.05 0.00 0.09 0.00 0.00 57.88 57.98 3igv h LEU 336 Cb -0.03 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.46 3igv h LEU 336 CO -0.10 0.99 0.16 0.03 0.09 0.00 0.00 178.44 179.62 3igv h ARG 337 N 0.79 0.89 -0.37 1.13 3.08 -1.35 -0.92 114.38 117.62 3igv h ARG 337 Ca 0.13 -0.20 -0.05 0.00 0.07 0.00 0.00 59.98 59.93 3igv h ARG 337 Cb 0.62 -0.12 -0.01 0.00 0.08 0.00 0.00 29.97 30.53 3igv h ARG 337 CO 0.04 0.81 0.04 0.28 -1.07 0.00 0.00 179.97 180.07 3igv h VAL 338 N 0.79 1.25 -0.43 2.04 2.07 -1.29 -0.80 116.25 119.88 3igv h VAL 338 Ca 0.18 -0.90 0.07 0.00 0.82 0.00 0.00 66.70 66.87 3igv h VAL 338 Cb 0.30 1.11 -0.06 0.00 -1.52 0.00 0.00 31.29 31.12 3igv h VAL 338 CO -0.00 0.30 0.07 0.15 0.02 0.00 0.00 177.57 178.11 3igv h PHE 339 N 0.47 0.10 -0.34 1.57 3.57 -1.07 -0.68 116.94 120.56 3igv h PHE 339 Ca 0.11 0.03 -0.06 0.00 3.53 0.00 0.00 57.97 61.57 3igv h PHE 339 Cb 0.40 0.02 -0.02 0.00 2.79 0.00 0.00 35.95 39.14 3igv h PHE 339 CO 0.03 -0.01 -0.06 1.15 -2.23 0.00 0.00 178.31 177.19 3igv h THR 340 N 0.19 1.22 -0.35 4.41 2.02 -0.99 -1.26 112.91 118.14 3igv h THR 340 Ca 0.21 -0.93 -0.02 0.00 0.77 0.00 0.00 66.41 66.44 3igv h THR 340 Cb 0.27 1.03 -0.02 0.00 -1.74 0.00 0.00 68.15 67.69 3igv h THR 340 CO -0.29 0.31 0.15 -0.33 0.37 0.00 0.00 175.52 175.73 3igv h GLU 341 N 0.52 0.53 0.10 6.66 5.08 -0.41 -0.83 114.58 126.22 3igv h GLU 341 Ca 0.10 -0.09 -0.00 0.00 -1.00 0.00 0.00 59.36 58.37 3igv h GLU 341 Cb 0.42 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.59 3igv h GLU 341 CO 0.02 0.51 -0.05 0.00 -1.00 0.00 0.00 179.01 178.49 3igv h ALA 342 N 0.99 -0.13 -0.75 3.43 0.00 -0.80 -1.78 119.26 120.22 3igv h ALA 342 Ca 0.12 -0.07 0.08 0.00 0.00 0.00 0.00 54.91 55.04 3igv h ALA 342 Cb 0.18 0.05 -0.07 0.00 0.00 0.00 0.00 17.79 17.95 3igv h ALA 342 CO -0.01 -0.53 0.41 0.52 0.00 0.00 0.00 179.25 179.65 3igv h MET 343 N -0.22 0.70 -0.58 0.00 2.86 -1.18 -0.12 114.93 116.39 3igv h MET 343 Ca -0.01 -0.04 0.02 0.00 -2.06 0.00 0.00 59.70 57.60 3igv h MET 343 Cb 0.18 -0.16 -0.03 0.00 0.06 0.00 0.00 31.60 31.64 3igv h MET 343 CO 0.02 0.47 0.37 1.15 1.06 0.00 0.00 176.91 179.98 3igv h THR 344 N 0.72 1.11 -0.27 2.22 2.02 -1.00 0.30 112.91 118.02 3igv h THR 344 Ca 0.35 -0.26 -0.05 0.00 0.77 0.00 0.00 66.41 67.23 3igv h THR 344 Cb 0.29 0.30 -0.02 0.00 -1.74 0.00 0.00 68.15 66.99 3igv h THR 344 CO -0.23 0.14 -0.05 0.03 0.37 0.00 0.00 175.52 175.78 3igv h ARG 345 N 0.74 0.42 0.00 6.66 3.08 -0.41 -1.77 114.38 123.11 3igv h ARG 345 Ca 0.22 -0.09 0.00 0.00 0.07 0.00 0.00 59.98 60.18 3igv h ARG 345 Cb -0.04 -0.06 0.00 0.00 0.08 0.00 0.00 29.97 29.95 3igv h ARG 345 CO -0.07 0.49 0.00 0.66 -1.07 0.00 0.00 179.97 179.98 3igv n TYR 346 N -4.28 0.00 -2.72 3.04 4.01 -0.15 -0.45 117.16 116.61 3igv n TYR 346 Ca 0.01 0.00 -0.10 0.00 -0.16 0.00 0.00 57.90 57.65 3igv n TYR 346 Cb 0.25 0.00 0.05 0.00 -0.31 0.00 0.00 39.34 39.33 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 -0.65 -3.63 -2.98 7.72 2.88 -0.66 -4.88 113.62 111.41 3igv n SER 347 Ca 0.07 -0.42 -0.15 0.00 -1.33 0.00 0.00 58.87 57.05 3igv n SER 347 Cb 0.03 -3.41 0.01 0.00 -0.75 0.00 0.00 64.21 60.09 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 -2.74 0.72 -1.73 -1.46 0.00 0.99 -4.57 120.51 111.73 3igv n ALA 348 Ca -0.10 -2.51 -0.34 0.00 0.00 0.00 0.00 53.44 50.48 3igv n ALA 348 Cb 0.59 -1.04 0.00 0.00 0.00 0.00 0.00 19.45 19.00 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 -0.93 3.33 0.66 0.00 0.04 -1.26 -3.88 135.00 132.96 3igv s PRO 349 Ca 0.32 1.51 -0.11 0.00 0.04 0.00 0.00 61.00 62.76 3igv s PRO 349 Cb 0.28 -2.01 -0.01 0.00 0.04 0.00 0.00 34.50 32.80 3igv s PRO 349 CO -0.10 -0.85 1.06 -1.25 0.04 0.00 0.00 177.00 175.90 3igv s PRO 350 N -3.46 3.23 -0.03 0.56 0.04 -1.26 -1.57 135.00 132.51 3igv s PRO 350 Ca 0.70 0.61 -0.00 0.00 0.04 0.00 0.00 61.00 62.35 3igv s PRO 350 Cb -0.22 -2.05 -0.00 0.00 0.04 0.00 0.00 34.50 32.27 3igv s PRO 350 CO 0.29 -0.80 0.04 0.78 0.04 0.00 0.00 177.00 177.35 3igv h GLY 351 N -0.49 -0.02 -5.09 0.56 0.00 -0.80 -3.37 103.07 93.87 3igv h GLY 351 Ca -0.44 0.01 -0.64 0.00 0.00 0.00 0.00 47.33 46.25 3igv h GLY 351 CO 0.63 -0.01 -0.52 0.99 0.00 0.00 0.00 176.54 177.63 3igv s ASP 352 N -3.69 6.14 0.32 0.19 1.01 -1.26 -4.97 116.67 114.40 3igv s ASP 352 Ca -0.00 0.27 -0.29 0.00 0.71 0.00 0.00 52.55 53.23 3igv s ASP 352 Cb 0.00 -1.87 -0.11 0.00 1.01 0.00 0.00 42.92 41.95 3igv s ASP 352 CO 0.01 0.25 1.47 -2.16 0.21 0.00 0.00 175.17 174.95 3igv s PRO 353 N -1.97 4.19 0.41 8.23 0.04 -1.26 -4.70 135.00 139.93 3igv s PRO 353 Ca 0.27 2.46 -0.26 0.00 0.04 0.00 0.00 61.00 63.51 3igv s PRO 353 Cb -0.12 -3.03 -0.08 0.00 0.04 0.00 0.00 34.50 31.30 3igv s PRO 353 CO 0.19 -0.48 1.26 -1.25 0.04 0.00 0.00 177.00 176.76 3igv s PRO 354 N -1.29 3.98 0.00 0.56 0.04 -1.26 -5.04 135.00 131.99 3igv s PRO 354 Ca 0.56 2.06 0.08 0.00 0.04 0.00 0.00 61.00 63.74 3igv s PRO 354 Cb -0.45 -2.73 -0.02 0.00 0.04 0.00 0.00 34.50 31.34 3igv s PRO 354 CO 0.54 -0.45 -0.26 -0.65 0.04 0.00 0.00 177.00 176.22 3igv s GLN 355 N -2.26 2.00 0.02 4.56 -1.52 -1.26 -4.97 119.66 116.22 3igv s GLN 355 Ca 0.57 -0.98 -0.30 0.00 -1.95 0.00 0.00 55.36 52.70 3igv s GLN 355 Cb -0.36 -2.00 -0.04 0.00 -0.22 0.00 0.00 33.01 30.39 3igv s GLN 355 CO 0.46 0.54 1.08 -1.25 -0.25 0.00 0.00 175.29 175.86 3igv s PRO 356 N -0.80 4.49 -0.05 2.91 0.04 -1.26 -4.66 135.00 135.67 3igv s PRO 356 Ca 0.10 1.56 0.00 0.00 0.04 0.00 0.00 61.00 62.71 3igv s PRO 356 Cb -0.10 -3.43 -0.03 0.00 0.04 0.00 0.00 34.50 30.98 3igv s PRO 356 CO -0.00 -0.16 -0.02 -1.21 0.04 0.00 0.00 177.00 175.65 3igv s GLU 357 N 1.13 2.83 0.00 4.56 0.41 0.12 -4.97 118.70 122.79 3igv s GLU 357 Ca 0.55 -0.52 0.09 0.00 -0.41 0.00 0.00 54.97 54.68 3igv s GLU 357 Cb -0.24 -2.68 0.19 0.00 -1.78 0.00 0.00 34.13 29.61 3igv s GLU 357 CO 0.28 0.66 1.06 0.66 -0.49 0.00 0.00 175.26 177.43 3igv n TYR 358 N 1.91 0.25 -3.91 1.61 4.01 -1.26 -1.21 117.16 118.56 3igv n TYR 358 Ca -0.17 -0.31 -0.27 0.00 -0.16 0.00 0.00 57.90 56.99 3igv n TYR 358 Cb 0.53 -0.02 -0.17 0.00 -0.31 0.00 0.00 39.34 39.37 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 -0.92 2.35 0.36 7.72 2.15 -1.26 -4.94 116.67 122.12 3igv s ASP 359 Ca 0.16 -0.39 0.06 0.00 0.43 0.00 0.00 52.55 52.82 3igv s ASP 359 Cb 0.09 -0.87 0.75 0.00 -0.30 0.00 0.00 42.92 42.59 3igv s ASP 359 CO 0.13 -0.13 1.93 0.25 -0.17 0.00 0.00 175.17 177.18 3igv h LEU 360 N 8.16 0.68 -1.87 -1.34 5.85 -1.96 -1.68 115.31 123.15 3igv h LEU 360 Ca -0.29 0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.44 3igv h LEU 360 Cb 1.13 -0.13 0.00 0.00 0.37 0.00 0.00 40.66 42.03 3igv h LEU 360 CO 0.41 0.42 0.00 -0.33 -0.34 0.00 0.00 178.44 178.60 3igv h GLU 361 N 0.76 0.00 -0.62 1.25 5.08 -1.97 -2.06 114.58 117.03 3igv h GLU 361 Ca 0.36 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.72 3igv h GLU 361 Cb 0.38 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.63 3igv h GLU 361 CO -0.13 0.00 0.00 1.28 -1.00 0.00 0.00 179.01 179.16 3igv n LEU 362 N -2.65 3.37 -4.64 1.33 4.77 -0.63 -4.55 117.00 114.00 3igv n LEU 362 Ca -0.01 -1.67 -0.35 0.00 -0.03 0.00 0.00 56.01 53.95 3igv n LEU 362 Cb 0.11 -0.41 -0.10 0.00 -2.33 0.00 0.00 43.42 40.69 3igv n LEU 362 CO 0.17 0.84 -0.24 -0.63 -1.33 0.00 0.00 177.39 176.20 3igv s ILE 363 N -1.17 4.86 -0.25 -0.08 1.01 -0.77 -5.03 121.20 119.77 3igv s ILE 363 Ca 0.42 -0.01 -0.06 0.00 0.00 0.00 0.00 60.65 61.00 3igv s ILE 363 Cb 0.22 -3.20 -0.02 0.00 0.01 0.00 0.00 42.46 39.47 3igv s