#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ho8 s ILE 37 N 0.00 2.40 0.18 5.09 1.01 -1.26 -4.96 121.20 123.66 3ho8 s ILE 37 Ca 0.00 -3.12 -0.11 0.00 0.00 0.00 0.00 60.65 57.42 3ho8 s ILE 37 Cb 0.00 -2.68 0.09 0.00 0.01 0.00 0.00 42.46 39.88 3ho8 s ILE 37 CO 0.00 -0.79 1.72 0.11 0.00 0.00 0.00 174.94 175.98 3ho8 h LYS 38 N 6.65 0.97 -2.87 2.79 1.79 -1.96 -3.43 116.57 120.51 3ho8 h LYS 38 Ca -0.07 -0.19 -0.18 0.00 -2.18 0.00 0.00 60.65 58.03 3ho8 h LYS 38 Cb 0.91 -0.15 -0.30 0.00 -1.58 0.00 0.00 32.23 31.11 3ho8 h LYS 38 CO 0.65 0.83 -0.46 0.21 -1.08 0.00 0.00 179.45 179.60 3ho8 s LYS 39 N -5.47 0.22 -0.13 3.15 2.20 -1.26 -2.54 119.74 115.90 3ho8 s LYS 39 Ca -0.13 0.69 0.00 0.00 -0.36 0.00 0.00 55.97 56.17 3ho8 s LYS 39 Cb 0.13 -0.04 -0.01 0.00 -1.51 0.00 0.00 37.83 36.40 3ho8 s LYS 39 CO 0.81 -0.21 -0.14 -1.17 -0.36 0.00 0.00 175.35 174.28 3ho8 s LEU 40 N 1.80 2.62 -0.17 5.43 0.20 -0.12 -0.15 118.68 128.29 3ho8 s LEU 40 Ca -0.05 -0.37 -0.04 0.00 0.69 0.00 0.00 54.13 54.36 3ho8 s LEU 40 Cb -0.11 -1.59 -0.03 0.00 -0.43 0.00 0.00 46.19 44.04 3ho8 s LEU 40 CO -0.10 0.15 -0.03 -0.22 -0.29 0.00 0.00 176.35 175.86 3ho8 s LEU 41 N 0.43 3.22 -0.42 -0.68 0.20 -0.61 -0.50 118.68 120.31 3ho8 s LEU 41 Ca -0.11 -0.16 -0.19 0.00 0.69 0.00 0.00 54.13 54.36 3ho8 s LEU 41 Cb -0.16 -1.78 0.02 0.00 -0.43 0.00 0.00 46.19 43.84 3ho8 s LEU 41 CO 0.05 0.14 0.54 -0.69 -0.29 0.00 0.00 176.35 176.10 3ho8 s VAL 42 N 0.54 4.96 -0.65 1.68 1.01 -0.56 -1.59 120.40 125.78 3ho8 s VAL 42 Ca -0.03 -0.06 -0.06 0.00 0.00 0.00 0.00 61.98 61.83 3ho8 s VAL 42 Cb -0.14 -4.11 -0.04 0.00 0.00 0.00 0.00 36.38 32.09 3ho8 s VAL 42 CO 0.03 -0.48 2.97 0.00 0.00 0.00 0.00 175.10 177.62 3ho8 n ALA 43 N 5.92 6.66 -3.00 5.51 0.00 -0.74 -3.85 120.51 131.00 3ho8 n ALA 43 Ca -0.04 -2.96 0.00 0.00 0.00 0.00 0.00 53.44 50.43 3ho8 n ALA 43 Cb 0.48 -2.48 0.00 0.00 0.00 0.00 0.00 19.45 17.44 3ho8 n ALA 43 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 3ho8 n ASN 44 N 1.87 0.00 -1.48 0.00 4.05 -1.26 -4.76 115.26 113.67 3ho8 n ASN 44 Ca 0.54 -0.21 -0.03 0.00 0.45 0.00 0.00 54.58 55.32 3ho8 n ASN 44 Cb 0.56 0.00 -0.01 0.00 1.23 0.00 0.00 39.78 41.56 3ho8 n ASN 44 CO 0.00 0.00 0.00 -2.11 -3.05 0.00 0.00 177.26 172.10 3ho8 n ARG 45 N 0.00 0.19 0.00 1.20 1.85 -1.26 -4.71 116.66 113.93 3ho8 n ARG 45 Ca 0.00 -0.66 0.00 0.00 -1.00 0.00 0.00 57.85 56.19 3ho8 n ARG 45 Cb 0.00 0.67 0.00 0.00 -1.05 0.00 0.00 32.46 32.08 3ho8 n ARG 45 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 3ho8 n GLY 46 N -0.14 1.47 0.36 2.89 0.00 -1.26 -2.43 105.19 106.09 3ho8 n GLY 46 Ca -0.00 -0.31 -0.01 0.00 0.00 0.00 0.00 46.02 45.70 3ho8 n GLY 46 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 3ho8 h GLU 47 N 0.00 1.14 -0.27 1.61 -0.00 -1.82 -2.94 114.58 112.29 3ho8 h GLU 47 Ca 0.00 -0.08 -0.07 0.00 -0.00 0.00 0.00 59.36 59.21 3ho8 h GLU 47 Cb 0.00 -0.25 -0.01 0.00 -0.00 0.00 0.00 28.75 28.49 3ho8 h GLU 47 CO 0.00 0.77 -0.10 0.97 -0.00 0.00 0.00 179.01 180.65 3ho8 h ILE 48 N 1.17 1.29 -0.65 -1.06 6.09 -1.86 -1.30 117.51 121.19 3ho8 h ILE 48 Ca 0.31 -1.16 0.14 0.00 -1.37 0.00 0.00 64.86 62.78 3ho8 h ILE 48 Cb -0.10 1.47 -0.11 0.00 0.47 0.00 0.00 36.82 38.55 3ho8 h ILE 48 CO -0.06 0.37 -0.03 0.00 -3.07 0.00 0.00 178.15 175.36 3ho8 h ALA 49 N 0.76 0.61 -0.20 0.18 0.00 -1.30 0.97 119.26 120.27 3ho8 h ALA 49 Ca 0.07 0.21 -0.04 0.00 0.00 0.00 0.00 54.91 55.15 3ho8 h ALA 49 Cb 0.60 0.37 -0.01 0.00 0.00 0.00 0.00 17.79 18.75 3ho8 h ALA 49 CO 0.03 -0.40 -0.02 0.82 0.00 0.00 0.00 179.25 179.68 3ho8 h ILE 50 N 0.09 1.27 -0.38 0.00 2.04 -1.43 -0.50 117.51 118.60 3ho8 h ILE 50 Ca 0.34 -0.94 0.08 0.00 1.00 0.00 0.00 64.86 65.34 3ho8 h ILE 50 Cb 0.55 1.49 -0.08 0.00 -0.74 0.00 0.00 36.82 38.05 3ho8 h ILE 50 CO -0.58 0.29 -0.13 -0.09 0.00 0.00 0.00 178.15 177.64 3ho8 h ARG 51 N 0.11 -0.05 0.11 2.37 9.65 -0.25 -0.48 114.38 125.83 3ho8 h ARG 51 Ca 0.05 0.00 0.01 0.00 -1.10 0.00 0.00 59.98 58.95 3ho8 h ARG 51 Cb 0.44 0.01 -0.02 0.00 -1.39 0.00 0.00 29.97 29.01 3ho8 h ARG 51 CO 0.01 -0.03 -0.18 0.82 2.80 0.00 0.00 179.97 183.39 3ho8 h ILE 52 N -0.05 0.58 -0.32 1.20 2.04 -0.62 -2.35 117.51 117.99 3ho8 h ILE 52 Ca 0.19 0.00 0.07 0.00 1.00 0.00 0.00 64.86 66.12 3ho8 h ILE 52 Cb 0.34 0.58 -0.07 0.00 -0.74 0.00 0.00 36.82 36.93 3ho8 h ILE 52 CO -0.43 0.00 -0.15 -0.26 0.00 0.00 0.00 178.15 177.31 3ho8 h PHE 53 N -0.35 -0.38 -0.14 1.37 0.05 -0.37 0.64 116.94 117.75 3ho8 h PHE 53 Ca 0.02 0.04 0.04 0.00 3.82 0.00 0.00 57.97 61.89 3ho8 h PHE 53 Cb 0.37 0.22 -0.05 0.00 2.00 0.00 0.00 35.95 38.49 3ho8 h PHE 53 CO -0.18 -0.23 -0.14 0.00 -0.18 0.00 0.00 178.31 177.58 3ho8 h ARG 54 N -0.10 -0.16 0.06 1.51 3.08 -1.07 0.38 114.38 118.08 3ho8 h ARG 54 Ca 0.17 0.01 0.02 0.00 0.07 0.00 0.00 59.98 60.25 3ho8 h ARG 54 Cb 0.36 0.04 -0.05 0.00 0.08 0.00 0.00 29.97 30.39 3ho8 h ARG 54 CO -0.39 -0.10 -0.50 0.00 -1.07 0.00 0.00 179.97 177.91 3ho8 h ALA 55 N 0.92 -0.89 -0.85 0.04 0.00 -0.95 -2.31 119.26 115.23 3ho8 h ALA 55 Ca 0.10 -0.09 0.09 0.00 0.00 0.00 0.00 54.91 55.01 3ho8 h ALA 55 Cb 0.30 0.87 -0.07 0.00 0.00 0.00 0.00 17.79 18.89 3ho8 h ALA 55 CO -0.24 -1.07 0.50 0.00 0.00 0.00 0.00 179.25 178.43 3ho8 h ALA 56 N -0.35 1.20 -0.23 0.00 0.00 -0.36 -1.10 119.26 118.42 3ho8 h ALA 56 Ca 0.01 0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.92 3ho8 h ALA 56 Cb 0.72 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.34 3ho8 h ALA 56 CO -0.31 0.15 0.04 0.00 0.00 0.00 0.00 179.25 179.13 3ho8 h ALA 57 N 1.45 1.64 0.00 0.00 0.00 -0.12 0.20 119.26 122.43 3ho8 h ALA 57 Ca 0.40 -0.11 -0.04 0.00 0.00 0.00 0.00 54.91 55.16 3ho8 h ALA 57 Cb 0.33 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 3ho8 h ALA 57 CO -0.23 0.27 -0.21 0.93 0.00 0.00 0.00 179.25 180.01 3ho8 h GLU 58 N 0.33 0.00 -0.18 0.00 5.08 -0.62 -0.48 114.58 118.70 3ho8 h GLU 58 Ca 0.08 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.44 3ho8 h GLU 58 Cb 0.16 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.41 3ho8 h GLU 58 CO -0.00 0.21 0.00 1.28 -1.00 0.00 0.00 179.01 179.50 3ho8 n LEU 59 N -4.26 1.21 -4.03 1.33 4.77 0.02 -4.91 117.00 111.13 3ho8 n LEU 59 Ca -0.02 -0.56 -0.27 0.00 -0.03 0.00 0.00 56.01 55.12 3ho8 n LEU 59 Cb 0.27 -0.12 -0.04 0.00 -2.33 0.00 0.00 43.42 41.20 3ho8 n LEU 59 CO 0.36 0.28 -0.29 -0.67 -1.33 0.00 0.00 177.39 175.75 3ho8 n ASP 60 N 0.09 -0.08 -4.92 -1.43 -0.08 -0.19 -4.98 116.55 104.97 3ho8 n ASP 60 Ca 0.11 -1.07 -0.28 0.00 -1.51 0.00 0.00 54.79 52.04 3ho8 n ASP 60 Cb 0.22 -2.71 -0.04 0.00 2.34 0.00 0.00 41.12 40.93 3ho8 n ASP 60 CO 0.00 0.00 0.00 -0.63 0.12 0.00 0.00 177.20 176.69 3ho8 s ILE 61 N -4.05 5.26 0.07 5.18 1.01 -0.95 -5.03 121.20 122.69 3ho8 s ILE 61 Ca 0.01 -0.61 -0.25 0.00 0.00 0.00 0.00 60.65 59.79 3ho8 s ILE 61 Cb -0.00 -3.65 -0.06 0.00 0.01 0.00 0.00 42.46 38.76 3ho8 s ILE 61 CO 0.91 -0.00 0.78 -0.55 0.00 0.00 0.00 174.94 176.08 3ho8 s SER 62 N -2.94 7.27 -0.10 3.58 0.15 -1.05 -4.44 113.70 116.16 3ho8 s SER 62 Ca 0.34 1.51 -0.00 0.00 0.70 0.00 0.00 55.95 58.50 3ho8 s SER 62 Cb -0.12 -2.48 -0.03 0.00 -1.71 0.00 0.00 66.02 61.69 3ho8 s SER 62 CO 0.28 0.05 -0.08 0.42 1.20 0.00 0.00 173.24 175.10 3ho8 s THR 63 N -0.28 3.53 -0.07 6.45 -4.23 -1.26 -0.94 115.64 118.83 3ho8 s THR 63 Ca 0.38 -0.52 0.05 0.00 -1.18 0.00 0.00 61.69 60.43 3ho8 s THR 63 Cb -0.21 -2.47 -0.01 0.00 1.34 0.00 0.00 72.50 71.15 3ho8 s THR 63 CO 0.24 0.55 -0.25 -0.69 -0.54 0.00 0.00 174.62 173.94 3ho8 s VAL 64 N -0.22 2.05 -0.05 2.29 1.01 0.34 0.04 120.40 125.86 3ho8 s VAL 64 Ca 0.02 -1.04 0.06 0.00 0.00 0.00 0.00 61.98 61.02 3ho8 s VAL 64 Cb -0.13 -1.75 -0.01 0.00 0.00 0.00 0.00 36.38 34.49 3ho8 s VAL 64 CO 0.03 0.56 -0.24 0.00 0.00 0.00 0.00 175.10 175.45 3ho8 s ALA 65 N 0.04 2.22 0.09 5.51 0.00 0.71 -1.50 121.76 128.83 3ho8 s ALA 65 Ca -0.10 -1.05 0.04 0.00 0.00 0.00 0.00 51.96 50.85 3ho8 s ALA 65 Cb -0.15 -0.70 -0.04 0.00 0.00 0.00 0.00 23.12 22.23 3ho8 s ALA 65 CO 0.06 0.44 0.05 0.96 0.00 0.00 0.00 175.76 177.27 3ho8 s ILE 66 N -0.25 4.32 -0.02 0.00 -4.36 -1.25 -0.03 121.20 119.63 3ho8 s ILE 66 Ca -0.01 -0.88 -0.12 0.00 -0.26 0.00 0.00 60.65 59.38 3ho8 s ILE 66 Cb -0.13 -3.09 0.02 0.00 1.25 0.00 0.00 42.46 40.51 3ho8 s ILE 66 CO 0.03 0.10 0.25 -0.72 0.24 0.00 0.00 174.94 174.84 3ho8 s TYR 67 N -1.39 -0.11 0.44 1.37 1.13 -0.93 -4.85 117.35 113.01 3ho8 s TYR 67 Ca 0.28 0.17 -0.08 0.00 -1.41 0.00 0.00 57.07 56.02 3ho8 s TYR 67 Cb -0.12 0.05 -0.05 0.00 -1.10 0.00 0.00 41.96 40.74 3ho8 s TYR 67 CO 0.21 -0.33 0.78 -1.54 -2.51 0.00 0.00 175.55 172.16 3ho8 s SER 68 N -1.22 6.40 0.29 -0.18 1.04 -1.26 -1.97 113.70 116.80 3ho8 s SER 68 Ca -0.13 1.05 0.01 0.00 0.48 0.00 0.00 55.95 57.37 3ho8 s SER 68 Cb -0.06 -2.30 0.72 0.00 0.10 0.00 0.00 66.02 64.48 3ho8 s SER 68 CO 0.03 -0.49 1.61 0.78 0.98 0.00 0.00 173.24 176.15 3ho8 h ASN 69 N 0.77 -0.21 0.23 7.02 -0.26 -1.87 -0.05 115.58 121.21 3ho8 h ASN 69 Ca -0.47 0.23 -0.09 0.00 -0.56 0.00 0.00 56.30 55.41 3ho8 h ASN 69 Cb 1.19 0.36 -0.01 0.00 -1.06 0.00 0.00 38.32 38.80 3ho8 h ASN 69 CO 0.63 -0.25 -0.34 -0.33 -1.06 0.00 0.00 177.43 176.08 3ho8 h GLU 70 N 0.11 0.17 -0.02 0.81 4.39 -1.93 -1.87 114.58 116.24 3ho8 h GLU 70 Ca 0.56 -0.07 0.00 0.00 0.34 0.00 0.00 59.36 60.20 3ho8 h GLU 70 Cb 1.16 -0.01 0.00 0.00 -0.10 0.00 0.00 28.75 29.80 3ho8 h GLU 70 CO -0.76 0.50 0.00 -0.25 -1.16 0.00 0.00 179.01 177.34 3ho8 n ASP 71 N -4.10 0.36 -0.33 1.42 8.00 -0.07 -4.20 116.55 117.63 3ho8 n ASP 71 Ca -0.01 -1.25 0.31 0.00 0.71 0.00 0.00 54.79 54.55 3ho8 n ASP 71 Cb 0.41 -0.01 0.56 0.00 -0.02 0.00 0.00 41.12 42.06 3ho8 n ASP 71 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 3ho8 n LYS 72 N -0.66 -0.05 -0.36 -1.24 5.02 -0.71 0.77 118.16 120.94 3ho8 n LYS 72 Ca 0.20 1.20 0.12 0.00 -2.02 0.00 0.00 58.31 57.81 3ho8 n LYS 72 Cb 0.15 -2.22 0.32 0.00 -0.02 0.00 0.00 35.03 33.26 3ho8 n LYS 72 CO 0.00 0.00 0.00 -1.13 -0.52 0.00 0.00 177.40 175.75 3ho8 n SER 73 N -4.85 3.89 -3.98 4.39 3.41 -1.26 -5.00 113.62 110.22 3ho8 n SER 73 Ca 0.35 -2.00 -0.28 0.00 -0.26 0.00 0.00 58.87 56.68 3ho8 n SER 73 Cb 1.24 -0.48 0.23 0.00 -0.26 0.00 0.00 64.21 64.95 3ho8 n SER 73 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 3ho8 n SER 74 N 1.63 -2.78 -0.05 4.04 2.88 0.23 -4.99 113.62 114.59 3ho8 n SER 74 Ca 0.24 -0.39 -0.10 0.00 -1.33 0.00 0.00 58.87 57.29 3ho8 n SER 74 Cb 0.62 -1.04 -0.15 0.00 -0.75 0.00 0.00 64.21 62.89 3ho8 n SER 74 CO 0.00 0.00 0.00 -0.11 -1.23 0.00 0.00 175.04 173.70 3ho8 n LEU 75 N -3.85 0.73 0.22 2.46 7.94 -1.26 -4.56 117.00 118.68 3ho8 n LEU 75 Ca 0.05 0.23 0.15 0.00 -1.11 0.00 0.00 56.01 55.33 3ho8 n LEU 75 Cb 0.55 0.18 0.50 0.00 0.53 0.00 0.00 43.42 45.18 3ho8 n LEU 75 CO 0.47 0.47 0.91 1.12 -1.11 0.00 0.00 177.39 179.26 3ho8 h HIS 76 N 0.00 0.00 -0.32 1.96 2.07 -1.88 -3.16 115.15 113.82 3ho8 h HIS 76 Ca -0.40 0.00 -0.11 0.00 -2.85 0.00 0.00 60.37 57.01 3ho8 h HIS 76 Cb 2.10 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 32.06 3ho8 h HIS 76 CO 0.01 0.00 -0.25 0.07 -3.07 0.00 0.00 177.93 174.68 3ho8 h ARG 77 N 0.00 0.65 -0.91 