ILE 363 CO 0.29 0.45 0.05 -0.89 0.00 0.00 0.00 174.94 174.83 3igv s THR 364 N 0.46 4.05 -0.06 2.92 2.01 -1.26 -4.10 115.64 119.66 3igv s THR 364 Ca 0.04 -0.33 -0.03 0.00 0.31 0.00 0.00 61.69 61.68 3igv s THR 364 Cb -0.12 -2.92 0.03 0.00 0.01 0.00 0.00 72.50 69.50 3igv s THR 364 CO 0.00 0.31 0.14 -0.94 -0.69 0.00 0.00 174.62 173.45 3igv s SER 365 N 1.57 -0.11 -1.41 3.53 1.04 -0.05 -4.67 113.70 113.60 3igv s SER 365 Ca 0.06 0.29 -0.09 0.00 0.48 0.00 0.00 55.95 56.68 3igv s SER 365 Cb -0.15 0.19 0.04 0.00 0.10 0.00 0.00 66.02 66.20 3igv s SER 365 CO 0.02 -0.13 1.05 0.00 0.98 0.00 0.00 173.24 175.15 3igv n SER 367 N -2.96 -5.46 -4.10 0.00 7.64 -1.26 -4.95 113.62 102.52 3igv n SER 367 Ca -0.03 0.34 -0.16 0.00 1.01 0.00 0.00 58.87 60.03 3igv n SER 367 Cb 0.57 -4.17 -0.12 0.00 -1.01 0.00 0.00 64.21 59.48 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 -2.56 1.25 0.13 6.43 0.01 -0.97 -4.59 113.70 113.40 3igv s SER 368 Ca 0.00 -0.52 0.07 0.00 1.31 0.00 0.00 55.95 56.81 3igv s SER 368 Cb 0.00 -0.02 -0.04 0.00 0.21 0.00 0.00 66.02 66.17 3igv s SER 368 CO 0.00 -0.10 -0.17 0.54 0.41 0.00 0.00 173.24 173.92 3igv s ASN 369 N -1.45 2.31 0.26 2.44 4.22 -0.16 -0.87 114.94 121.69 3igv s ASN 369 Ca -0.04 -0.80 -0.30 0.00 -2.14 0.00 0.00 52.86 49.58 3igv s ASN 369 Cb -0.09 -0.11 -0.09 0.00 1.28 0.00 0.00 41.25 42.24 3igv s ASN 369 CO 0.01 -0.07 1.03 -0.69 -2.04 0.00 0.00 177.10 175.34 3igv s VAL 370 N -1.91 3.77 0.24 3.54 1.01 -1.26 -1.77 120.40 124.03 3igv s VAL 370 Ca 0.10 1.78 -0.05 0.00 0.00 0.00 0.00 61.98 63.81 3igv s VAL 370 Cb -0.06 -4.13 -0.02 0.00 0.00 0.00 0.00 36.38 32.17 3igv s VAL 370 CO 0.04 0.42 0.32 -0.55 0.00 0.00 0.00 175.10 175.33 3igv s SER 371 N -0.98 0.24 0.01 3.32 0.15 -0.82 -4.25 113.70 111.37 3igv s SER 371 Ca 0.43 -1.25 0.04 0.00 0.70 0.00 0.00 55.95 55.88 3igv s SER 371 Cb -0.29 0.51 -0.01 0.00 -1.71 0.00 0.00 66.02 64.51 3igv s SER 371 CO 0.37 -1.03 -0.13 0.54 1.20 0.00 0.00 173.24 174.19 3igv s VAL 372 N -3.92 1.04 0.18 4.45 0.11 -1.26 -1.70 120.40 119.30 3igv s VAL 372 Ca 0.32 -0.72 0.03 0.00 -2.93 0.00 0.00 61.98 58.67 3igv s VAL 372 Cb 0.03 -0.90 -0.01 0.00 -1.53 0.00 0.00 36.38 33.97 3igv s VAL 372 CO 0.13 0.17 0.09 0.00 -3.33 0.00 0.00 175.10 172.17 3igv n ALA 373 N 2.43 0.30 -2.39 1.54 0.00 -0.29 -3.60 120.51 118.50 3igv n ALA 373 Ca -0.16 -0.96 -0.28 0.00 0.00 0.00 0.00 53.44 52.04 3igv n ALA 373 Cb 0.55 0.70 -0.16 0.00 0.00 0.00 0.00 19.45 20.54 3igv n ALA 373 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.50 176.49 3igv s HIS 374 N -2.41 2.00 0.00 0.00 3.76 -0.68 -0.49 115.29 117.46 3igv s HIS 374 Ca 0.13 -0.38 0.00 0.00 -0.15 0.00 0.00 55.06 54.67 3igv s HIS 374 Cb 0.01 -1.28 0.00 0.00 1.11 0.00 0.00 32.58 32.42 3igv s HIS 374 CO 0.09 -0.02 0.00 -0.40 -0.85 0.00 0.00 174.74 173.56 3igv n ASP 375 N 2.48 0.00 -0.31 1.40 3.85 -0.17 -1.07 116.55 122.73 3igv n ASP 375 Ca -0.16 -0.89 0.02 0.00 -0.71 0.00 0.00 54.79 53.05 3igv n ASP 375 Cb 0.52 0.00 0.16 0.00 -1.35 0.00 0.00 41.12 40.45 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 -1.07 1.22 0.00 2.12 0.00 -1.89 0.12 119.26 119.75 3igv h ALA 376 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3igv h ALA 376 Cb 0.00 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 17.57 3igv h ALA 376 CO 0.00 0.25 0.00 -1.13 0.00 0.00 0.00 179.25 178.37 3igv n SER 377 N -4.64 0.00 0.00 0.00 3.41 -1.26 -4.88 113.62 106.26 3igv n SER 377 Ca 0.13 -1.25 0.00 0.00 -0.26 0.00 0.00 58.87 57.50 3igv n SER 377 Cb 0.21 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.16 3igv n SER 377 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3igv n GLY 378 N 0.75 0.46 3.83 5.00 0.00 0.42 -5.04 105.19 110.62 3igv n GLY 378 Ca 0.16 -0.34 -0.34 0.00 0.00 0.00 0.00 46.02 45.49 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 -0.63 4.15 0.05 1.61 2.20 -1.26 -4.66 119.74 121.19 3igv s LYS 379 Ca 0.00 0.82 -0.31 0.00 -0.36 0.00 0.00 55.97 56.12 3igv s LYS 379 Cb 0.00 -2.60 -0.07 0.00 -1.51 0.00 0.00 37.83 33.65 3igv s LYS 379 CO 0.00 0.24 1.49 1.03 -0.36 0.00 0.00 175.35 177.75 3igv s ARG 380 N -2.56 4.26 -0.10 4.03 0.52 -1.26 -1.00 118.95 122.83 3igv s ARG 380 Ca 0.50 2.11 0.02 0.00 -0.52 0.00 0.00 55.73 57.84 3igv s ARG 380 Cb -0.13 -3.52 0.01 0.00 0.52 0.00 0.00 34.95 31.84 3igv s ARG 380 CO 0.19 -0.61 -0.14 0.08 0.02 0.00 0.00 175.30 174.84 3igv s VAL 381 N 2.23 1.43 0.13 3.52 1.01 0.36 -4.93 120.40 124.14 3igv s VAL 381 Ca 0.67 -0.61 -0.21 0.00 0.00 0.00 0.00 61.98 61.84 3igv s VAL 381 Cb -0.35 -1.31 -0.07 0.00 0.00 0.00 0.00 36.38 34.64 3igv s VAL 381 CO 0.29 0.43 0.65 -0.31 0.00 0.00 0.00 175.10 176.16 3igv s TYR 382 N 0.98 3.81 0.09 5.22 2.02 -1.26 -1.13 117.35 127.08 3igv s TYR 382 Ca -0.07 1.39 -0.09 0.00 -0.37 0.00 0.00 57.07 57.93 3igv s TYR 382 Cb -0.15 -2.59 0.00 0.00 -0.40 0.00 0.00 41.96 38.82 3igv s TYR 382 CO -0.01 0.53 0.21 1.52 -1.57 0.00 0.00 175.55 176.22 3igv s TYR 383 N -1.19 0.12 -0.08 2.71 1.13 -0.69 -4.97 117.35 114.39 3igv s TYR 383 Ca 0.33 -0.54 -0.11 0.00 -1.41 0.00 0.00 57.07 55.35 3igv s TYR 383 Cb -0.20 -0.03 -0.05 0.00 -1.10 0.00 0.00 41.96 40.58 3igv s TYR 383 CO 0.22 -0.56 0.26 -0.51 -2.51 0.00 0.00 175.55 172.45 3igv s LEU 384 N -2.86 4.41 0.34 -3.49 1.43 -1.26 -1.95 118.68 115.30 3igv s LEU 384 Ca 0.05 0.67 0.02 0.00 -1.03 0.00 0.00 54.13 53.83 3igv s LEU 384 Cb 0.05 -2.30 -0.01 0.00 0.03 0.00 0.00 46.19 43.96 3igv s LEU 384 CO -0.11 0.35 0.40 0.28 0.23 0.00 0.00 176.35 177.50 3igv s THR 385 N -0.91 0.00 0.34 5.49 -1.32 -0.73 -4.67 115.64 113.84 3igv s THR 385 Ca 0.18 -1.75 -0.15 0.00 -1.21 0.00 0.00 61.69 58.76 3igv s THR 385 Cb -0.14 -2.60 0.03 0.00 -1.51 0.00 0.00 72.50 68.28 3igv s THR 385 CO 0.08 0.00 0.70 0.00 -2.21 0.00 0.00 174.62 173.19 3igv s ARG 386 N -3.16 2.03 0.03 7.08 1.70 -1.26 -0.98 118.95 124.40 3igv s ARG 386 Ca 0.35 -1.37 -0.30 0.00 -0.47 0.00 0.00 55.73 53.93 3igv s ARG 386 Cb 0.01 0.58 -0.08 0.00 -0.57 0.00 0.00 34.95 34.89 3igv s ARG 386 CO 0.24 -0.93 1.68 0.34 -1.08 0.00 0.00 175.30 175.55 3igv s ASP 387 N -3.06 6.61 0.00 -2.89 -1.08 -1.26 -4.89 116.67 110.10 3igv s ASP 387 Ca 0.17 2.43 0.14 0.00 -0.52 0.00 0.00 52.55 54.78 3igv s ASP 387 Cb -0.04 -2.55 0.79 0.00 -1.46 0.00 0.00 42.92 39.65 3igv s ASP 387 CO 0.12 -0.91 1.51 -0.81 0.52 0.00 0.00 175.17 175.60 3igv n PRO 388 N 6.14 1.09 0.14 4.34 -0.04 -1.26 -4.30 135.00 141.10 3igv n PRO 388 Ca 0.16 -0.13 -0.13 0.00 -0.04 0.00 0.00 63.50 63.36 3igv n PRO 388 Cb 0.41 -1.23 -0.07 0.00 -0.04 0.00 0.00 33.50 32.58 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 0.25 0.63 0.16 0.52 2.02 -1.94 -1.20 112.91 113.35 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 0.06 0.63 0.00 0.00 -1.74 0.00 0.00 68.15 67.10 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 -0.38 0.98 -1.02 3.16 2.02 -1.95 -1.97 112.91 113.74 3igv h THR 390 Ca -0.00 -0.83 0.25 0.00 0.77 0.00 0.00 66.41 66.60 3igv h THR 390 Cb 0.35 1.47 -0.11 0.00 -1.74 0.00 0.00 68.15 68.12 3igv h THR 390 CO -0.03 0.19 0.63 -0.65 0.37 0.00 0.00 175.52 176.03 3igv h PRO 391 N -0.63 0.50 0.01 6.66 0.11 -1.82 -0.57 132.00 136.27 3igv h PRO 391 Ca -0.02 -0.03 -0.24 0.00 0.11 0.00 0.00 66.00 65.82 3igv h PRO 391 Cb 0.47 -0.11 0.01 0.00 0.11 0.00 0.00 31.00 31.47 3igv h PRO 391 CO 0.04 0.33 -0.99 -0.07 -0.21 0.00 0.00 178.00 177.10 3igv h LEU 392 N 0.51 0.61 -0.76 2.35 3.38 -1.17 -0.82 115.31 119.42 3igv h LEU 392 Ca 0.61 -0.50 -0.04 0.00 0.09 0.00 0.00 57.88 58.04 