5.12 0.11 -1.92 -2.69 114.38 114.74 3ho8 h ARG 77 Ca 0.00 -0.26 -0.45 0.00 0.10 0.00 0.00 59.98 59.36 3ho8 h ARG 77 Cb 0.62 -0.03 -0.27 0.00 1.11 0.00 0.00 29.97 31.40 3ho8 h ARG 77 CO 0.00 0.84 0.54 2.48 0.10 0.00 0.00 179.97 183.94 3ho8 n TYR 78 N -4.10 2.81 0.85 4.08 0.18 -1.19 -3.43 117.16 116.36 3ho8 n TYR 78 Ca -0.00 -1.76 0.09 0.00 1.88 0.00 0.00 57.90 58.11 3ho8 n TYR 78 Cb 0.43 -0.88 -0.02 0.00 -0.38 0.00 0.00 39.34 38.50 3ho8 n TYR 78 CO 0.00 0.00 0.00 1.63 -2.08 0.00 0.00 176.86 176.41 3ho8 n LYS 79 N -1.05 1.41 -4.24 -3.48 4.76 -1.01 -4.95 118.16 109.61 3ho8 n LYS 79 Ca 0.55 -0.80 -0.28 0.00 -2.87 0.00 0.00 58.31 54.91 3ho8 n LYS 79 Cb 1.59 -1.37 -0.09 0.00 -1.84 0.00 0.00 35.03 33.31 3ho8 n LYS 79 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 3ho8 s ALA 80 N -2.24 3.00 0.35 7.82 0.00 -1.22 -4.81 121.76 124.66 3ho8 s ALA 80 Ca 0.15 -1.33 0.05 0.00 0.00 0.00 0.00 51.96 50.83 3ho8 s ALA 80 Cb 0.15 -0.88 0.69 0.00 0.00 0.00 0.00 23.12 23.09 3ho8 s ALA 80 CO 0.52 0.57 1.95 -0.44 0.00 0.00 0.00 175.76 178.35 3ho8 h ASP 81 N 3.25 0.72 -4.25 0.00 3.32 -1.55 -3.44 116.42 114.47 3ho8 h ASP 81 Ca -0.48 0.00 -0.29 0.00 0.02 0.00 0.00 57.03 56.29 3ho8 h ASP 81 Cb 1.18 -0.15 -0.15 0.00 0.22 0.00 0.00 39.33 40.44 3ho8 h ASP 81 CO 0.54 0.47 -0.70 -1.61 -1.72 0.00 0.00 179.24 176.21 3ho8 s GLU 82 N -5.73 0.98 -0.22 3.56 2.02 0.11 -4.99 118.70 114.44 3ho8 s GLU 82 Ca -0.10 -1.42 -0.11 0.00 0.02 0.00 0.00 54.97 53.37 3ho8 s GLU 82 Cb 0.19 -0.44 0.08 0.00 0.10 0.00 0.00 34.13 34.07 3ho8 s GLU 82 CO 0.78 0.02 0.51 0.45 0.02 0.00 0.00 175.26 177.04 3ho8 s SER 83 N -3.12 -0.64 -0.07 -0.19 0.15 -1.26 -0.21 113.70 108.37 3ho8 s SER 83 Ca 0.16 1.15 0.00 0.00 0.70 0.00 0.00 55.95 57.95 3ho8 s SER 83 Cb 0.04 1.22 0.02 0.00 -1.71 0.00 0.00 66.02 65.59 3ho8 s SER 83 CO -0.01 -0.22 -0.04 -0.31 1.20 0.00 0.00 173.24 173.86 3ho8 s TYR 84 N 1.89 0.91 0.04 3.44 1.51 0.96 -4.95 117.35 121.15 3ho8 s TYR 84 Ca -0.08 -0.31 -0.34 0.00 -1.01 0.00 0.00 57.07 55.33 3ho8 s TYR 84 Cb -0.09 -0.84 -0.13 0.00 -0.11 0.00 0.00 41.96 40.79 3ho8 s TYR 84 CO -0.15 -0.30 1.69 -0.11 -1.11 0.00 0.00 175.55 175.57 3ho8 n LEU 85 N 4.52 3.11 -0.05 -1.29 7.94 -1.26 -2.18 117.00 127.79 3ho8 n LEU 85 Ca -0.17 1.04 -0.16 0.00 -1.11 0.00 0.00 56.01 55.61 3ho8 n LEU 85 Cb 0.50 -1.38 -0.05 0.00 0.53 0.00 0.00 43.42 43.02 3ho8 n LEU 85 CO 0.18 -0.25 0.36 0.58 -1.11 0.00 0.00 177.39 177.15 3ho8 h VAL 86 N 4.37 1.27 -0.14 1.96 2.07 -1.75 -3.46 116.25 120.58 3ho8 h VAL 86 Ca -0.47 -1.84 0.27 0.00 0.82 0.00 0.00 66.70 65.48 3ho8 h VAL 86 Cb 1.27 1.79 -0.25 0.00 -1.52 0.00 0.00 31.29 32.58 3ho8 h VAL 86 CO 0.91 0.59 0.43 -0.83 0.02 0.00 0.00 177.57 178.69 3ho8 s GLY 87 N -4.03 0.13 0.59 2.17 0.00 -1.26 -4.91 107.32 100.00 3ho8 s GLY 87 Ca -0.10 3.44 0.29 0.00 0.00 0.00 0.00 44.72 48.35 3ho8 s GLY 87 CO 0.90 3.60 1.84 1.48 0.00 0.00 0.00 173.10 180.92 3ho8 h SER 88 N 7.42 0.00 1.29 1.64 4.64 -1.96 0.91 113.55 127.49 3ho8 h SER 88 Ca -0.12 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.20 3ho8 h SER 88 Cb 1.15 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.24 3ho8 h SER 88 CO -0.04 0.00 -0.36 -2.24 -0.87 0.00 0.00 176.83 173.32 3ho8 h ASP 89 N 0.00 0.00 -3.44 4.97 2.03 -2.01 -3.44 116.42 114.52 3ho8 h ASP 89 Ca 0.26 -0.08 -0.60 0.00 -0.73 0.00 0.00 57.03 55.89 3ho8 h ASP 89 Cb 1.38 0.00 -0.09 0.00 -0.83 0.00 0.00 39.33 39.79 3ho8 h ASP 89 CO -0.00 0.04 0.55 -0.76 -1.03 0.00 0.00 179.24 178.03 3ho8 s LEU 90 N -4.85 4.03 0.94 0.15 1.43 0.31 -5.05 118.68 115.64 3ho8 s LEU 90 Ca 0.07 0.66 -0.12 0.00 -1.03 0.00 0.00 54.13 53.70 3ho8 s LEU 90 Cb 0.11 -3.22 0.16 0.00 0.03 0.00 0.00 46.19 43.27 3ho8 s LEU 90 CO 0.68 -0.76 1.13 -0.83 0.23 0.00 0.00 176.35 176.79 3ho8 s GLY 91 N 1.75 1.57 0.13 -3.19 0.00 -1.26 -4.43 107.32 101.89 3ho8 s GLY 91 Ca 0.37 -0.51 -0.09 0.00 0.00 0.00 0.00 44.72 44.48 3ho8 s GLY 91 CO 0.16 0.07 0.86 -1.55 0.00 0.00 0.00 173.10 172.64 3ho8 n PRO 92 N -3.90 -0.12 -0.06 2.90 -0.04 -1.26 -0.84 135.00 131.68 3ho8 n PRO 92 Ca 0.06 0.85 -0.17 0.00 -0.04 0.00 0.00 63.50 64.21 3ho8 n PRO 92 Cb 0.59 -1.26 -0.13 0.00 -0.04 0.00 0.00 33.50 32.65 3ho8 n PRO 92 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3ho8 h ALA 93 N 0.79 0.04 -1.00 0.55 0.00 -1.92 -3.36 119.26 114.37 3ho8 h ALA 93 Ca 0.20 -0.68 0.27 0.00 0.00 0.00 0.00 54.91 54.70 3ho8 h ALA 93 Cb 0.34 0.17 -0.13 0.00 0.00 0.00 0.00 17.79 18.16 3ho8 h ALA 93 CO -0.55 0.22 0.58 1.49 0.00 0.00 0.00 179.25 180.98 3ho8 h GLU 94 N -0.88 0.47 -0.51 0.00 4.57 -1.33 -2.58 114.58 114.32 3ho8 h GLU 94 Ca -0.10 -0.03 0.09 0.00 -1.18 0.00 0.00 59.36 58.15 3ho8 h GLU 94 Cb 1.18 -0.11 -0.07 0.00 -0.16 0.00 0.00 28.75 29.59 3ho8 h GLU 94 CO -0.01 0.31 0.08 0.77 -1.18 0.00 0.00 179.01 178.98 3ho8 h SER 95 N 0.48 -0.04 -0.40 1.04 0.02 -1.57 -1.38 113.55 111.69 3ho8 h SER 95 Ca 0.67 0.10 0.00 0.00 -0.84 0.00 0.00 61.79 61.72 3ho8 h SER 95 Cb 1.38 0.15 0.00 0.00 0.14 0.00 0.00 62.40 64.06 3ho8 h SER 95 CO -0.53 0.00 0.00 -1.22 -1.14 0.00 0.00 176.83 173.95 3ho8 n TYR 96 N -5.14 0.63 0.00 3.45 4.02 -0.97 -4.13 117.16 115.01 3ho8 n TYR 96 Ca 0.06 -0.29 0.00 0.00 -0.01 0.00 0.00 57.90 57.66 3ho8 n TYR 96 Cb 0.26 -0.04 0.00 0.00 -0.02 0.00 0.00 39.34 39.54 3ho8 n TYR 96 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 176.86 177.13 3ho8 n LEU 97 N 0.67 0.00 -4.58 7.72 4.77 -0.75 -4.43 117.00 120.41 3ho8 n LEU 97 Ca 0.14 -0.14 -0.43 0.00 -0.03 0.00 0.00 56.01 55.56 3ho8 n LEU 97 Cb 0.40 