3igv h LEU 392 Cb 1.32 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 41.85 3igv h LEU 392 CO -0.38 1.31 0.31 0.00 0.09 0.00 0.00 178.44 179.76 3igv h ALA 393 N 0.65 0.99 -0.10 1.53 0.00 -0.52 -0.49 119.26 121.32 3igv h ALA 393 Ca -0.10 -0.19 -0.14 0.00 0.00 0.00 0.00 54.91 54.49 3igv h ALA 393 Cb 1.63 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 19.12 3igv h ALA 393 CO 0.18 0.60 -0.53 0.00 0.00 0.00 0.00 179.25 179.50 3igv h ARG 394 N 1.09 0.28 -0.64 0.00 3.08 -1.14 -2.62 114.38 114.44 3igv h ARG 394 Ca 0.25 -0.17 -0.07 0.00 0.07 0.00 0.00 59.98 60.07 3igv h ARG 394 Cb 0.21 0.02 -0.03 0.00 0.08 0.00 0.00 29.97 30.25 3igv h ARG 394 CO -0.02 0.75 0.14 0.00 -1.07 0.00 0.00 179.97 179.76 3igv h ALA 395 N 1.22 1.04 -0.61 0.04 0.00 -0.75 -1.55 119.26 118.66 3igv h ALA 395 Ca 0.00 -0.24 -0.02 0.00 0.00 0.00 0.00 54.91 54.65 3igv h ALA 395 Cb 1.01 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 18.53 3igv h ALA 395 CO 0.08 0.62 0.31 0.00 0.00 0.00 0.00 179.25 180.26 3igv h ALA 396 N 1.18 0.79 -0.58 0.00 0.00 -0.95 -1.84 119.26 117.87 3igv h ALA 396 Ca 0.20 -0.13 -0.07 0.00 0.00 0.00 0.00 54.91 54.91 3igv h ALA 396 Cb 0.37 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 3igv h ALA 396 CO 0.00 0.34 0.07 2.35 0.00 0.00 0.00 179.25 182.02 3igv h TRP 397 N 0.84 1.04 0.00 0.00 2.91 -1.23 -2.73 115.95 116.78 3igv h TRP 397 Ca 0.21 -0.15 0.00 0.00 1.13 0.00 0.00 58.89 60.08 3igv h TRP 397 Cb 0.10 -0.28 0.00 0.00 -0.51 0.00 0.00 29.16 28.47 3igv h TRP 397 CO -0.00 0.91 0.00 0.93 -1.03 0.00 0.00 178.44 179.25 3igv h GLU 398 N 0.86 0.00 -0.04 2.65 5.08 -1.18 -0.53 114.58 121.42 3igv h GLU 398 Ca 0.17 0.00 -0.08 0.00 -1.00 0.00 0.00 59.36 58.45 3igv h GLU 398 Cb 0.45 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.69 3igv h GLU 398 CO 0.02 0.00 -0.35 1.15 -1.00 0.00 0.00 179.01 178.83 3igv h THR 399 N 0.00 1.26 0.00 1.13 2.02 -1.00 -3.32 112.91 113.00 3igv h THR 399 Ca 0.00 -1.25 0.00 0.00 0.77 0.00 0.00 66.41 65.93 3igv h THR 399 Cb 0.66 1.62 0.00 0.00 -1.74 0.00 0.00 68.15 68.69 3igv h THR 399 CO 0.00 0.36 -0.94 0.00 0.37 0.00 0.00 175.52 175.32 3igv n ALA 400 N -2.47 2.60 -3.47 6.16 0.00 -1.01 -4.92 120.51 117.39 3igv n ALA 400 Ca -0.02 -0.20 -0.26 0.00 0.00 0.00 0.00 53.44 52.96 3igv n ALA 400 Cb 0.40 -0.28 -0.17 0.00 0.00 0.00 0.00 19.45 19.41 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 -2.20 1.98 0.26 0.00 1.81 -0.24 -4.94 118.95 115.63 3igv s ARG 401 Ca -0.00 -0.50 -0.30 0.00 -1.72 0.00 0.00 55.73 53.20 3igv s ARG 401 Cb 0.05 -1.63 -0.11 0.00 -0.45 0.00 0.00 34.95 32.82 3igv s ARG 401 CO 0.32 0.03 1.55 -1.01 -0.68 0.00 0.00 175.30 175.52 3igv s HIS 402 N 0.70 2.87 0.26 -0.53 3.76 -1.26 -4.28 115.29 116.81 3igv s HIS 402 Ca -0.13 0.81 0.09 0.00 -0.15 0.00 0.00 55.06 55.68 3igv s HIS 402 Cb -0.16 -3.99 -0.05 0.00 1.11 0.00 0.00 32.58 29.49 3igv s HIS 402 CO 0.03 -3.35 -0.15 0.95 -0.85 0.00 0.00 174.74 171.37 3igv s THR 403 N 0.19 2.04 0.26 1.30 -4.23 -1.26 -5.04 115.64 108.90 3igv s THR 403 Ca 0.64 -2.27 0.09 0.00 -1.18 0.00 0.00 61.69 58.97 3igv s THR 403 Cb -0.46 -2.26 -0.03 0.00 1.34 0.00 0.00 72.50 71.09 3igv s THR 403 CO 0.44 -0.44 1.60 -0.65 -0.54 0.00 0.00 174.62 175.02 3igv h PRO 404 N 2.36 0.06 -5.28 3.99 0.11 -1.96 -3.42 132.00 127.87 3igv h PRO 404 Ca -0.39 -0.04 -0.66 0.00 0.11 0.00 0.00 66.00 65.01 3igv h PRO 404 Cb 1.24 0.01 -0.29 0.00 0.11 0.00 0.00 31.00 32.06 3igv h PRO 404 CO 0.63 0.66 -0.80 0.08 -0.21 0.00 0.00 178.00 178.36 3igv s VAL 405 N -3.64 2.73 -0.76 3.15 1.01 -1.26 -4.71 120.40 116.92 3igv s VAL 405 Ca -0.02 -0.77 -0.16 0.00 0.00 0.00 0.00 61.98 61.03 3igv s VAL 405 Cb 0.12 -2.13 0.17 0.00 0.00 0.00 0.00 36.38 34.54 3igv s VAL 405 CO 0.77 0.53 0.78 0.20 0.00 0.00 0.00 175.10 177.38 3igv s ASN 406 N 0.51 6.54 0.45 3.32 0.01 -0.78 -4.91 114.94 120.09 3igv s ASN 406 Ca -0.11 -2.20 0.15 0.00 -0.71 0.00 0.00 52.86 49.99 3igv s ASN 406 Cb -0.16 -2.26 1.01 0.00 0.41 0.00 0.00 41.25 40.25 3igv s ASN 406 CO 0.04 -0.81 2.00 0.77 -1.51 0.00 0.00 177.10 177.59 3igv h SER 407 N 8.41 0.00 -0.78 -1.22 4.64 -1.93 -2.55 113.55 120.11 3igv h SER 407 Ca -0.02 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.30 3igv h SER 407 Cb 1.06 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 63.11 3igv h SER 407 CO 0.93 0.18 0.51 4.11 -0.87 0.00 0.00 176.83 181.68 3igv h TRP 408 N 0.00 1.00 -0.12 4.77 5.08 -1.90 0.13 115.95 124.90 3igv h TRP 408 Ca -0.00 0.02 -0.20 0.00 1.08 0.00 0.00 58.89 59.79 3igv h TRP 408 Cb 0.32 -0.34 0.01 0.00 -3.00 0.00 0.00 29.16 26.15 3igv h TRP 408 CO 0.00 0.64 -0.69 1.25 -1.28 0.00 0.00 178.44 178.36 3igv h LEU 409 N 1.07 0.82 -0.59 0.11 5.85 -1.86 -0.72 115.31 120.00 3igv h LEU 409 Ca 0.29 -0.64 -0.01 0.00 0.84 0.00 0.00 57.88 58.35 3igv h LEU 409 Cb -0.10 -0.24 -0.03 0.00 0.37 0.00 0.00 40.66 40.65 3igv h LEU 409 CO -0.06 1.34 0.33 1.23 -0.34 0.00 0.00 178.44 180.94 3igv h GLY 410 N 0.37 0.87 1.44 3.75 0.00 -1.33 -0.72 103.07 107.45 3igv h GLY 410 Ca -0.05 -0.38 -0.07 0.00 0.00 0.00 0.00 47.33 46.83 3igv h GLY 410 CO 0.14 0.37 -0.02 3.43 0.00 0.00 0.00 176.54 180.46 3igv h ASN 411 N 0.79 0.66 -0.18 0.19 2.35 -0.71 -0.49 115.58 118.19 3igv h ASN 411 Ca 0.21 -0.15 -0.03 0.00 -0.55 0.00 0.00 56.30 55.78 3igv h ASN 411 Cb 0.02 -0.17 -0.01 0.00 0.05 0.00 0.00 38.32 38.21 3igv h ASN 411 CO -0.04 0.74 0.00 0.40 -1.65 0.00 0.00 177.43 176.89 3igv h ILE 412 N 0.64 1.25 -0.03 2.81 2.04 -0.86 -0.26 117.51 123.11 3igv h ILE 412 Ca 0.13 -0.85 0.01 0.00 1.00 0.00 0.00 64.86 65.14 3igv h ILE 412 Cb 0.43 1.45 -0.01 0.00 -0.74 0.00 0.00 36.82 37.96 3igv h ILE 412 CO 0.02 0.26 -0.01 0.40 0.00 0.00 0.00 178.15 178.82 3igv h ILE 413 N 0.08 0.97 0.00 -0.67 2.04 -0.95 0.00 117.51 118.99 3igv h ILE 413 Ca 0.05 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.90 3igv h ILE 413 Cb 0.38 0.97 -0.00 0.00 -0.74 0.00 0.00 36.82 37.43 3igv h ILE 413 CO 0.01 0.00 -0.38 0.24 0.00 0.00 0.00 178.15 178.02 3igv h MET 414 N -0.00 0.00 0.00 2.37 2.86 -1.13 -3.30 114.93 115.73 3igv h MET 414 Ca 0.01 0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.64 3igv h MET 414 Cb 0.02 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 31.66 3igv h MET 414 CO -0.03 0.03 -0.39 0.66 1.06 0.00 0.00 176.91 178.24 3igv n TYR 415 N -2.96 0.00 -0.29 -0.22 4.01 -0.11 -4.89 117.16 112.69 3igv n TYR 415 Ca 0.02 -1.28 0.12 0.00 -0.16 0.00 0.00 57.90 56.60 3igv n TYR 415 Cb 0.55 -0.21 0.27 0.00 -0.31 0.00 0.00 39.34 39.64 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 0.70 1.20 0.00 -0.72 0.00 -1.07 -0.96 119.26 118.41 3igv h ALA 416 Ca -0.01 0.23 0.00 0.00 0.00 0.00 0.00 54.91 55.13 3igv h ALA 416 Cb 1.05 0.35 0.00 0.00 0.00 0.00 0.00 17.79 19.19 3igv h ALA 416 CO 0.00 -0.47 0.00 -2.30 0.00 0.00 0.00 179.25 176.49 3igv n PRO 417 N -5.26 0.07 -2.20 0.00 -0.02 -1.26 -4.45 135.00 121.87 3igv n PRO 417 Ca 0.20 0.06 -0.34 0.00 -2.02 0.00 0.00 63.50 61.40 3igv n PRO 417 Cb 0.66 -1.50 0.01 0.00 -0.02 0.00 0.00 33.50 32.64 3igv n PRO 417 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 3igv s THR 418 N -2.93 3.28 0.12 3.45 -4.23 -0.37 -4.95 115.64 110.02 3igv s THR 418 Ca 0.14 0.75 -0.20 0.00 -1.18 0.00 0.00 61.69 61.21 3igv s THR 418 Cb 0.17 -3.28 -0.08 0.00 1.34 0.00 0.00 72.50 70.65 3igv s THR 418 CO 0.45 -0.21 1.77 0.25 -0.54 0.00 0.00 174.62 176.34 3igv h LEU 419 N 1.01 0.21 -0.93 4.79 5.85 -1.89 -2.76 115.31 121.58 3igv h LEU 419 Ca -0.49 -0.01 -0.11 0.00 0.84 0.00 0.00 57.88 58.11 3igv h LEU 419 Cb 1.25 -0.05 -0.02 0.00 0.37 0.00 0.00 40.66 42.21 3igv h LEU 419 CO 0.57 0.16 -0.52 4.11 -0.34 0.00 0.00 178.44 182.42 3igv h TRP 420 N 0.25 0.00 0.00 1.25 5.08 -1.93 -2.08 115.95 118.51 3igv h TRP 420 Ca 0.07 0.00 -0.25 0.00 1.08 0.00 0.00 58.89 59.78 3igv h TRP 420 Cb -0.02 0.00 0.01 0.00 -3.00 0.00 0.00 29.16 26.15 3igv h TRP 420 CO -0.06 0.52 -1.01 0.00 -1.28 0.00 0.00 178.44 176.60 3igv h ALA 421 N 1.48 0.22 -0.13 0.11 0.00 -1.81 -2.11 119.26 117.02 3igv h ALA 421 Ca -0.01 -0.70 -0.12 0.00 0.00 0.00 0.00 54.91 54.08 3igv h ALA 421 Cb 0.94 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.77 3igv h ALA 421 CO 0.07 0.74 -0.39 0.00 0.00 0.00 0.00 179.25 179.66 3igv h ARG 422 N 0.33 0.50 0.00 0.00 3.08 -1.46 0.20 114.38 117.03 3igv h ARG 422 Ca -0.11 -0.36 -0.23 0.00 0.07 0.00 0.00 59.98 59.34 3igv h ARG 422 Cb 1.66 0.06 -0.04 0.00 0.08 0.00 0.00 29.97 31.73 3igv h ARG 422 CO 0.19 0.98 -1.35 0.52 -1.07 0.00 0.00 179.97 179.25 3igv h MET 423 N 0.11 0.00 0.00 0.04 2.86 -1.48 -3.34 114.93 113.12 3igv h MET 423 Ca -0.01 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.63 3igv h MET 423 Cb 1.01 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.67 3igv h MET 423 CO 0.08 0.62 -0.28 -0.89 1.06 0.00 0.00 176.91 177.50 3igv n ILE 424 N -3.13 0.60 -0.26 -1.22 5.41 -0.80 -4.35 119.36 115.61 3igv n ILE 424 Ca -0.09 0.29 -0.01 0.00 1.00 0.00 0.00 62.75 63.93 3igv n ILE 424 Cb 0.96 -1.66 0.10 0.00 -0.71 0.00 0.00 39.64 38.34 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 -0.28 0.68 -0.16 1.39 3.38 -1.39 0.13 115.31 119.05 3igv h LEU 425 Ca 0.00 0.02 -0.04 0.00 0.09 0.00 0.00 57.88 57.95 3igv h LEU 425 Cb 0.28 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 40.91 3igv h LEU 425 CO 0.00 0.44 -0.06 0.24 0.09 0.00 0.00 178.44 179.15 3igv h MET 426 N 0.81 0.32 0.28 1.13 2.86 -1.10 -2.68 114.93 116.55 3igv h MET 426 Ca 0.31 -0.13 -0.01 0.00 -2.06 0.00 0.00 59.70 57.81 3igv h MET 426 Cb 0.13 -0.01 0.00 0.00 0.06 0.00 0.00 31.60 31.78 3igv h MET 426 CO -0.16 0.62 -0.14 1.15 1.06 0.00 0.00 176.91 179.45 3igv h THR 427 N -0.00 0.76 0.02 2.22 2.02 -1.58 -1.99 112.91 114.35 3igv h THR 427 Ca 0.04 -0.46 0.03 0.00 0.77 0.00 0.00 66.41 66.79 3igv h THR 427 Cb 0.52 1.01 -0.05 0.00 -1.74 0.00 0.00 68.15 67.88 3igv h THR 427 CO 0.02 0.10 -0.30 -0.74 0.37 0.00 0.00 175.52 174.96 3igv h HIS 428 N -0.63 -0.83 0.00 3.16 6.17 -0.88 -2.69 115.15 119.45 3igv h HIS 428 Ca -0.04 0.03 -0.13 0.00 0.71 0.00 0.00 60.37 60.94 3igv h HIS 428 Cb 0.45 0.36 -0.02 0.00 2.52 0.00 0.00 27.41 30.72 3igv h HIS 428 CO 0.01 -0.40 -0.61 0.74 0.71 0.00 0.00 177.93 178.38 3igv h PHE 429 N -0.46 0.00 -0.06 5.26 0.04 -1.51 -2.60 116.94 117.61 3igv h PHE 429 Ca 0.06 0.00 -0.16 0.00 2.80 0.00 0.00 57.97 60.67 3igv h PHE 429 Cb 0.54 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.68 3igv h PHE 429 CO -0.32 0.61 -0.67 0.74 -0.60 0.00 0.00 178.31 178.06 3igv h PHE 430 N 0.00 0.32 -0.51 -0.55 0.04 -1.39 -2.01 116.94 112.84 3igv h PHE 430 Ca -0.01 -0.14 0.03 0.00 2.80 0.00 0.00 57.97 60.66 3igv h PHE 430 Cb 1.29 -0.05 -0.04 0.00 2.20 0.00 0.00 35.95 39.35 3igv h PHE 430 CO 0.00 0.84 0.29 1.03 -0.60 0.00 0.00 178.31 179.86 3igv h SER 431 N 0.17 0.44 -0.47 2.17 0.87 -1.28 -0.35 113.55 115.10 3igv h SER 431 Ca -0.02 0.01 0.01 0.00 -1.23 0.00 0.00 61.79 60.56 3igv h SER 431 Cb 1.21 -0.08 -0.02 0.00 -0.44 0.00 0.00 62.40 63.07 3igv h SER 431 CO 0.10 0.31 0.31 0.40 -0.53 0.00 0.00 176.83 177.42 3igv h ILE 432 N 0.56 1.12 -0.12 2.23 2.04 -1.34 -2.43 117.51 119.57 3igv h ILE 432 Ca 0.21 -0.22 -0.13 0.00 1.00 0.00 0.00 64.86 65.72 3igv h ILE 432 Cb 0.07 0.43 -0.01 0.00 -0.74 0.00 0.00 36.82 36.57 3igv h ILE 432 CO -0.12 0.11 -0.50 -0.07 0.00 0.00 0.00 178.15 177.57 3igv h LEU 433 N 0.63 0.36 -0.13 1.44 3.38 -1.01 -2.19 115.31 117.79 3igv h LEU 433 Ca 0.17 -0.18 -0.02 0.00 0.09 0.00 0.00 57.88 57.94 3igv h LEU 433 Cb -0.07 -0.10 -0.00 0.00 0.09 0.00 0.00 40.66 40.57 3igv h LEU 433 CO -0.04 0.80 -0.01 -0.07 0.09 0.00 0.00 178.44 179.22 3igv h LEU 434 N 0.26 0.23 -1.46 1.67 3.38 -1.01 0.59 115.31 118.97 3igv h LEU 434 Ca 0.01 -0.32 -0.06 0.00 0.09 0.00 0.00 57.88 57.60 3igv h LEU 434 Cb 0.98 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 41.66 3igv h LEU 434 CO 0.08 0.50 -0.26 0.00 0.09 0.00 0.00 178.44 178.85 3igv h ALA 435 N 0.74 1.56 -0.01 1.53 0.00 -1.38 -2.55 119.26 119.15 3igv h ALA 435 Ca 0.04 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.70 3igv h ALA 435 Cb 0.38 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.13 3igv h ALA 435 CO 0.01 0.33 -0.48 1.04 0.00 0.00 0.00 179.25 180.15 3igv n GLN 436 N -4.23 0.52 -3.69 0.00 1.13 -0.83 -4.97 117.38 105.31 3igv n GLN 436 Ca -0.02 -0.35 -0.21 0.00 -1.94 0.00 0.00 57.00 54.47 3igv n GLN 436 Cb 0.31 -1.49 0.03 0.00 0.11 0.00 0.00 30.24 29.21 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 -0.93 -4.80 -1.44 -1.09 1.02 -0.50 -4.94 120.64 107.96 3igv n GLU 437 Ca 0.08 0.62 -0.04 0.00 -0.02 0.00 0.00 57.16 57.80 3igv n GLU 437 Cb 0.36 -5.17 0.10 0.00 -0.02 0.00 0.00 31.44 26.72 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 -4.25 2.01 -0.21 3.49 6.02 0.08 -4.79 117.38 119.72 3igv n GLN 438 Ca -0.29 -3.41 -0.08 0.00 -0.01 0.00 0.00 57.00 53.21 3igv n GLN 438 Cb 0.68 -1.58 0.02 0.00 1.02 0.00 0.00 30.24 30.38 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 1.55 0.93 -0.09 1.08 3.38 -1.93 -3.18 115.31 117.07 3igv h LEU 439 Ca 0.07 -0.25 0.00 0.00 0.09 0.00 0.00 57.88 57.78 3igv h LEU 439 Cb 1.34 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 41.84 3igv h LEU 439 CO 0.28 0.95 -0.23 -0.62 0.09 0.00 0.00 178.44 178.90 3igv n GLU 440 N -4.32 0.22 -2.56 1.13 1.02 -1.26 -3.97 120.64 110.90 3igv n GLU 440 Ca 0.03 -0.09 -0.43 0.00 -0.02 0.00 0.00 57.16 56.66 3igv n GLU 440 Cb 0.26 -1.50 -0.02 0.00 -0.02 0.00 0.00 31.44 30.16 3igv n GLU 440 CO 0.00 0.00 0.00 0.21 1.18 0.00 0.00 177.13 178.52 3igv s LYS 441 N -2.84 4.26 0.34 3.49 2.20 -1.20 -4.90 119.74 121.10 3igv s LYS 441 Ca 0.17 1.50 -0.29 0.00 -0.36 0.00 0.00 55.97 57.00 3igv s LYS 441 Cb 0.19 -3.68 -0.10 0.00 -1.51 0.00 0.00 37.83 32.72 3igv s LYS 441 CO 0.58 -0.63 1.36 0.00 -0.36 0.00 0.00 175.35 176.29 3igv s ALA 442 N 3.19 3.52 0.15 3.13 0.00 -1.26 -4.50 121.76 125.98 3igv s ALA 442 Ca 0.49 1.35 0.10 0.00 0.00 0.00 0.00 51.96 53.90 3igv s ALA 442 Cb -0.18 -3.51 -0.04 0.00 0.00 0.00 0.00 23.12 19.38 3igv s ALA 442 CO 0.11 -0.75 -0.24 -0.51 0.00 0.00 0.00 175.76 174.37 3igv s LEU 443 N -1.85 2.36 0.01 0.00 1.43 0.38 -4.87 118.68 116.14 3igv s LEU 443 Ca 0.50 -0.78 -0.18 0.00 -1.03 0.00 0.00 54.13 52.64 3igv s LEU 443 Cb -0.42 -1.07 -0.06 0.00 0.03 0.00 0.00 46.19 44.67 3igv s LEU 443 CO 0.56 0.11 0.51 -1.81 0.23 0.00 0.00 176.35 175.94 3igv s ASP 444 N -2.27 6.92 0.18 2.29 1.01 -1.26 -0.04 116.67 123.49 3igv s ASP 444 Ca 0.14 1.09 -0.14 0.00 0.71 0.00 0.00 52.55 54.35 3igv s ASP 444 Cb -0.09 -2.31 0.02 0.00 1.01 0.00 0.00 42.92 41.54 3igv s ASP 444 CO 0.07 0.23 0.43 0.00 0.21 0.00 0.00 175.17 176.11 3igv s GLN 446 N -3.90 3.58 -0.21 0.00 -0.21 -1.26 -1.18 119.66 116.48 3igv s GLN 446 Ca 0.11 -0.52 -0.01 0.00 0.02 0.00 0.00 55.36 54.96 3igv s GLN 446 Cb 0.01 -3.20 0.02 0.00 1.00 0.00 0.00 33.01 30.84 3igv s GLN 446 CO -0.03 -0.15 -0.12 0.42 -2.12 0.00 0.00 175.29 173.30 3igv s ILE 447 N 1.44 2.61 -1.33 1.08 1.01 -0.56 -4.72 121.20 120.74 3igv s ILE 447 Ca 0.05 -0.88 -0.06 0.00 