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.46 3ho8 n LEU 97 CO 0.10 0.00 0.99 0.21 -1.33 0.00 0.00 177.39 177.36 3ho8 s ASN 98 N -0.98 6.48 0.11 -1.43 2.47 -0.60 -4.91 114.94 116.09 3ho8 s ASN 98 Ca 0.00 0.12 -0.32 0.00 0.42 0.00 0.00 52.86 53.09 3ho8 s ASN 98 Cb 0.00 -2.53 -0.11 0.00 -1.45 0.00 0.00 41.25 37.16 3ho8 s ASN 98 CO 0.00 -1.35 1.58 0.40 -3.72 0.00 0.00 177.10 174.01 3ho8 h ILE 99 N 6.15 0.11 -0.40 -5.21 2.04 -1.94 -1.79 117.51 116.47 3ho8 h ILE 99 Ca -0.25 0.00 -0.11 0.00 1.00 0.00 0.00 64.86 65.51 3ho8 h ILE 99 Cb 1.06 0.11 -0.02 0.00 -0.74 0.00 0.00 36.82 37.23 3ho8 h ILE 99 CO 1.14 0.00 -0.19 -0.33 0.00 0.00 0.00 178.15 178.78 3ho8 h GLU 100 N -0.68 0.77 -0.01 2.37 4.39 -1.99 -0.22 114.58 119.22 3ho8 h GLU 100 Ca 0.02 -0.29 -0.14 0.00 0.34 0.00 0.00 59.36 59.28 3ho8 h GLU 100 Cb 0.70 -0.04 -0.02 0.00 -0.10 0.00 0.00 28.75 29.29 3ho8 h GLU 100 CO -0.27 0.90 -0.67 0.00 -1.16 0.00 0.00 179.01 177.81 3ho8 h ARG 101 N 0.68 0.04 -0.09 2.33 3.08 -1.94 0.54 114.38 119.01 3ho8 h ARG 101 Ca 0.10 -0.03 -0.22 0.00 0.07 0.00 0.00 59.98 59.90 3ho8 h ARG 101 Cb 0.69 0.01 0.01 0.00 0.08 0.00 0.00 29.97 30.75 3ho8 h ARG 101 CO 0.05 0.69 -0.84 0.82 -1.07 0.00 0.00 179.97 179.63 3ho8 h ILE 102 N 0.03 1.31 -0.13 2.04 2.04 -1.06 -3.14 117.51 118.59 3ho8 h ILE 102 Ca -0.01 -2.12 0.03 0.00 1.00 0.00 0.00 64.86 63.77 3ho8 h ILE 102 Cb 1.19 2.13 -0.03 0.00 -0.74 0.00 0.00 36.82 39.37 3ho8 h ILE 102 CO 0.09 0.66 -0.08 0.40 0.00 0.00 0.00 178.15 179.22 3ho8 h ILE 103 N 0.42 0.76 -0.66 -0.67 1.08 -0.86 -3.06 117.51 114.52 3ho8 h ILE 103 Ca -0.07 0.00 0.11 0.00 -0.39 0.00 0.00 64.86 64.51 3ho8 h ILE 103 Cb 1.46 0.76 -0.12 0.00 -3.07 0.00 0.00 36.82 35.85 3ho8 h ILE 103 CO 0.16 0.00 -0.37 0.44 -0.69 0.00 0.00 178.15 177.69 3ho8 h ASP 104 N -0.07 -1.30 -0.14 1.72 5.19 -0.87 -0.19 116.42 120.76 3ho8 h ASP 104 Ca 0.08 0.25 0.05 0.00 -0.62 0.00 0.00 57.03 56.78 3ho8 h ASP 104 Cb 0.19 0.64 -0.06 0.00 0.18 0.00 0.00 39.33 40.27 3ho8 h ASP 104 CO -0.18 -0.31 -0.27 0.58 -3.12 0.00 0.00 179.24 175.94 3ho8 h VAL 105 N -0.15 0.37 -0.58 -1.35 2.07 -1.49 0.12 116.25 115.23 3ho8 h VAL 105 Ca 0.24 0.00 0.11 0.00 0.82 0.00 0.00 66.70 67.87 3ho8 h VAL 105 Cb 0.56 0.37 -0.11 0.00 -1.52 0.00 0.00 31.29 30.59 3ho8 h VAL 105 CO -0.74 0.00 -0.22 0.00 0.02 0.00 0.00 177.57 176.63 3ho8 h ALA 106 N 0.59 0.22 -0.36 1.67 0.00 -1.12 0.26 119.26 120.52 3ho8 h ALA 106 Ca 0.10 0.21 0.01 0.00 0.00 0.00 0.00 54.91 55.23 3ho8 h ALA 106 Cb 0.49 0.58 -0.02 0.00 0.00 0.00 0.00 17.79 18.84 3ho8 h ALA 106 CO -0.33 -0.53 0.23 0.87 0.00 0.00 0.00 179.25 179.50 3ho8 h LYS 107 N -0.08 0.47 0.00 0.00 1.57 -0.09 -0.18 116.57 118.26 3ho8 h LYS 107 Ca 0.27 -0.03 -0.08 0.00 -1.87 0.00 0.00 60.65 58.94 3ho8 h LYS 107 Cb 0.50 -0.11 -0.01 0.00 0.08 0.00 0.00 32.23 32.69 3ho8 h LYS 107 CO -0.64 0.31 -0.38 0.37 -0.57 0.00 0.00 179.45 178.54 3ho8 h GLN 108 N 0.48 0.00 -0.62 3.15 4.15 0.02 -2.91 115.11 119.38 3ho8 h GLN 108 Ca 0.13 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.55 3ho8 h GLN 108 Cb -0.05 0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.64 3ho8 h GLN 108 CO -0.04 0.38 0.00 0.00 -1.93 0.00 0.00 178.83 177.24 3ho8 n ALA 109 N -2.36 2.55 -3.68 3.38 0.00 0.86 -4.96 120.51 116.30 3ho8 n ALA 109 Ca -0.01 -1.14 -0.26 0.00 0.00 0.00 0.00 53.44 52.03 3ho8 n ALA 109 Cb 0.46 -0.97 0.03 0.00 0.00 0.00 0.00 19.45 18.98 3ho8 n ALA 109 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 3ho8 n ASN 110 N 1.22 -3.50 -4.70 0.00 4.13 -0.85 -4.93 115.26 106.63 3ho8 n ASN 110 Ca 0.21 -0.92 -0.39 0.00 1.68 0.00 0.00 54.58 55.16 3ho8 n ASN 110 Cb 0.58 -3.73 -0.06 0.00 -1.54 0.00 0.00 39.78 35.03 3ho8 n ASN 110 CO 0.00 0.00 0.00 -0.69 0.28 0.00 0.00 177.26 176.85 3ho8 s VAL 111 N -3.59 5.13 0.03 2.41 1.01 -0.14 -4.72 120.40 120.53 3ho8 s VAL 111 Ca 0.27 1.03 -0.25 0.00 0.00 0.00 0.00 61.98 63.02 3ho8 s VAL 111 Cb -0.08 -3.86 -0.17 0.00 0.00 0.00 0.00 36.38 32.26 3ho8 s VAL 111 CO 0.84 0.25 1.39 0.44 0.00 0.00 0.00 175.10 178.02 3ho8 h ASP 112 N 7.02 -0.23 -4.62 3.32 5.19 -0.89 -3.44 116.42 122.78 3ho8 h ASP 112 Ca -0.38 -0.19 -0.10 0.00 -0.62 0.00 0.00 57.03 55.75 3ho8 h ASP 112 Cb 1.17 0.06 -0.21 0.00 0.18 0.00 0.00 39.33 40.53 3ho8 h ASP 112 CO 0.75 0.07 -0.11 0.00 -3.12 0.00 0.00 179.24 176.83 3ho8 s ALA 113 N -5.12 -1.19 -0.10 3.45 0.00 -0.90 -2.55 121.76 115.35 3ho8 s ALA 113 Ca -0.15 0.96 -0.00 0.00 0.00 0.00 0.00 51.96 52.77 3ho8 s ALA 113 Cb 0.03 -0.25 -0.02 0.00 0.00 0.00 0.00 23.12 22.87 3ho8 s ALA 113 CO 0.61 -0.28 -0.09 0.42 0.00 0.00 0.00 175.76 176.42 3ho8 s ILE 114 N -0.74 3.46 -0.22 0.00 1.01 -0.84 -1.58 121.20 122.29 3ho8 s ILE 114 Ca -0.08 -0.54 -0.08 0.00 0.00 0.00 0.00 60.65 59.94 3ho8 s ILE 114 Cb -0.03 -2.44 -0.04 0.00 0.01 0.00 0.00 42.46 39.96 3ho8 s ILE 114 CO 0.05 0.55 0.09 -2.28 0.00 0.00 0.00 174.94 173.34 3ho8 s HIS 115 N -0.21 3.19 -0.60 3.97 2.46 -0.62 -0.35 115.29 123.14 3ho8 s HIS 115 Ca 0.02 -0.07 0.24 0.00 0.47 0.00 0.00 55.06 55.72 3ho8 s HIS 115 Cb -0.13 -2.18 0.39 0.00 -0.13 0.00 0.00 32.58 30.53 3ho8 s HIS 115 CO 0.03 -0.06 1.39 -1.00 -2.47 0.00 0.00 174.74 172.63 3ho8 h PRO 116 N 7.47 0.00 0.00 2.88 0.13 -1.86 -1.96 132.00 138.66 3ho8 h PRO 116 Ca -0.37 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.76 3ho8 h PRO 116 Cb 1.17 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.30 3ho8 h PRO 116 CO 0.64 0.00 0.00 0.41 -0.23 0.00 0.00 178.00 178.82 3ho8 n GLY 117 N 1.30 1.48 3.50 1.56 0.00 -1.26 -4.44 105.19 107.33 3ho8 n GLY 117 Ca 0.03 -0.68 -0.25 0.00 