0.00 0.00 0.00 60.65 59.76 3igv s ILE 447 Cb -0.15 -2.20 0.04 0.00 0.01 0.00 0.00 42.46 40.16 3igv s ILE 447 CO 0.01 0.40 0.43 -1.22 0.00 0.00 0.00 174.94 174.56 3igv n TYR 448 N 4.67 -1.76 0.00 3.97 4.01 -1.26 -1.87 117.16 124.92 3igv n TYR 448 Ca -0.19 0.39 0.00 0.00 -0.16 0.00 0.00 57.90 57.94 3igv n TYR 448 Cb 0.49 -3.35 0.00 0.00 -0.31 0.00 0.00 39.34 36.17 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 -1.20 3.06 3.86 2.72 0.00 -1.26 -0.46 105.19 111.90 3igv n GLY 449 Ca -0.07 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.63 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 -2.49 3.08 -0.11 4.61 0.00 -0.78 -4.51 121.76 121.56 3igv s ALA 450 Ca 0.00 0.05 -0.04 0.00 0.00 0.00 0.00 51.96 51.98 3igv s ALA 450 Cb 0.00 -3.10 -0.04 0.00 0.00 0.00 0.00 23.12 19.98 3igv s ALA 450 CO 0.00 -0.45 0.04 0.00 0.00 0.00 0.00 175.76 175.35 3igv s TYR 452 N -0.70 0.92 -0.25 0.00 2.02 -0.32 -1.34 117.35 117.68 3igv s TYR 452 Ca 0.12 -0.28 -0.15 0.00 -0.37 0.00 0.00 57.07 56.39 3igv s TYR 452 Cb -0.12 -0.56 -0.04 0.00 -0.40 0.00 0.00 41.96 40.84 3igv s TYR 452 CO 0.02 -0.01 0.38 0.45 -1.57 0.00 0.00 175.55 174.83 3igv s SER 453 N -0.76 6.32 -0.06 2.29 0.15 -1.26 -1.72 113.70 118.66 3igv s SER 453 Ca 0.01 0.37 0.01 0.00 0.70 0.00 0.00 55.95 57.03 3igv s SER 453 Cb -0.06 -2.22 0.02 0.00 -1.71 0.00 0.00 66.02 62.06 3igv s SER 453 CO 0.00 -0.14 -0.04 -0.63 1.20 0.00 0.00 173.24 173.63 3igv s ILE 454 N 1.79 0.58 -0.33 6.45 1.01 0.94 -4.90 121.20 126.73 3igv s ILE 454 Ca 0.16 -0.11 -0.26 0.00 0.00 0.00 0.00 60.65 60.44 3igv s ILE 454 Cb -0.15 -0.62 0.01 0.00 0.01 0.00 0.00 42.46 41.71 3igv s ILE 454 CO 0.09 0.25 0.92 -1.61 0.00 0.00 0.00 174.94 174.59 3igv s GLU 455 N 1.15 3.95 0.59 2.79 2.02 -1.26 -0.47 118.70 127.47 3igv s GLU 455 Ca -0.07 0.73 0.30 0.00 0.02 0.00 0.00 54.97 55.95 3igv s GLU 455 Cb -0.14 -3.76 1.29 0.00 0.10 0.00 0.00 34.13 31.62 3igv s GLU 455 CO -0.01 -0.84 1.64 -1.35 0.02 0.00 0.00 175.26 174.72 3igv h PRO 456 N 8.23 0.00 0.00 0.39 0.11 -1.79 0.37 132.00 139.30 3igv h PRO 456 Ca -0.23 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.88 3igv h PRO 456 Cb 1.08 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.19 3igv h PRO 456 CO 0.96 0.00 0.00 1.28 -0.21 0.00 0.00 178.00 180.03 3igv n LEU 457 N -3.58 0.06 -0.29 2.35 4.77 -1.25 -1.93 117.00 117.13 3igv n LEU 457 Ca 0.18 0.51 0.14 0.00 -0.03 0.00 0.00 56.01 56.81 3igv n LEU 457 Cb 1.14 -0.50 0.49 0.00 -2.33 0.00 0.00 43.42 42.22 3igv n LEU 457 CO 0.28 -0.21 0.78 0.47 -1.33 0.00 0.00 177.39 177.38 3igv n ASP 458 N -1.56 1.04 -0.33 -1.43 10.43 0.13 -4.48 116.55 120.35 3igv n ASP 458 Ca 0.04 -1.03 0.05 0.00 2.57 0.00 0.00 54.79 56.42 3igv n ASP 458 Cb 0.22 0.05 0.20 0.00 1.84 0.00 0.00 41.12 43.43 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 1.41 0.79 -0.55 0.64 3.38 -1.52 -1.71 115.31 117.75 3igv h LEU 459 Ca 0.00 0.05 0.00 0.00 0.09 0.00 0.00 57.88 58.02 3igv h LEU 459 Cb 0.46 -0.10 -0.03 0.00 0.09 0.00 0.00 40.66 41.08 3igv h LEU 459 CO 0.00 0.43 0.36 -0.65 0.09 0.00 0.00 178.44 178.66 3igv h PRO 460 N 0.88 0.72 -0.29 1.13 0.11 -1.83 -1.48 132.00 131.24 3igv h PRO 460 Ca 0.45 -0.05 -0.03 0.00 0.11 0.00 0.00 66.00 66.48 3igv h PRO 460 Cb 0.43 -0.16 -0.01 0.00 0.11 0.00 0.00 31.00 31.37 3igv h PRO 460 CO -0.26 0.49 0.08 1.96 -0.21 0.00 0.00 178.00 180.06 3igv h GLN 461 N 0.74 0.46 -0.31 1.05 7.50 -1.76 -2.15 115.11 120.65 3igv h GLN 461 Ca 0.20 -0.11 0.05 0.00 0.50 0.00 0.00 58.65 59.29 3igv h GLN 461 Cb -0.07 -0.06 -0.04 0.00 0.05 0.00 0.00 27.48 27.35 3igv h GLN 461 CO -0.04 0.53 0.05 0.82 -1.50 0.00 0.00 178.83 178.68 3igv h ILE 462 N 0.31 0.83 -0.15 2.54 2.04 -1.25 -2.24 117.51 119.59 3igv h ILE 462 Ca 0.09 -0.05 -0.08 0.00 1.00 0.00 0.00 64.86 65.82 3igv h ILE 462 Cb 0.27 0.66 -0.01 0.00 -0.74 0.00 0.00 36.82 37.00 3igv h ILE 462 CO -0.00 0.03 -0.26 0.40 0.00 0.00 0.00 178.15 178.32 3igv h ILE 463 N 0.15 1.25 -0.59 -0.67 2.04 -1.16 -1.67 117.51 116.85 3igv h ILE 463 Ca 0.15 -1.16 -0.04 0.00 1.00 0.00 0.00 64.86 64.81 3igv h ILE 463 Cb 0.17 1.42 -0.03 0.00 -0.74 0.00 0.00 36.82 37.64 3igv h ILE 463 CO -0.21 0.35 0.22 -0.08 0.00 0.00 0.00 178.15 178.44 3igv h GLU 464 N 0.25 0.90 -0.06 2.37 4.81 -1.04 -1.51 114.58 120.30 3igv h GLU 464 Ca 0.04 -0.17 -0.15 0.00 -0.13 0.00 0.00 59.36 58.95 3igv h GLU 464 Cb 0.60 -0.14 -0.01 0.00 0.63 0.00 0.00 28.75 29.82 3igv h GLU 464 CO 0.04 0.78 -0.62 0.00 -0.73 0.00 0.00 179.01 178.48 3igv h ARG 465 N 0.83 0.23 0.00 1.92 2.47 -0.84 -1.28 114.38 117.71 3igv h ARG 465 Ca 0.20 -0.16 0.00 0.00 -1.26 0.00 0.00 59.98 58.75 3igv h ARG 465 Cb 0.23 0.03 0.00 0.00 -1.65 0.00 0.00 29.97 28.57 3igv h ARG 465 CO -0.01 0.78 -1.29 1.28 0.56 0.00 0.00 179.97 181.28 3igv n LEU 466 N -3.86 0.56 0.00 3.04 4.77 -0.68 -4.62 117.00 116.21 3igv n LEU 466 Ca -0.02 -0.17 0.00 0.00 -0.03 0.00 0.00 56.01 55.79 3igv n LEU 466 Cb 0.63 -0.04 0.00 0.00 -2.33 0.00 0.00 43.42 41.68 3igv n LEU 466 CO 0.45 0.10 -0.12 1.41 -1.33 0.00 0.00 177.39 177.89 3igv n HIS 467 N -1.90 0.00 0.00 -1.77 8.25 -0.58 -1.32 115.22 117.90 3igv n HIS 467 Ca 0.01 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.47 3igv n HIS 467 Cb 0.44 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.55 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 0.81 0.23 0.27 -1.41 0.00 -0.48 -4.64 105.19 99.96 3igv n GLY 468 Ca 0.00 -1.78 0.11 0.00 0.00 0.00 0.00 46.02 44.35 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 0.00 -2.63 0.99 3.38 -1.87 -2.64 115.31 112.54 3igv h LEU 469 Ca 0.00 0.00 0.01 0.00 0.09 0.00 0.00 57.88 57.98 3igv h LEU 469 Cb 0.00 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.75 3igv h LEU 469 CO 0.00 0.02 0.08 0.77 0.09 0.00 0.00 178.44 179.40 3igv h SER 470 N 0.00 0.00 0.32 -0.43 4.64 -1.97 -1.13 113.55 114.99 3igv h SER 470 Ca -0.00 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3igv h SER 470 Cb 0.04 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.13 3igv h SER 470 CO 0.00 0.00 -0.00 0.00 -0.87 0.00 0.00 176.83 175.96 3igv h ALA 471 N 1.87 1.01 -0.41 5.18 0.00 -1.73 -1.95 119.26 123.23 3igv h ALA 471 Ca 0.01 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.92 3igv h ALA 471 Cb 0.17 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.96 3igv h ALA 471 CO -0.00 0.00 0.00 1.19 0.00 0.00 0.00 179.25 180.44 3igv n PHE 472 N -3.10 0.53 -1.62 0.00 3.72 -0.43 -4.36 117.46 112.21 3igv n PHE 472 Ca -0.02 -0.27 0.00 0.00 -0.05 0.00 0.00 57.45 57.12 3igv n PHE 472 Cb 0.14 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.68 3igv n PHE 472 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 176.76 175.58 3igv n SER 473 N 1.25 0.00 -4.73 4.37 3.41 -0.78 -4.50 113.62 112.64 3igv n SER 473 Ca 0.19 -1.40 -0.42 0.00 -0.26 0.00 0.00 58.87 56.99 3igv n SER 473 Cb 0.54 -0.08 -0.03 0.00 -0.26 0.00 0.00 64.21 64.38 3igv n SER 473 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 3igv s LEU 474 N 0.00 4.39 0.34 1.04 1.43 -0.89 -3.88 118.68 121.10 3igv s LEU 474 Ca 0.00 2.41 0.08 0.00 -1.03 0.00 0.00 54.13 55.59 3igv s LEU 474 Cb 0.00 -3.60 -0.03 0.00 0.03 0.00 0.00 46.19 42.59 3igv s LEU 474 CO 0.00 -0.62 0.29 -1.38 0.23 0.00 0.00 176.35 174.87 3igv s HIS 475 N 0.60 1.79 -1.13 0.29 -3.43 -0.23 -4.96 115.29 108.22 3igv s HIS 475 Ca 0.61 -1.68 -0.22 0.00 -0.80 0.00 0.00 55.06 52.97 3igv s HIS 475 Cb -0.38 -0.72 -0.00 0.00 -1.43 0.00 0.00 32.58 30.05 3igv s HIS 475 CO 0.35 -0.89 0.78 0.43 -2.00 0.00 0.00 174.74 173.41 3igv n SER 476 N -1.63 -5.24 -4.74 7.38 7.64 -1.26 -1.68 113.62 114.09 3igv n SER 476 Ca 0.08 -1.04 -0.33 0.00 1.01 0.00 0.00 58.87 58.59 3igv n SER 476 Cb 0.62 -3.15 0.08 0.00 -1.01 0.00 0.00 64.21 60.75 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 -3.45 2.27 0.54 1.43 2.02 -1.26 -4.19 117.35 114.71 3igv s TYR 477 Ca 0.46 1.60 -0.20 0.00 -0.37 0.00 0.00 57.07 58.56 3igv s TYR 477 Cb -0.18 -3.30 -0.06 0.00 -0.40 0.00 0.00 41.96 38.02 3igv s TYR 477 CO 0.87 -2.20 1.14 -1.54 -1.57 0.00 0.00 175.55 172.26 3igv s SER 478 N -2.44 5.73 0.41 2.29 1.04 -1.24 -4.86 113.70 114.64 3igv s SER 478 Ca 0.69 2.21 0.14 0.00 0.48 0.00 0.00 55.95 59.48 3igv s SER 478 Cb -0.24 -2.59 1.00 0.00 0.10 0.00 0.00 66.02 64.30 3igv s SER 478 CO 0.46 -1.22 1.89 -0.65 0.98 0.00 0.00 173.24 174.71 3igv h PRO 479 N 1.27 0.47 -0.28 4.02 0.11 -1.96 -1.04 132.00 134.59 3igv h PRO 479 Ca -0.50 -0.03 -0.08 0.00 0.11 0.00 0.00 66.00 65.51 3igv h PRO 479 Cb 1.26 -0.11 -0.01 0.00 0.11 0.00 0.00 31.00 32.26 3igv h PRO 479 CO 0.57 0.31 -0.12 0.78 -0.21 0.00 0.00 178.00 179.33 3igv h GLY 480 N 0.48 0.63 0.87 -0.55 0.00 -2.00 -1.88 103.07 100.62 3igv h GLY 480 Ca 0.41 -0.55 -0.05 0.00 0.00 0.00 0.00 47.33 47.14 3igv h GLY 480 CO -0.15 0.50 -0.02 -2.09 0.00 0.00 0.00 176.54 174.78 3igv h GLU 481 N 0.32 0.50 -0.76 4.80 4.57 -1.87 -2.65 114.58 119.49 3igv h GLU 481 Ca 0.06 -0.17 0.06 0.00 -1.18 0.00 0.00 59.36 58.13 3igv h GLU 481 Cb 0.63 -0.04 -0.06 0.00 -0.16 0.00 0.00 28.75 29.12 3igv h GLU 481 CO 0.04 0.68 0.45 0.82 -1.18 0.00 0.00 179.01 179.82 3igv h ILE 482 N 0.28 1.00 -0.52 2.32 2.04 -1.20 -1.19 117.51 120.25 3igv h ILE 482 Ca 0.08 -0.28 -0.01 0.00 1.00 0.00 0.00 64.86 65.65 3igv h ILE 482 Cb 0.46 0.11 -0.02 0.00 -0.74 0.00 0.00 36.82 36.63 3igv h ILE 482 CO 0.02 0.15 0.30 0.78 0.00 0.00 0.00 178.15 179.39 3igv h ASN 483 N 0.82 0.63 -0.28 1.72 2.35 -1.30 -1.27 115.58 118.25 3igv h ASN 483 Ca 0.34 -0.08 -0.08 0.00 -0.55 0.00 0.00 56.30 55.93 3igv h ASN 483 Cb 0.18 -0.16 -0.02 0.00 0.05 0.00 0.00 38.32 38.37 3igv h ASN 483 CO -0.18 0.53 -0.09 -0.09 -1.65 0.00 0.00 177.43 175.95 3igv h ARG 484 N 0.69 0.68 0.06 0.81 2.43 -1.06 0.12 114.38 118.11 3igv h ARG 484 Ca 0.18 -0.20 -0.00 0.00 -0.81 0.00 0.00 59.98 59.15 3igv h ARG 484 Cb 0.02 -0.07 0.00 0.00 -0.42 0.00 0.00 29.97 29.50 3igv h ARG 484 CO -0.03 0.75 -0.03 0.28 -1.51 0.00 0.00 179.97 179.43 3igv h VAL 485 N 0.62 1.07 -0.42 0.20 2.07 -1.07 -2.86 116.25 115.87 3igv h VAL 485 Ca 0.11 -0.44 -0.00 0.00 0.82 0.00 0.00 66.70 67.19 3igv h VAL 485 Cb 0.52 1.36 -0.02 0.00 -1.52 0.00 0.00 31.29 31.63 3igv h VAL 485 CO 0.03 0.11 0.25 0.00 0.02 0.00 0.00 177.57 177.98 3igv h ALA 486 N 0.65 0.54 0.00 1.67 0.00 -0.97 -2.58 119.26 118.57 3igv h ALA 486 Ca -0.01 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 54.84 3igv h ALA 486 Cb 0.24 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 17.86 3igv h ALA 486 CO 0.01 0.03 -0.00 1.03 0.00 0.00 0.00 179.25 180.32 3igv h SER 487 N 0.55 0.00 -0.09 0.00 0.87 -0.80 -1.55 113.55 112.53 3igv h SER 487 Ca 0.15 0.00 -0.23 0.00 -1.23 0.00 0.00 61.79 60.48 3igv h SER 487 Cb 0.01 0.00 0.01 0.00 -0.44 0.00 0.00 62.40 61.98 3igv h SER 487 CO -0.03 0.00 -0.85 0.00 -0.53 0.00 0.00 176.83 175.43 3igv h LEU 489 N 0.43 0.75 -0.63 0.00 3.38 -0.98 -0.70 115.31 117.56 3igv h LEU 489 Ca -0.08 -0.25 -0.07 0.00 0.09 0.00 0.00 57.88 57.57 3igv h LEU 489 Cb 1.49 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 42.01 3igv h LEU 489 CO 0.17 0.93 0.13 0.03 0.09 0.00 0.00 178.44 179.79 3igv h ARG 490 N 0.66 1.02 -0.59 1.13 3.08 -1.51 0.11 114.38 118.28 3igv h ARG 490 Ca 0.10 -0.26 -0.02 0.00 0.07 0.00 0.00 59.98 59.87 3igv h ARG 490 Cb 0.67 -0.13 -0.03 0.00 0.08 0.00 0.00 29.97 30.57 3igv h ARG 490 CO 0.05 0.94 0.28 -0.22 -1.07 0.00 0.00 179.97 179.95 3igv h LYS 491 N 0.94 0.86 0.00 0.04 3.64 -1.23 -3.29 116.57 117.52 3igv h LYS 491 Ca 0.19 -0.13 0.00 0.00 -1.27 0.00 0.00 60.65 59.45 3igv h LYS 491 Cb 0.39 -0.15 0.00 0.00 -0.41 0.00 0.00 32.23 32.06 3igv h LYS 491 CO 0.01 0.70 -1.60 1.28 -2.27 0.00 0.00 179.45 177.57 3igv n LEU 492 N -4.52 0.33 -0.46 5.20 4.77 -0.31 -4.89 117.00 117.12 3igv n LEU 492 Ca 0.04 0.02 0.00 0.00 -0.03 0.00 0.00 56.01 56.04 3igv n LEU 492 Cb 0.13 -0.02 0.00 0.00 -2.33 0.00 0.00 43.42 41.19 3igv n LEU 492 CO 0.38 -0.01 0.00 0.61 -1.33 0.00 0.00 177.39 177.04 3igv n GLY 493 N 1.28 0.95 3.74 -0.72 0.00 0.25 -1.61 105.19 109.08 3igv n GLY 493 Ca -0.02 -0.64 -0.39 0.00 0.00 0.00 0.00 46.02 44.97 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 -2.92 4.91 0.20 1.61 1.01 -0.43 -0.98 120.40 123.80 3igv s VAL 494 Ca 0.00 1.40 -0.31 0.00 0.00 0.00 0.00 61.98 63.07 3igv s VAL 494 Cb 0.00 -4.01 -0.16 0.00 0.00 0.00 0.00 36.38 32.21 3igv s VAL 494 CO 0.00 0.35 0.94 -2.65 0.00 0.00 0.00 175.10 173.74 3igv n PRO 495 N 3.08 0.82 -1.20 2.72 -0.02 -1.26 -4.72 135.00 134.42 3igv n PRO 495 Ca -0.04 0.29 -0.35 0.00 -2.02 0.00 0.00 63.50 61.38 3igv n PRO 495 Cb 0.51 -1.62 0.10 0.00 -0.02 0.00 0.00 33.50 32.48 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 1.22 0.29 0.17 0.52 -0.04 -1.26 -4.76 135.00 131.14 3igv n PRO 496 Ca 0.15 0.16 0.13 0.00 -0.04 0.00 0.00 63.50 63.89 3igv n PRO 496 Cb 0.26 -2.24 0.59 0.00 -0.04 0.00 0.00 33.50 32.06 3igv n PRO 496 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 3igv h LEU 497 N -0.64 0.00 -0.69 1.53 3.38 -2.00 0.52 115.31 117.41 3igv h LEU 497 Ca -0.46 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 57.37 3igv h LEU 497 Cb 1.32 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.06 3igv h LEU 497 CO 0.45 0.00 -0.45 0.08 0.09 0.00 0.00 178.44 178.61 3igv h ARG 498 N 0.00 0.47 -0.58 1.13 0.11 -2.00 -2.09 114.38 111.43 3igv h ARG 498 Ca 0.00 -0.25 -0.03 0.00 0.10 0.00 0.00 59.98 59.79 3igv h ARG 498 Cb 0.22 0.01 -0.03 0.00 1.11 0.00 0.00 29.97 31.29 3igv h ARG 498 CO 0.00 0.83 0.23 0.28 0.10 0.00 0.00 179.97 181.41 3igv h VAL 499 N 0.39 1.23 -0.49 0.08 2.07 -1.22 -2.60 116.25 115.70 3igv h VAL 499 Ca 0.03 -0.71 -0.08 0.00 0.82 0.00 0.00 66.70 66.76 3igv h VAL 499 Cb 0.94 0.61 -0.02 0.00 -1.52 0.00 0.00 31.29 31.30 3igv h VAL 499 CO 0.08 0.27 -0.02 -0.50 0.02 0.00 0.00 177.57 177.42 3igv h TRP 500 N 0.79 0.89 -0.51 1.57 4.06 -1.48 -2.12 115.95 119.16 3igv h TRP 500 Ca 0.19 -0.14 0.04 0.00 2.06 0.00 0.00 58.89 61.05 3igv h TRP 500 Cb 0.21 -0.24 -0.04 0.00 -1.00 0.00 0.00 29.16 28.08 3igv h TRP 500 CO 0.01 0.83 0.26 -0.09 -3.56 0.00 0.00 178.44 175.89 3igv h ARG 501 N 0.77 0.49 -0.51 0.49 2.43 -1.24 -0.65 114.38 116.16 3igv h ARG 501 Ca 0.14 -0.03 0.01 0.00 -0.81 0.00 0.00 59.98 59.29 3igv h ARG 501 Cb 0.50 -0.11 -0.03 0.00 -0.42 0.00 0.00 29.97 29.91 3igv h ARG 501 CO 0.02 0.32 0.33 1.25 -1.51 0.00 0.00 179.97 180.39 3igv h HIS 502 N 0.50 0.62 -0.20 2.20 2.76 -1.12 -2.62 115.15 117.29 3igv h HIS 502 Ca 0.22 0.02 -0.10 0.00 -2.20 0.00 0.00 60.37 58.31 3igv h HIS 502 Cb 0.13 -0.21 -0.01 0.00 1.55 0.00 0.00 27.41 28.87 3igv h HIS 502 CO -0.10 0.38 -0.29 0.00 -1.30 0.00 0.00 177.93 176.62 3igv h ARG 503 N 0.67 0.39 -0.59 5.26 3.08 -1.08 -3.01 114.38 119.10 3igv h ARG 503 Ca 0.19 -0.15 -0.07 0.00 0.07 0.00 0.00 59.98 60.02 3igv h ARG 503 Cb -0.05 -0.02 -0.03 0.00 0.08 0.00 0.00 29.97 29.95 3igv h ARG 503 CO -0.05 0.65 0.10 0.00 -1.07 0.00 0.00 179.97 179.59 3igv h ALA 504 N 1.35 1.06 -0.78 0.04 0.00 -0.79 -1.76 119.26 118.38 3igv h ALA 504 Ca 0.05 -0.25 0.12 0.00 0.00 0.00 0.00 