0.00 0.00 0.00 46.02 45.13 3ho8 n GLY 117 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3ho8 s TYR 118 N 0.00 2.40 -1.24 1.61 -0.85 -1.26 -4.37 117.35 113.63 3ho8 s TYR 118 Ca 0.00 -0.31 -0.14 0.00 -0.52 0.00 0.00 57.07 56.10 3ho8 s TYR 118 Cb 0.00 -1.08 -0.00 0.00 0.38 0.00 0.00 41.96 41.26 3ho8 s TYR 118 CO 0.00 0.65 0.65 0.41 -1.52 0.00 0.00 175.55 175.73 3ho8 n GLY 119 N -0.46 -0.69 0.00 5.49 0.00 -1.26 -4.81 105.19 103.46 3ho8 n GLY 119 Ca -0.07 0.33 0.00 0.00 0.00 0.00 0.00 46.02 46.28 3ho8 n GLY 119 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3ho8 n PHE 120 N -4.34 0.00 1.17 1.61 3.72 -1.26 -4.92 117.46 113.43 3ho8 n PHE 120 Ca -0.18 0.00 0.04 0.00 -0.05 0.00 0.00 57.45 57.26 3ho8 n PHE 120 Cb 0.62 0.00 0.11 0.00 -0.94 0.00 0.00 39.48 39.28 3ho8 n PHE 120 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 176.76 177.99 3ho8 n LEU 121 N 0.00 1.40 0.20 4.37 4.77 -1.26 -4.38 117.00 122.10 3ho8 n LEU 121 Ca 0.00 -0.70 0.04 0.00 -0.03 0.00 0.00 56.01 55.32 3ho8 n LEU 121 Cb 0.00 -0.18 0.43 0.00 -2.33 0.00 0.00 43.42 41.34 3ho8 n LEU 121 CO 0.00 0.35 0.81 0.77 -1.33 0.00 0.00 177.39 177.99 3ho8 h SER 122 N 1.52 0.00 -1.75 -1.43 4.64 -1.85 -3.03 113.55 111.64 3ho8 h SER 122 Ca 0.00 0.00 -0.63 0.00 -0.47 0.00 0.00 61.79 60.69 3ho8 h SER 122 Cb 0.35 0.00 -0.39 0.00 -0.31 0.00 0.00 62.40 62.05 3ho8 h SER 122 CO 0.00 0.28 -0.36 1.21 -0.87 0.00 0.00 176.83 177.09 3ho8 n GLU 123 N -4.20 3.38 -3.82 4.77 2.13 -1.26 -4.89 120.64 116.75 3ho8 n GLU 123 Ca -0.02 -4.42 -0.26 0.00 0.66 0.00 0.00 57.16 53.12 3ho8 n GLU 123 Cb 0.33 -2.26 -0.17 0.00 0.27 0.00 0.00 31.44 29.61 3ho8 n GLU 123 CO 0.00 0.00 0.00 1.21 -0.41 0.00 0.00 177.13 177.93 3ho8 s ASN 124 N -3.06 2.19 0.24 4.31 3.84 -1.15 -5.02 114.94 116.30 3ho8 s ASN 124 Ca 0.48 -0.37 0.03 0.00 0.21 0.00 0.00 52.86 53.22 3ho8 s ASN 124 Cb 0.38 -0.65 0.28 0.00 -0.55 0.00 0.00 41.25 40.70 3ho8 s ASN 124 CO -0.21 -0.19 1.59 -0.08 -2.79 0.00 0.00 177.10 175.41 3ho8 h GLU 125 N 8.24 0.31 -0.22 0.43 4.81 -1.90 -2.92 114.58 123.34 3ho8 h GLU 125 Ca -0.22 -0.19 -0.08 0.00 -0.13 0.00 0.00 59.36 58.74 3ho8 h GLU 125 Cb 1.12 0.02 -0.00 0.00 0.63 0.00 0.00 28.75 30.52 3ho8 h GLU 125 CO 0.34 0.76 -0.18 0.37 -0.73 0.00 0.00 179.01 179.57 3ho8 h GLN 126 N 0.24 0.51 0.21 1.92 -0.00 -1.97 -0.80 115.11 115.22 3ho8 h GLN 126 Ca 0.01 -0.26 -0.01 0.00 -0.00 0.00 0.00 58.65 58.39 3ho8 h GLN 126 Cb 1.01 0.00 0.00 0.00 0.00 0.00 0.00 27.48 28.50 3ho8 h GLN 126 CO 0.09 0.83 -0.10 0.35 0.00 0.00 0.00 178.83 179.99 3ho8 h PHE 127 N 0.19 -0.26 -0.90 3.99 3.57 -1.91 -2.44 116.94 119.18 3ho8 h PHE 127 Ca 0.04 -0.01 0.17 0.00 3.53 0.00 0.00 57.97 61.71 3ho8 h PHE 127 Cb 0.72 0.09 -0.07 0.00 2.79 0.00 0.00 35.95 39.48 3ho8 h PHE 127 CO 0.07 0.06 0.59 0.00 -2.23 0.00 0.00 178.31 176.80 3ho8 h ALA 128 N 0.10 1.98 -0.26 2.41 0.00 -1.58 -1.83 119.26 120.07 3ho8 h ALA 128 Ca -0.03 0.02 0.02 0.00 0.00 0.00 0.00 54.91 54.93 3ho8 h ALA 128 Cb 0.44 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.13 3ho8 h ALA 128 CO 0.05 -0.25 0.11 -0.09 0.00 0.00 0.00 179.25 179.07 3ho8 h ARG 129 N 0.57 0.24 -0.28 0.00 2.43 -0.75 -2.58 114.38 114.01 3ho8 h ARG 129 Ca 0.47 -0.01 -0.17 0.00 -0.81 0.00 0.00 59.98 59.45 3ho8 h ARG 129 Cb 0.93 -0.05 0.00 0.00 -0.42 0.00 0.00 29.97 30.43 3ho8 h ARG 129 CO -0.21 0.16 -0.50 0.00 -1.51 0.00 0.00 179.97 177.90 3ho8 h ARG 130 N 0.25 0.84 -0.51 0.20 2.47 -0.97 -2.70 114.38 113.95 3ho8 h ARG 130 Ca 0.11 -0.53 0.05 0.00 -1.26 0.00 0.00 59.98 58.36 3ho8 h ARG 130 Cb 0.05 0.06 -0.08 0.00 -1.65 0.00 0.00 29.97 28.35 3ho8 h ARG 130 CO -0.09 1.16 -0.48 0.00 0.56 0.00 0.00 179.97 181.12 3ho8 h ALA 132 N -0.07 1.00 0.00 0.00 0.00 -1.44 -0.00 119.26 118.75 3ho8 h ALA 132 Ca 0.09 0.00 -0.22 0.00 0.00 0.00 0.00 54.91 54.78 3ho8 h ALA 132 Cb 0.45 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.20 3ho8 h ALA 132 CO -0.60 0.00 -1.29 0.93 0.00 0.00 0.00 179.25 178.29 3ho8 h GLU 133 N 0.00 0.00 -0.35 0.00 5.08 -0.48 -3.31 114.58 115.53 3ho8 h GLU 133 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3ho8 h GLU 133 Cb 0.22 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.47 3ho8 h GLU 133 CO 0.00 0.57 0.00 0.39 -1.00 0.00 0.00 179.01 178.97 3ho8 n GLU 134 N -3.11 2.25 -0.52 2.33 -0.58 0.10 -4.94 120.64 116.19 3ho8 n GLU 134 Ca -0.08 -1.90 0.00 0.00 -0.42 0.00 0.00 57.16 54.76 3ho8 n GLU 134 Cb 0.93 -1.47 0.00 0.00 -0.57 0.00 0.00 31.44 30.33 3ho8 n GLU 134 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3ho8 n GLY 135 N 1.38 0.75 3.89 0.62 0.00 -0.73 -5.06 105.19 106.04 3ho8 n GLY 135 Ca 0.18 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.91 3ho8 n GLY 135 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3ho8 s ILE 136 N -2.52 3.90 -0.33 -0.61 1.09 -0.22 -4.89 121.20 117.62 3ho8 s ILE 136 Ca 0.00 0.47 0.02 0.00 -1.10 0.00 0.00 60.65 60.05 3ho8 s ILE 136 Cb 0.00 -3.59 0.09 0.00 -1.06 0.00 0.00 42.46 37.90 3ho8 s ILE 136 CO 0.00 -0.74 0.04 -0.75 -0.10 0.00 0.00 174.94 173.39 3ho8 s LYS 137 N -5.21 1.76 0.11 2.79 2.47 -1.06 -3.66 119.74 116.95 3ho8 s LYS 137 Ca 0.56 -1.73 -0.31 0.00 -1.56 0.00 0.00 55.97 52.93 3ho8 s LYS 137 Cb -0.11 -3.20 -0.10 0.00 -1.46 0.00 0.00 37.83 32.97 3ho8 s LYS 137 CO 0.51 -0.87 1.73 0.12 0.16 0.00 0.00 175.35 177.00 3ho8 s PHE 138 N 1.00 2.38 -1.12 4.03 2.19 -1.26 -1.98 117.98 123.21 3ho8 s PHE 138 Ca 0.06 0.19 -0.16 0.00 0.33 0.00 0.00 56.93 57.35 3ho8 s PHE 138 Cb -0.20 -4.07 0.15 0.00 -1.31 0.00 0.00 43.02 37.59 3ho8 s PHE 138 CO -0.06 -4.32 1.35 0.42 1.83 0.00 0.00 175.22 174.44 3ho8 s ILE 139 N 2.46 4.88 0.00 3.12 1.01 0.53 -4.84 121.20 128.36 3ho8 s ILE 139 Ca 0.77 -2.23 0.00 0.00 0.00 0.00 0.00 60.65 59.18 3ho8 s ILE 139 Cb -0.44 -4.88 0.00 0.00 0.01 0.00 0.00 42.46 37.15 3ho8 s ILE 139 CO 0.34 -1.61 0.00 0.61 0.00 0.00 0.00 174.94 174.28 3ho8 n GLY 140 N 4.66 2.47 3.95 6.18 0.00 -1.26 -4.51 105.19 116.69 3ho8 n GLY 140 Ca 0.33 -0.49 -0.23 0.00 0.00 0.00 0.00 46.02 45.63 3ho8 n GLY 140 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3ho8 s PRO 141 N 1.69 2.67 1.03 1.61 0.04 -1.25 -4.51 135.00 136.28 3ho8 s PRO 141 Ca 0.00 -0.53 -0.12 0.00 0.04 0.00 0.00 61.00 60.39 3ho8 s PRO 141 Cb 0.00 -2.43 0.17 0.00 0.04 0.00 0.00 34.50 32.28 3ho8 s PRO 141 CO 0.00 -0.68 0.87 0.72 0.04 0.00 0.00 177.00 177.95 3ho8 n HIS 142 N -2.39 -0.44 -0.03 0.56 8.25 -1.26 -4.66 115.22 115.24 3ho8 n HIS 142 Ca 0.06 0.16 -0.13 0.00 -0.26 0.00 0.00 57.72 57.55 3ho8 n HIS 142 Cb 0.59 -1.82 -0.08 0.00 1.12 0.00 0.00 29.99 29.80 3ho8 n HIS 142 CO 0.00 0.00 0.00 1.25 0.64 0.00 0.00 176.34 178.23 3ho8 h LEU 143 N -2.13 -1.54 -1.66 2.41 5.85 -1.98 -1.79 115.31 114.46 3ho8 h LEU 143 Ca -0.50 0.20 -0.02 0.00 0.84 0.00 0.00 57.88 58.40 3ho8 h LEU 143 Cb 1.30 0.62 -0.00 0.00 0.37 0.00 0.00 40.66 42.95 3ho8 h LEU 143 CO 0.42 -0.44 -0.08 1.05 -0.34 0.00 0.00 178.44 179.04 3ho8 h GLU 144 N -0.50 0.00 -0.23 1.25 9.09 -1.99 -1.80 114.58 120.39 3ho8 h GLU 144 Ca 0.07 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.48 3ho8 h GLU 144 Cb 0.65 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 27.73 3ho8 h GLU 144 CO -0.45 0.08 0.15 0.45 0.05 0.00 0.00 179.01 179.29 3ho8 h HIS 145 N 0.00 0.30 -0.52 2.06 3.86 -1.65 0.24 115.15 119.42 3ho8 h HIS 145 Ca -0.00 0.01 0.08 0.00 -1.16 0.00 0.00 60.37 59.29 3ho8 h HIS 145 Cb 0.47 -0.10 -0.06 0.00 1.06 0.00 0.00 27.41 28.78 3ho8 h HIS 145 CO 0.00 0.19 0.17 -0.07 0.86 0.00 0.00 177.93 179.08 3ho8 h LEU 146 N 0.31 0.15 0.00 2.43 3.38 -1.19 -2.97 115.31 117.42 3ho8 h LEU 146 Ca 0.09 0.07 0.00 0.00 0.09 0.00 0.00 57.88 58.13 3ho8 h LEU 146 Cb -0.03 0.06 0.00 0.00 0.09 0.00 0.00 40.66 40.78 3ho8 h LEU 146 CO -0.02 0.11 0.00 -0.67 0.09 0.00 0.00 178.44 177.95 3ho8 n ASP 147 N -5.02 0.00 0.00 -0.43 -0.08 -1.11 -2.22 116.55 107.69 3ho8 n ASP 147 Ca 0.06 0.89 0.00 0.00 -1.51 0.00 0.00 54.79 54.23 3ho8 n ASP 147 Cb 0.22 -0.39 0.00 0.00 2.34 0.00 0.00 41.12 43.29 3ho8 n ASP 147 CO 0.00 0.00 0.00 0.80 0.12 0.00 0.00 177.20 178.12 3ho8 n MET 148 N -1.74 0.00 -0.29 -0.67 1.56 0.81 0.89 117.12 117.68 3ho8 n MET 148 Ca 0.00 0.00 0.07 0.00 -0.27 0.00 0.00 57.70 57.50 3ho8 n MET 148 Cb 0.00 0.00 0.21 0.00 2.15 0.00 0.00 33.22 35.58 3ho8 n MET 148 CO 0.00 0.00 0.00 1.19 -0.73 0.00 0.00 175.97 176.43 3ho8 n PHE 149 N -2.99 0.72 0.61 1.12 3.01 -1.13 -2.36 117.46 116.44 3ho8 n PHE 149 Ca 0.00 -0.58 0.13 0.00 1.01 0.00 0.00 57.45 58.01 3ho8 n PHE 149 Cb 0.00 -0.10 0.44 0.00 -0.01 0.00 0.00 39.48 39.81 3ho8 n PHE 149 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3ho8 n GLY 150 N 0.51 -1.59 3.01 1.37 0.00 0.26 -4.78 105.19 103.97 3ho8 n GLY 150 Ca 0.16 -0.01 -0.21 0.00 0.00 0.00 0.00 46.02 45.97 3ho8 n GLY 150 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3ho8 s ASP 151 N -4.29 1.25 0.39 1.61 2.15 -1.26 -5.04 116.67 111.48 3ho8 s ASP 151 Ca 0.10 -0.19 0.13 0.00 0.43 0.00 0.00 52.55 53.01 3ho8 s ASP 151 Cb 0.12 -0.32 0.95 0.00 -0.30 0.00 0.00 42.92 43.37 3ho8 s ASP 151 CO 0.54 0.07 1.88 0.50 -0.17 0.00 0.00 175.17 177.99 3ho8 h LYS 152 N 6.35 0.53 0.11 4.34 1.63 -1.95 -2.37 116.57 125.21 3ho8 h LYS 152 Ca -0.33 -0.03 -0.01 0.00 -0.85 0.00 0.00 60.65 59.43 3ho8 h LYS 152 Cb 1.17 -0.12 0.00 0.00 -0.60 0.00 0.00 32.23 32.68 3ho8 h LYS 152 CO 0.49 0.35 -0.05 0.28 -3.45 0.00 0.00 179.45 177.06 3ho8 h VAL 153 N 0.54 0.00 -0.98 2.00 2.07 -1.96 -2.98 116.25 114.94 3ho8 h VAL 153 Ca 0.43 -0.49 0.16 0.00 0.82 0.00 0.00 66.70 67.62 3ho8 h VAL 153 Cb 0.86 0.00 -0.10 0.00 -1.52 0.00 0.00 31.29 30.53 3ho8 h VAL 153 CO -0.18 0.00 0.59 0.11 0.02 0.00 0.00 177.57 178.12 3ho8 h LYS 154 N -0.64 0.79 -0.13 1.57 1.57 -1.83 -1.78 116.57 116.10 3ho8 h LYS 154 Ca -0.02 -0.05 -0.00 0.00 -1.87 0.00 0.00 60.65 58.71 3ho8 h LYS 154 Cb 0.12 -0.18 -0.01 0.00 0.08 0.00 0.00 32.23 32.24 3ho8 h LYS 154 CO 0.03 0.52 0.07 0.00 -0.57 0.00 0.00 179.45 179.49 3ho8 h ALA 155 N 1.60 0.17 -0.84 3.86 0.00 -1.04 -1.68 119.26 121.34 3ho8 h ALA 155 Ca 0.54 -0.06 0.13 0.00 0.00 0.00 0.00 54.91 55.51 3ho8 h ALA 155 Cb 0.75 -0.05 -0.09 0.00 0.00 0.00 0.00 17.79 18.40 3ho8 h ALA 155 CO -0.35 -0.28 0.45 -0.09 0.00 0.00 0.00 179.25 178.97 3ho8 h ARG 156 N 0.10 0.66 -0.07 0.00 2.43 -1.18 -2.36 114.38 113.97 3ho8 h ARG 156 Ca 0.05 -0.04 -0.15 0.00 -0.81 0.00 0.00 59.98 59.03 3ho8 h ARG 156 Cb 0.10 -0.15 -0.01 0.00 -0.42 0.00 0.00 29.97 29.49 3ho8 h ARG 156 CO -0.01 0.44 -0.60 1.15 -1.51 0.00 0.00 179.97 179.44 3ho8 h THR 157 N 0.68 1.39 -0.48 0.20 2.02 -1.21 -2.50 112.91 113.01 3ho8 h THR 157 Ca 0.44 -1.98 -0.28 0.00 0.77 0.00 0.00 66.41 65.35 3ho8 h THR 157 Cb 0.54 2.00 -0.14 0.00 -1.74 0.00 0.00 68.15 68.81 3ho8 h THR 157 CO -0.32 0.59 0.36 0.35 0.37 0.00 0.00 175.52 176.87 3ho8 n THR 158 N -3.87 2.38 0.00 3.16 -2.24 -0.65 -2.61 114.28 110.44 3ho8 n THR 158 Ca -0.02 -1.25 0.00 0.00 -2.27 0.00 0.00 64.05 60.51 3ho8 n THR 158 Cb 0.62 -1.01 0.00 0.00 -2.10 0.00 0.00 70.33 67.84 3ho8 n THR 158 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3ho8 n ALA 159 N -0.00 1.25 0.08 6.98 0.00 -1.08 -4.43 120.51 123.31 3ho8 n ALA 159 Ca 0.29 0.00 -0.04 0.00 0.00 0.00 0.00 53.44 53.69 3ho8 n ALA 159 Cb 0.85 0.02 0.14 0.00 0.00 0.00 0.00 19.45 20.46 3ho8 n ALA 159 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 3ho8 h ILE 160 N 0.00 1.37 -0.47 0.00 2.04 -1.51 -2.21 117.51 116.72 3ho8 h ILE 160 Ca 0.00 -1.88 -0.11 0.00 1.00 0.00 0.00 64.86 63.87 3ho8 h ILE 160 Cb 0.06 1.93 -0.01 0.00 -0.74 0.00 0.00 36.82 38.05 3ho8 h ILE 160 CO 0.00 0.56 -0.14 0.50 0.00 0.00 0.00 178.15 179.06 3ho8 h LYS 161 N 0.19 0.93 0.00 2.37 1.63 -1.77 -2.79 116.57 117.13 3ho8 h LYS 161 Ca 0.00 -0.37 0.00 0.00 -0.85 0.00 0.00 60.65 59.43 3ho8 h LYS 161 Cb 1.04 -0.05 0.00 0.00 -0.60 0.00 0.00 32.23 32.63 3ho8 h LYS 161 CO 0.09 1.03 0.00 0.00 -3.45 0.00 0.00 179.45 177.12 3ho8 n ALA 162 N -2.49 2.47 -2.41 5.00 0.00 -1.21 -4.89 120.51 116.98 3ho8 n ALA 162 Ca 0.00 -0.05 -0.08 0.00 0.00 0.00 0.00 53.44 53.31 3ho8 n ALA 162 Cb 0.41 -1.14 0.04 0.00 0.00 0.00 0.00 19.45 18.76 3ho8 n ALA 162 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 3ho8 n ASP 163 N -0.65 -4.23 -4.22 0.00 -0.08 -1.05 -4.67 116.55 101.66 3ho8 n ASP 163 Ca 0.07 -0.36 -0.18 0.00 -1.51 0.00 0.00 54.79 52.81 3ho8 n ASP 163 Cb 0.03 -2.89 -0.11 0.00 2.34 0.00 0.00 41.12 40.48 3ho8 n ASP 163 CO 0.00 0.00 0.00 -0.76 0.12 0.00 0.00 177.20 176.56 3ho8 s LEU 164 N -4.21 2.36 0.00 -2.67 1.43 -0.83 -5.01 118.68 109.75 3ho8 s LEU 164 Ca 0.22 -0.75 -0.30 0.00 -1.03 0.00 0.00 54.13 52.27 3ho8 s LEU 164 Cb -0.03 -0.53 -0.06 0.00 0.03 0.00 0.00 46.19 45.60 3ho8 s LEU 164 CO 0.38 -0.13 1.55 -2.16 0.23 0.00 0.00 176.35 176.21 3ho8 s PRO 165 N -2.38 4.23 0.07 1.29 0.04 -1.26 -4.55 135.00 132.44 3ho8 s PRO 165 Ca 0.05 2.13 0.10 0.00 0.04 0.00 0.00 61.00 63.33 3ho8 s PRO 165 Cb -0.06 -3.69 -0.03 0.00 0.04 0.00 0.00 34.50 30.75 3ho8 s PRO 165 CO 0.03 -0.70 -0.26 0.08 0.04 0.00 0.00 177.00 176.18 3ho8 s VAL 166 N 2.94 2.15 0.08 -0.36 1.01 -1.26 -0.60 120.40 124.36 3ho8 s VAL 166 Ca 0.69 -1.49 -0.31 0.00 0.00 0.00 0.00 61.98 60.87 3ho8 s VAL 166 Cb -0.34 -1.86 -0.08 0.00 0.00 0.00 0.00 36.38 34.10 3ho8 s VAL 166 CO 0.29 0.28 1.53 -0.63 0.00 0.00 0.00 175.10 176.57 3ho8 s ILE 167 N -0.88 3.16 0.06 2.22 1.01 -1.26 -4.95 121.20 120.56 3ho8 s ILE 167 Ca 0.12 0.70 -0.31 0.00 0.00 0.00 0.00 60.65 61.16 3ho8 s ILE 167 Cb -0.10 -3.45 -0.07 0.00 0.01 0.00 0.00 42.46 38.85 3ho8 s ILE 167 CO 0.03 0.02 1.43 -2.84 0.00 0.00 0.00 174.94 173.59 3ho8 s PRO 168 N 2.00 4.29 0.00 2.79 0.02 -1.26 -4.84 135.00 138.00 3ho8 s PRO 168 Ca 0.69 2.07 0.00 0.00 0.02 0.00 0.00 61.00 63.78 3ho8 s PRO 168 Cb -0.38 -3.43 0.00 0.00 0.02 0.00 0.00 34.50 30.71 3ho8 s PRO 168 CO 0.30 -0.54 0.00 0.41 -0.33 0.00 0.00 177.00 176.85 3ho8 n GLY 169 N 3.63 3.89 3.17 0.52 0.00 -1.26 0.52 105.19 115.67 3ho8 n GLY 169 Ca 0.13 -0.89 -0.27 0.00 0.00 0.00 0.00 46.02 44.98 3ho8 n GLY 169 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 3ho8 n THR 170 N 0.00 0.00 -2.52 2.61 -1.04 -1.26 -5.06 114.28 107.01 3ho8 n THR 170 Ca 0.00 -0.01 -0.27 0.00 -2.04 0.00 0.00 64.05 61.73 3ho8 n THR 170 Cb 0.00 -0.88 -0.00 0.00 -1.82 0.00 0.00 70.33 67.62 3ho8 n THR 170 CO 0.00 0.00 0.00 -0.90 -0.64 0.00 0.00 175.07 173.53 3ho8 n ASP 171 N -4.85 4.66 0.00 8.00 5.75 -1.26 -5.22 116.55 123.63 3ho8 n ASP 171 Ca 0.12 -3.71 0.00 0.00 -0.01 0.00 0.00 54.79 51.19 3ho8 n ASP 171 Cb 0.54 -0.47 0.00 0.00 -1.03 0.00 0.00 41.12 40.16 3ho8 n ASP 171 CO 0.00 0.00 0.00 -1.14 -0.11 0.00 0.00 177.20 175.95 3ho8 n ARG 237 N -0.46 0.00 -1.67 0.11 0.63 0.19 -5.16 116.66 110.30 3ho8 n ARG 237 Ca 0.38 0.00 -0.45 0.00 -0.92 0.00 0.00 57.85 56.86 3ho8 n ARG 237 Cb 0.64 0.00 -0.04 0.00 0.45 0.00 0.00 32.46 33.51 3ho8 n ARG 237 CO 0.00 0.00 0.00 0.98 -2.51 0.00 0.00 177.63 176.10 3ho8 n TYR 238 N 0.00 2.44 -2.29 -0.14 9.36 -1.26 -4.82 117.16 120.45 3ho8 n TYR 238 Ca 0.00 -0.22 -0.42 0.00 3.32 0.00 0.00 57.90 60.58 3ho8 n TYR 238 Cb 0.00 -2.75 -0.03 0.00 -0.63 0.00 0.00 39.34 35.93 3ho8 n TYR 238 CO 0.00 0.00 0.00 -1.50 0.22 0.00 0.00 176.86 175.58 3ho8 s ILE 239 N 4.30 3.59 -0.66 2.97 1.10 -1.26 -4.97 121.20 126.27 3ho8 s ILE 239 Ca 0.91 1.17 -0.18 0.00 -0.51 0.00 0.00 60.65 62.03 3ho8 s ILE 239 Cb -0.55 -3.75 0.12 0.00 0.15 0.00 0.00 42.46 38.43 3ho8 s ILE 239 CO 0.46 0.11 0.76 -0.62 -2.11 0.00 0.00 174.94 173.54 3ho8 s ASP 240 N 0.92 6.30 -0.58 4.50 -1.08 -1.26 -4.70 116.67 120.76 3ho8 s ASP 240 Ca 0.60 -1.65 -0.15 0.00 -0.52 0.00 0.00 52.55 50.83 3ho8 s ASP 240 Cb -0.34 -2.30 0.02 0.00 -1.46 0.00 0.00 42.92 38.84 3ho8 s ASP 240 CO 0.31 -1.05 0.64 -3.20 0.52 0.00 0.00 175.17 172.40 3ho8 n ASN 241 N 6.09 -6.74 -4.97 -0.34 4.05 -1.26 -4.98 115.26 107.10 3ho8 n ASN 241 Ca -0.03 -0.06 -0.22 0.00 0.45 0.00 0.00 54.58 54.72 3ho8 n ASN 241 Cb 0.44 -3.76 0.02 0.00 1.23 0.00 0.00 39.78 37.70 3ho8 n ASN 241 CO 0.00 0.00 0.00 -2.16 -3.05 0.00 0.00 177.26 172.05 3ho8 s PRO 242 N -3.10 2.93 -0.23 1.20 0.04 -1.26 -4.88 135.00 129.71 3ho8 s PRO 242 Ca 0.18 -0.68 -0.05 0.00 0.04 0.00 0.00 61.00 60.48 3ho8 s PRO 242 Cb -0.03 -2.59 -0.02 0.00 0.04 0.00 0.00 34.50 31.90 3ho8 s PRO 242 CO 0.82 -0.33 -0.01 0.21 0.04 0.00 0.00 177.00 177.73 3ho8 s LYS 243 N -4.54 3.48 -0.31 4.56 2.20 -0.07 -0.68 119.74 124.38 3ho8 s LYS 243 Ca 0.50 -0.57 -0.29 0.00 -0.36 0.00 0.00 55.97 55.25 3ho8 s LYS 243 Cb -0.10 -3.11 0.01 0.00 -1.51 0.00 0.00 37.83 33.12 3ho8 s LYS 243 CO 0.37 -0.18 1.14 -1.58 -0.36 0.00 0.00 175.35 174.74 3ho8 s HIS 244 N 1.48 3.01 -0.04 4.03 5.65 -1.26 -2.34 115.29 125.81 3ho8 s HIS 244 Ca 0.06 1.09 0.02 0.00 