54.91 54.83 3igv h ALA 504 Cb 0.69 -0.23 -0.08 0.00 0.00 0.00 0.00 17.79 18.16 3igv h ALA 504 CO 0.05 0.61 0.38 0.00 0.00 0.00 0.00 179.25 180.30 3igv h ARG 505 N 0.90 0.58 0.45 0.00 3.08 -1.34 0.21 114.38 118.26 3igv h ARG 505 Ca 0.18 -0.04 -0.02 0.00 0.07 0.00 0.00 59.98 60.18 3igv h ARG 505 Cb 0.39 -0.13 0.00 0.00 0.08 0.00 0.00 29.97 30.32 3igv h ARG 505 CO 0.01 0.39 -0.22 1.03 -1.07 0.00 0.00 179.97 180.11 3igv h SER 506 N 0.60 -0.51 -0.12 7.04 0.87 -1.41 -2.51 113.55 117.51 3igv h SER 506 Ca 0.41 -0.04 0.03 0.00 -1.23 0.00 0.00 61.79 60.96 3igv h SER 506 Cb 0.51 0.13 -0.03 0.00 -0.44 0.00 0.00 62.40 62.58 3igv h SER 506 CO -0.32 -0.29 -0.06 0.58 -0.53 0.00 0.00 176.83 176.21 3igv h VAL 507 N -0.71 0.81 -0.17 2.23 2.07 -0.86 -0.90 116.25 118.71 3igv h VAL 507 Ca -0.06 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.51 3igv h VAL 507 Cb 0.52 0.81 -0.07 0.00 -1.52 0.00 0.00 31.29 31.03 3igv h VAL 507 CO 0.10 0.00 -0.36 -0.09 0.02 0.00 0.00 177.57 177.24 3igv h ARG 508 N -0.04 -0.39 -0.52 1.57 2.43 -0.66 0.20 114.38 116.95 3igv h ARG 508 Ca 0.07 0.03 0.01 0.00 -0.81 0.00 0.00 59.98 59.28 3igv h ARG 508 Cb 0.15 0.09 -0.03 0.00 -0.42 0.00 0.00 29.97 29.76 3igv h ARG 508 CO -0.15 -0.26 0.33 0.00 -1.51 0.00 0.00 179.97 178.37 3igv h ALA 509 N 0.36 0.67 -0.86 2.80 0.00 -1.10 0.13 119.26 121.26 3igv h ALA 509 Ca 0.10 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.99 3igv h ALA 509 Cb 0.58 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 18.14 3igv h ALA 509 CO -0.40 0.06 0.56 0.00 0.00 0.00 0.00 179.25 179.47 3igv h ARG 510 N 0.67 1.15 -0.28 0.00 3.08 -0.90 -1.06 114.38 117.04 3igv h ARG 510 Ca 0.20 -0.08 -0.19 0.00 0.07 0.00 0.00 59.98 59.99 3igv h ARG 510 Cb -0.03 -0.25 0.00 0.00 0.08 0.00 0.00 29.97 29.77 3igv h ARG 510 CO -0.07 0.77 -0.55 -0.07 -1.07 0.00 0.00 179.97 178.98 3igv h LEU 511 N 1.18 0.95 -0.86 3.04 3.38 -0.18 -3.07 115.31 119.75 3igv h LEU 511 Ca 0.32 -0.51 0.02 0.00 0.09 0.00 0.00 57.88 57.80 3igv h LEU 511 Cb -0.11 -0.27 -0.05 0.00 0.09 0.00 0.00 40.66 40.32 3igv h LEU 511 CO -0.07 1.30 0.56 -0.07 0.09 0.00 0.00 178.44 180.26 3igv h LEU 512 N 0.65 0.94 -2.24 1.67 3.38 -0.39 -2.49 115.31 116.82 3igv h LEU 512 Ca 0.01 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 3igv h LEU 512 Cb 1.16 -0.22 -0.00 0.00 0.09 0.00 0.00 40.66 41.69 3igv h LEU 512 CO 0.12 0.66 -0.05 0.28 0.09 0.00 0.00 178.44 179.54 3igv h SER 513 N 1.10 0.00 0.99 -0.43 0.02 -1.12 -2.74 113.55 111.38 3igv h SER 513 Ca 0.33 0.00 -0.11 0.00 -0.84 0.00 0.00 61.79 61.17 3igv h SER 513 Cb -0.04 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 62.48 3igv h SER 513 CO -0.10 0.05 -0.54 1.56 -1.14 0.00 0.00 176.83 176.67 3igv h GLN 514 N 0.00 0.00 0.00 3.45 1.08 -1.36 -3.50 115.11 114.78 3igv h GLN 514 Ca -0.00 0.00 0.03 0.00 -1.45 0.00 0.00 58.65 57.23 3igv h GLN 514 Cb 0.15 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.57 3igv h GLN 514 CO 0.01 0.54 -0.04 0.41 -0.95 0.00 0.00 178.83 178.80 3igv n GLY 515 N 0.65 -1.49 7.00 3.46 0.00 -1.03 -4.87 105.19 108.91 3igv n GLY 515 Ca 0.00 -1.19 0.00 0.00 0.00 0.00 0.00 46.02 44.83 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 -0.36 2.10 0.26 -0.02 0.00 -1.26 -2.49 105.19 103.41 3igv n GLY 516 Ca 0.00 -0.38 0.04 0.00 0.00 0.00 0.00 46.02 45.68 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 0.21 -0.51 1.61 3.08 -1.95 -2.83 114.38 113.99 3igv h ARG 517 Ca 0.00 -0.03 -0.08 0.00 0.07 0.00 0.00 59.98 59.94 3igv h ARG 517 Cb 0.00 -0.04 -0.02 0.00 0.08 0.00 0.00 29.97 29.99 3igv h ARG 517 CO 0.00 0.26 -0.01 0.00 -1.07 0.00 0.00 179.97 179.16 3igv h ALA 518 N 1.76 1.04 -0.85 0.04 0.00 -1.80 -2.61 119.26 116.83 3igv h ALA 518 Ca 0.05 -0.28 -0.01 0.00 0.00 0.00 0.00 54.91 54.67 3igv h ALA 518 Cb 0.20 -0.20 -0.04 0.00 0.00 0.00 0.00 17.79 17.75 3igv h ALA 518 CO 0.01 0.60 0.48 0.00 0.00 0.00 0.00 179.25 180.34 3igv h ALA 519 N 1.20 1.24 -0.60 0.00 0.00 -1.23 -2.39 119.26 117.49 3igv h ALA 519 Ca 0.15 -0.12 0.03 0.00 0.00 0.00 0.00 54.91 54.97 3igv h ALA 519 Cb 0.48 -0.34 -0.04 0.00 0.00 0.00 0.00 17.79 17.89 3igv h ALA 519 CO 0.02 0.62 0.36 1.15 0.00 0.00 0.00 179.25 181.41 3igv h THR 520 N 1.19 1.07 -1.00 0.00 2.02 -1.47 0.13 112.91 114.86 3igv h THR 520 Ca 0.30 -0.25 0.04 0.00 0.77 0.00 0.00 66.41 67.27 3igv h THR 520 Cb 0.00 0.29 -0.06 0.00 -1.74 0.00 0.00 68.15 66.64 3igv h THR 520 CO -0.05 0.13 0.65 0.00 0.37 0.00 0.00 175.52 176.62 3igv h GLY 522 N 1.26 0.67 0.94 0.00 0.00 -0.86 -1.43 103.07 103.65 3igv h GLY 522 Ca 0.39 -0.57 -0.05 0.00 0.00 0.00 0.00 47.33 47.10 3igv h GLY 522 CO -0.12 0.52 0.05 1.70 0.00 0.00 0.00 176.54 178.69 3igv h LYS 523 N 0.38 0.67 0.00 4.80 3.64 -0.40 -3.12 116.57 122.54 3igv h LYS 523 Ca 0.07 -0.19 -0.15 0.00 -1.27 0.00 0.00 60.65 59.11 3igv h LYS 523 Cb 0.61 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 32.34 3igv h LYS 523 CO 0.04 0.73 -1.03 0.66 -2.27 0.00 0.00 179.45 177.58 3igv n TYR 524 N -4.50 0.93 0.19 1.91 4.01 0.07 -3.74 117.16 116.03 3igv n TYR 524 Ca -0.01 0.40 0.05 0.00 -0.16 0.00 0.00 57.90 58.18 3igv n TYR 524 Cb 0.25 -0.97 0.39 0.00 -0.31 0.00 0.00 39.34 38.71 3igv n TYR 524 CO 0.00 0.00 0.00 -0.07 -0.46 0.00 0.00 176.86 176.33 3igv h LEU 525 N -1.00 0.00 -2.99 7.72 3.38 -1.44 -3.28 115.31 117.70 3igv h LEU 525 Ca -0.23 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.74 3igv h LEU 525 Cb 1.02 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.76 3igv h LEU 525 CO -0.14 0.36 -0.38 0.49 0.09 0.00 0.00 178.44 178.85 3igv n PHE 526 N -3.84 0.00 0.24 1.13 3.72 -1.18 -4.69 117.46 112.85 3igv n PHE 526 Ca -0.01 -1.34 0.12 0.00 -0.05 0.00 0.00 57.45 56.17 3igv n PHE 526 Cb 0.43 -0.22 0.57 0.00 -0.94 0.00 0.00 39.48 39.31 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 0.74 0.00 0.28 4.37 -1.24 -1.65 -2.47 115.58 115.61 3igv h ASN 527 Ca -0.00 0.00 -0.03 0.00 0.71 0.00 0.00 56.30 56.97 3igv h ASN 527 Cb 1.02 0.00 -0.00 0.00 0.73 0.00 0.00 38.32 40.07 3igv h ASN 527 CO 0.00 0.16 -0.16 4.11 -1.29 0.00 0.00 177.43 180.25 3igv h TRP 528 N 0.00 0.00 0.00 0.67 5.08 -1.84 -3.25 115.95 116.61 3igv h TRP 528 Ca -0.00 0.00 -0.08 0.00 1.08 0.00 0.00 58.89 59.89 3igv h TRP 528 Cb 0.61 0.00 -0.01 0.00 -3.00 0.00 0.00 29.16 26.76 3igv h TRP 528 CO 0.00 0.16 -0.38 0.00 -1.28 0.00 0.00 178.44 176.94 3igv h ALA 529 N 1.84 1.31 -2.33 0.11 0.00 -1.81 -3.44 119.26 114.94 3igv h ALA 529 Ca -0.00 -0.35 -0.49 0.00 0.00 0.00 0.00 54.91 54.07 3igv h ALA 529 Cb 0.35 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.08 3igv h ALA 529 CO 0.02 0.47 -0.17 0.14 0.00 0.00 0.00 179.25 179.71 3igv s VAL 530 N -4.09 5.08 -0.07 0.00 -7.23 -1.23 -4.79 120.40 108.08 3igv s VAL 530 Ca -0.02 -0.26 -0.10 0.00 -1.81 0.00 0.00 61.98 59.79 3igv s VAL 530 Cb 0.14 -3.81 -0.29 0.00 0.56 0.00 0.00 36.38 32.97 3igv s VAL 530 CO 0.72 -0.47 0.56 0.11 -0.31 0.00 0.00 175.10 175.71 3igv h LYS 531 N 1.11 0.35 -4.33 4.82 1.57 -1.89 -3.43 116.57 114.78 3igv h LYS 531 Ca -0.49 -0.61 -0.74 0.00 -1.87 0.00 0.00 60.65 56.95 3igv h LYS 531 Cb 1.21 0.23 -0.22 0.00 0.08 0.00 0.00 32.23 33.52 3igv h LYS 531 CO 0.63 1.29 -0.30 -0.08 -0.57 0.00 0.00 179.45 180.42 3igv s THR 532 N -2.57 5.22 0.94 -0.16 -1.32 -1.26 -5.07 115.64 111.41 3igv s THR 532 Ca -0.18 -1.05 -0.11 0.00 -1.21 0.00 0.00 61.69 59.14 3igv s THR 532 Cb 0.06 -4.15 0.16 0.00 -1.51 0.00 0.00 72.50 67.06 3igv s THR 532 CO 0.83 -0.61 1.12 -0.54 -2.21 0.00 0.00 174.62 173.21 3igv s LYS 533 N 1.69 0.86 0.11 7.08 -0.14 -1.26 -5.07 119.74 123.01 3igv s LYS 533 Ca 0.05 1.36 0.06 0.00 -1.36 0.00 0.00 55.97 56.07 3igv s LYS 533 Cb -0.24 -1.72 -0.04 0.00 -1.68 0.00 0.00 37.83 34.14 3igv s LYS 533 CO 0.07 -2.67 -0.00 -0.51 -0.76 0.00 0.00 175.35 171.47 3igv s LEU 534 N -6.61 3.41 0.08 3.17 1.02 -1.26 -5.12 118.68 113.38 3igv s LEU 534 Ca 0.66 -0.24 -0.30 0.00 0.02 0.00 0.00 54.13 54.27 3igv s LEU 534 Cb -0.22 -2.13 -0.06 0.00 0.02 0.00 0.00 46.19 43.80 3igv s LEU 534 CO 0.59 0.15 1.13 -0.75 0.02 0.00 0.00 176.35 177.49 3igv s LYS 535 N -2.47 4.50 -0.41 1.70 2.47 -1.26 -5.01 119.74 119.26 3igv s LYS 535 Ca 0.26 1.68 -0.09 0.00 -1.56 0.00 0.00 55.97 56.27 3igv s LYS 535 Cb -0.11 -3.35 0.08 0.00 -1.46 0.00 0.00 37.83 32.99 3igv s LYS 535 CO 0.18 -0.12 0.24 -0.51 0.16 0.00 0.00 175.35 175.30 3igv s LEU 536 N 0.65 5.08 0.27 5.43 1.43 -1.26 -5.08 118.68 125.20 3igv s LEU 536 Ca 0.55 -1.50 0.07 0.00 -1.03 0.00 0.00 54.13 52.21 3igv s LEU 536 Cb -0.28 -1.97 -0.03 0.00 0.03 0.00 0.00 46.19 43.94 3igv s LEU 536 CO 0.30 -0.52 0.24 0.42 0.23 0.00 0.00 176.35 177.02 3igv s THR 537 N 1.40 4.34 0.33 5.49 -4.23 -1.26 -5.08 115.64 116.64 3igv s THR 537 Ca 0.03 -1.35 -0.27 0.00 -1.18 0.00 0.00 61.69 58.91 3igv s THR 537 Cb -0.23 -3.40 -0.13 0.00 1.34 0.00 0.00 72.50 70.08 3igv s THR 537 CO 0.02 -0.31 1.08 -2.65 -0.54 0.00 0.00 174.62 172.22 3igv n PRO 538 N -1.25 1.56 -2.64 3.99 -0.02 -1.26 -4.92 135.00 130.46 3igv n PRO 538 Ca -0.07 0.55 -0.42 0.00 -2.02 0.00 0.00 63.50 61.54 3igv n PRO 538 Cb 0.58 -2.01 -0.03 0.00 -0.02 0.00 0.00 33.50 32.03 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 -1.11 4.68 0.50 4.25 1.01 -1.26 -4.96 121.20 124.31 3igv s ILE 539 Ca 0.58 1.92 0.17 0.00 0.00 0.00 0.00 60.65 63.33 3igv s ILE 539 Cb -0.64 -4.23 0.31 0.00 0.01 0.00 0.00 42.46 37.91 3igv s ILE 539 CO 0.60 0.13 2.08 -0.65 0.00 0.00 0.00 174.94 177.10 3igv h PRO 540 N 6.85 0.10 -0.60 2.79 0.11 -2.04 -2.93 132.00 136.28 3igv h PRO 540 Ca -0.40 -0.01 -0.14 0.00 0.11 0.00 0.00 66.00 65.57 3igv h PRO 540 Cb 1.21 -0.02 -0.08 0.00 0.11 0.00 0.00 31.00 32.21 3igv h PRO 540 CO 0.78 0.07 0.15 0.00 -0.21 0.00 0.00 178.00 178.79 3igv n ALA 541 N -2.56 4.18 0.11 -0.75 0.00 -1.26 -4.66 120.51 115.57 3igv n ALA 541 Ca 0.03 -2.33 -0.11 0.00 0.00 0.00 0.00 53.44 51.03 3igv n ALA 541 Cb 0.27 -1.10 -0.07 0.00 0.00 0.00 0.00 19.45 18.55 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 2.65 -0.34 -0.65 0.00 0.00 -1.87 -3.33 119.26 115.71 3igv h ALA 542 Ca 0.17 -0.20 -0.49 0.00 0.00 0.00 0.00 54.91 54.39 3igv h ALA 542 Cb 2.08 0.13 -0.19 0.00 0.00 0.00 0.00 17.79 19.81 3igv h ALA 542 CO 0.59 -0.41 0.57 -1.13 0.00 0.00 0.00 179.25 178.86 3igv n SER 543 N -5.02 6.83 0.00 0.00 3.41 -1.26 -3.53 113.62 114.05 3igv n SER 543 Ca -0.08 -3.33 0.00 0.00 -0.26 0.00 0.00 58.87 55.20 3igv n SER 543 Cb 0.26 -1.10 0.00 0.00 -0.26 0.00 0.00 64.21 63.11 3igv n SER 543 CO 0.00 0.00 0.00 1.67 -0.16 0.00 0.00 175.04 176.55 3igv n GLN 544 N 0.17 6.08 -3.19 4.33 7.27 -1.25 -5.03 117.38 125.76 3igv n GLN 544 Ca 0.45 -0.01 -0.39 0.00 0.07 0.00 0.00 57.00 57.12 3igv n GLN 544 Cb 0.55 -0.45 -0.06 0.00 2.41 0.00 0.00 30.24 32.69 3igv n GLN 544 CO 0.00 0.00 0.00 -0.51 0.07 0.00 0.00 177.06 176.62 3igv s LEU 545 N -1.74 4.46 -1.00 1.69 1.43 -1.23 -5.02 118.68 117.27 3igv s LEU 545 Ca 0.00 1.25 -0.21 0.00 -1.03 0.00 0.00 54.13 54.14 3igv s LEU 545 Cb 0.00 -2.97 0.09 0.00 0.03 0.00 0.00 46.19 43.34 3igv s LEU 545 CO 0.00 0.14 1.33 -0.62 0.23 0.00 0.00 176.35 177.44 3igv s ASP 546 N -0.48 6.59 -0.07 2.29 -1.08 -1.26 -4.82 116.67 117.85 3igv s ASP 546 Ca 0.32 -1.80 0.12 0.00 -0.52 0.00 0.00 52.55 50.66 3igv s ASP 546 Cb -0.19 -2.49 0.46 0.00 -1.46 0.00 0.00 42.92 39.23 3igv s ASP 546 CO 0.19 -1.28 1.31 0.18 0.52 0.00 0.00 175.17 176.09 3igv n LEU 547 N 7.78 3.16 -4.75 -1.34 4.32 -1.26 -4.90 117.00 120.01 3igv n LEU 547 Ca 0.30 -1.59 -0.41 0.00 -0.02 0.00 0.00 56.01 54.30 3igv n LEU 547 Cb 0.50 -0.45 -0.04 0.00 -1.62 0.00 0.00 43.42 41.80 3igv n LEU 547 CO 0.60 0.56 0.77 -0.94 -1.22 0.00 0.00 177.39 177.16 3igv s SER 548 N -0.76 7.32 0.00 -1.43 1.04 -1.26 -3.10 113.70 115.51 3igv s SER 548 Ca 0.32 2.14 0.00 0.00 0.48 0.00 0.00 55.95 58.89 3igv s SER 548 Cb 0.21 -2.61 0.00 0.00 0.10 0.00 0.00 66.02 63.71 3igv s SER 548 CO 0.16 -0.14 0.00 0.61 0.98 0.00 0.00 173.24 174.85 3igv n GLY 549 N 1.64 3.38 0.21 7.32 0.00 -1.26 -4.93 105.19 111.55 3igv n GLY 549 Ca 0.01 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.95 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 0.65 -2.13 1.61 4.06 -1.90 -3.35 115.95 114.89 3igv h TRP 550 Ca 0.00 -0.01 -0.54 0.00 2.06 0.00 0.00 58.89 60.40 3igv h TRP 550 Cb 0.00 -0.21 -0.41 0.00 -1.00 0.00 0.00 29.16 27.54 3igv h TRP 550 CO 0.00 0.48 -0.92 1.19 -3.56 0.00 0.00 178.44 175.63 3igv n PHE 551 N -4.68 1.96 -0.04 0.49 3.72 -1.26 -4.83 117.46 112.83 3igv n PHE 551 Ca 0.02 -3.90 -0.05 0.00 -0.05 0.00 0.00 57.45 53.47 3igv n PHE 551 Cb 0.08 -0.45 -0.02 0.00 -0.94 0.00 0.00 39.48 38.15 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 0.20 1.22 -4.24 -4.37 0.31 -1.21 -4.16 118.33 106.09 3igv n VAL 552 Ca 0.27 0.24 -0.13 0.00 -0.01 0.00 0.00 64.34 64.71 3igv n VAL 552 Cb 0.52 -2.01 -0.10 0.00 -0.91 0.00 0.00 33.84 31.34 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 -2.65 1.33 0.24 3.52 0.00 -1.25 -3.75 121.76 119.20 3igv s ALA 553 Ca -0.17 -1.72 -0.08 0.00 0.00 0.00 0.00 51.96 49.99 3igv s ALA 553 Cb 0.02 1.16 -0.06 0.00 0.00 0.00 0.00 23.12 24.23 3igv s ALA 553 CO 0.26 -0.51 0.54 0.20 0.00 0.00 0.00 175.76 176.24 3igv s GLY 554 N -3.20 2.16 0.00 0.00 0.00 -1.26 -4.91 107.32 100.10 3igv s GLY 554 Ca 0.36 -0.38 0.17 0.00 0.00 0.00 0.00 44.72 44.87 3igv s GLY 554 CO 0.11 -0.25 1.10 -1.72 0.00 0.00 0.00 173.10 172.33 3igv n TYR 555 N -0.36 0.00 -1.69 1.90 4.01 0.39 -4.58 117.16 116.83 3igv n TYR 555 Ca -0.00 -0.45 -0.44 0.00 -0.16 0.00 0.00 57.90 56.84 3igv n TYR 555 Cb 0.53 0.04 -0.04 0.00 -0.31 0.00 0.00 39.34 39.56 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 0.32 3.68 0.00 7.72 2.88 -1.25 -0.95 113.62 126.01 3igv n SER 556 Ca -0.03 1.03 0.00 0.00 -1.33 0.00 0.00 58.87 58.54 3igv n SER 556 Cb 0.98 -1.50 0.00 0.00 -0.75 0.00 0.00 64.21 62.95 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 3.93 1.20 0.03 0.46 0.00 -1.26 -4.25 105.19 105.30 3igv n GLY 557 Ca 0.18 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.25 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 -2.00 -0.94 3.64 -0.02 0.00 -0.13 -3.25 105.19 102.49 3igv n GLY 558 Ca 0.00 -0.08 -0.26 0.00 0.00 0.00 0.00 46.02 45.67 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 -0.63 -4.28 -4.32 1.61 2.03 -1.26 -4.61 116.55 105.09 3igv n ASP 559 Ca 0.08 -0.93 -0.32 0.00 0.52 0.00 0.00 54.79 54.15 3igv n ASP 559 Cb 0.05 -3.79 -0.15 0.00 -0.72 0.00 0.00 41.12 36.51 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 -3.54 2.44 -0.05 5.18 -1.09 -1.26 -4.42 121.20 118.47 3igv s ILE 560 Ca 0.34 -0.92 0.01 0.00 -2.23 0.00 0.00 60.65 57.84 3igv s ILE 560 Cb -0.10 -1.93 0.02 0.00 -1.58 0.00 0.00 42.46 38.87 3igv s ILE 560 CO 0.83 0.56 -0.04 -0.47 -1.23 0.00 0.00 174.94 174.60 3igv s TYR 561 N -0.14 0.70 -2.39 3.97 5.04 0.14 -0.06 117.35 124.60 3igv s TYR 561 Ca -0.03 -0.19 0.19 0.00 -2.44 0.00 0.00 57.07 54.60 3igv s TYR 561 Cb -0.14 -0.66 0.15 0.00 0.35 0.00 0.00 41.96 41.66 3igv s TYR 561 CO 0.04 -0.20 1.11 0.72 -1.34 0.00 0.00 175.55 175.87