0.25 0.00 0.00 55.06 56.47 3ho8 s HIS 244 Cb -0.15 -3.76 0.01 0.00 -1.18 0.00 0.00 32.58 27.50 3ho8 s HIS 244 CO -0.01 -1.07 -0.08 0.42 -0.65 0.00 0.00 174.74 173.36 3ho8 s ILE 245 N 3.85 0.75 0.17 0.89 -1.09 -0.74 0.29 121.20 125.32 3ho8 s ILE 245 Ca 0.49 -0.29 0.08 0.00 -2.23 0.00 0.00 60.65 58.70 3ho8 s ILE 245 Cb -0.14 -0.70 -0.04 0.00 -1.58 0.00 0.00 42.46 40.00 3ho8 s ILE 245 CO 0.18 0.25 -0.18 -1.61 -1.23 0.00 0.00 174.94 172.36 3ho8 s GLU 246 N 0.53 1.27 -0.14 2.79 2.02 -0.83 0.28 118.70 124.63 3ho8 s GLU 246 Ca -0.08 -1.42 -0.01 0.00 0.02 0.00 0.00 54.97 53.48 3ho8 s GLU 246 Cb -0.12 -1.29 0.03 0.00 0.10 0.00 0.00 34.13 32.85 3ho8 s GLU 246 CO 0.01 0.26 -0.06 0.08 0.02 0.00 0.00 175.26 175.57 3ho8 s VAL 247 N -2.15 1.01 -0.32 2.63 1.01 -1.08 -0.16 120.40 121.35 3ho8 s VAL 247 Ca 0.16 -0.43 -0.29 0.00 0.00 0.00 0.00 61.98 61.42 3ho8 s VAL 247 Cb -0.05 -1.13 -0.01 0.00 0.00 0.00 0.00 36.38 35.19 3ho8 s VAL 247 CO 0.07 0.24 1.59 -1.58 0.00 0.00 0.00 175.10 175.41 3ho8 s GLN 248 N 1.69 3.59 -0.11 2.72 2.00 -0.59 -3.36 119.66 125.60 3ho8 s GLN 248 Ca 0.03 1.33 -0.03 0.00 -2.00 0.00 0.00 55.36 54.69 3ho8 s GLN 248 Cb -0.14 -4.07 -0.03 0.00 0.80 0.00 0.00 33.01 29.57 3ho8 s GLN 248 CO -0.08 -1.54 0.01 0.08 -0.50 0.00 0.00 175.29 173.26 3ho8 s VAL 249 N 5.74 4.39 -0.04 1.34 1.01 -1.25 0.67 120.40 132.25 3ho8 s VAL 249 Ca 0.70 -0.20 -0.02 0.00 0.00 0.00 0.00 61.98 62.46 3ho8 s VAL 249 Cb -0.20 -2.88 0.03 0.00 0.00 0.00 0.00 36.38 33.33 3ho8 s VAL 249 CO 0.31 0.56 0.07 -0.63 0.00 0.00 0.00 175.10 175.42 3ho8 s ILE 250 N -0.48 -0.11 0.45 2.22 1.01 -0.82 -2.73 121.20 120.74 3ho8 s ILE 250 Ca 0.09 0.34 0.04 0.00 0.00 0.00 0.00 60.65 61.12 3ho8 s ILE 250 Cb -0.12 -0.15 -0.05 0.00 0.01 0.00 0.00 42.46 42.15 3ho8 s ILE 250 CO 0.02 0.14 0.01 -0.83 0.00 0.00 0.00 174.94 174.29 3ho8 s GLY 251 N 1.80 2.74 0.00 6.18 0.00 0.13 -1.21 107.32 116.96 3ho8 s GLY 251 Ca -0.00 -1.34 0.00 0.00 0.00 0.00 0.00 44.72 43.38 3ho8 s GLY 251 CO -0.04 -2.12 0.00 2.09 0.00 0.00 0.00 173.10 173.03 3ho8 n ASP 252 N -1.11 1.65 -2.06 1.64 3.85 0.46 0.40 116.55 121.39 3ho8 n ASP 252 Ca -0.12 0.00 -0.21 0.00 -0.71 0.00 0.00 54.79 53.76 3ho8 n ASP 252 Cb 0.67 0.00 0.19 0.00 -1.35 0.00 0.00 41.12 40.62 3ho8 n ASP 252 CO 0.00 0.00 0.00 -0.62 -1.01 0.00 0.00 177.20 175.57 3ho8 n GLU 253 N 0.00 2.21 -0.70 0.11 1.02 -1.26 -4.13 120.64 117.89 3ho8 n GLU 253 Ca 0.00 -3.04 0.00 0.00 -0.02 0.00 0.00 57.16 54.10 3ho8 n GLU 253 Cb 0.00 -2.12 -0.00 0.00 -0.02 0.00 0.00 31.44 29.29 3ho8 n GLU 253 CO 0.00 0.00 0.00 0.72 1.18 0.00 0.00 177.13 179.03 3ho8 n HIS 254 N -1.13 0.00 -1.68 -0.32 8.25 -1.26 -5.02 115.22 114.06 3ho8 n HIS 254 Ca 0.55 -0.12 -0.04 0.00 -0.26 0.00 0.00 57.72 57.85 3ho8 n HIS 254 Cb 1.57 0.03 -0.01 0.00 1.12 0.00 0.00 29.99 32.71 3ho8 n HIS 254 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3ho8 n GLY 255 N 0.09 0.41 3.38 -1.41 0.00 -1.26 -5.04 105.19 101.35 3ho8 n GLY 255 Ca -0.01 -0.78 -0.34 0.00 0.00 0.00 0.00 46.02 44.88 3ho8 n GLY 255 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3ho8 s ASN 256 N -2.87 4.46 0.02 1.61 -0.87 -1.26 -5.00 114.94 111.02 3ho8 s ASN 256 Ca 0.00 -0.30 0.03 0.00 -1.57 0.00 0.00 52.86 51.03 3ho8 s ASN 256 Cb 0.00 -1.75 -0.01 0.00 -0.02 0.00 0.00 41.25 39.47 3ho8 s ASN 256 CO 0.00 0.05 -0.11 -0.63 -2.57 0.00 0.00 177.10 173.85 3ho8 s ILE 257 N 1.05 0.85 0.30 0.60 1.09 -1.26 -0.40 121.20 123.42 3ho8 s ILE 257 Ca 0.01 -0.69 0.05 0.00 -1.10 0.00 0.00 60.65 58.91 3ho8 s ILE 257 Cb -0.15 -0.75 -0.06 0.00 -1.06 0.00 0.00 42.46 40.44 3ho8 s ILE 257 CO 0.00 0.06 0.02 0.68 -0.10 0.00 0.00 174.94 175.60 3ho8 s VAL 258 N -0.58 1.33 0.11 2.92 -7.23 -0.35 -4.96 120.40 111.63 3ho8 s VAL 258 Ca 0.01 -2.04 0.09 0.00 -1.81 0.00 0.00 61.98 58.23 3ho8 s VAL 258 Cb -0.06 -2.64 -0.04 0.00 0.56 0.00 0.00 36.38 34.20 3ho8 s VAL 258 CO 0.00 -0.13 -0.20 -1.38 -0.31 0.00 0.00 175.10 173.09 3ho8 s HIS 259 N -3.21 2.50 -0.56 2.82 -3.43 -1.26 -1.94 115.29 110.21 3ho8 s HIS 259 Ca 0.33 -0.28 0.03 0.00 -0.80 0.00 0.00 55.06 54.34 3ho8 s HIS 259 Cb 0.07 -1.34 0.40 0.00 -1.43 0.00 0.00 32.58 30.28 3ho8 s HIS 259 CO 0.14 0.36 1.40 1.28 -2.00 0.00 0.00 174.74 175.92 3ho8 n LEU 260 N 0.89 5.61 0.00 5.38 4.77 0.21 -4.99 117.00 128.87 3ho8 n LEU 260 Ca -0.16 -5.07 0.06 0.00 -0.03 0.00 0.00 56.01 50.81 3ho8 n LEU 260 Cb 0.53 -0.64 -0.01 0.00 -2.33 0.00 0.00 43.42 40.96 3ho8 n LEU 260 CO 0.27 2.08 -0.08 0.49 -1.33 0.00 0.00 177.39 178.82 3ho8 n PHE 261 N -0.52 -2.44 -3.72 -1.77 3.01 -1.26 -4.55 117.46 106.21 3ho8 n PHE 261 Ca 0.44 0.53 -0.20 0.00 1.01 0.00 0.00 57.45 59.22 3ho8 n PHE 261 Cb 0.55 -0.78 -0.02 0.00 -0.01 0.00 0.00 39.48 39.22 3ho8 n PHE 261 CO 0.00 0.00 0.00 -1.83 1.01 0.00 0.00 176.76 175.94 3ho8 s GLU 262 N -0.66 2.91 -0.06 -1.08 1.03 -1.26 -1.54 118.70 118.04 3ho8 s GLU 262 Ca 0.00 -1.16 -0.02 0.00 0.03 0.00 0.00 54.97 53.82 3ho8 s GLU 262 Cb 0.00 -2.62 0.04 0.00 -0.80 0.00 0.00 34.13 30.75 3ho8 s GLU 262 CO 0.00 0.12 0.10 -0.98 -1.33 0.00 0.00 175.26 173.17 3ho8 s ARG 263 N -4.05 -0.00 0.45 -4.83 1.70 0.78 -4.28 118.95 108.71 3ho8 s ARG 263 Ca 0.42 0.40 -0.25 0.00 -0.47 0.00 0.00 55.73 55.83 3ho8 s ARG 263 Cb -0.07 -0.33 -0.08 0.00 -0.57 0.00 0.00 34.95 33.90 3ho8 s ARG 263 CO 0.28 -0.26 1.36 0.34 -1.08 0.00 0.00 175.30 175.94 3ho8 s ASP 264 N 1.83 5.97 0.00 -2.89 3.68 0.21 -1.97 116.67 123.51 3ho8 s ASP 264 Ca -0.01 2.78 0.08 0.00 2.13 0.00 0.00 52.55 57.53 3ho8 s ASP 264 Cb -0.12 -2.64 0.13 0.00 -1.45 0.00 0.00 42.92 38.84 3ho8 s ASP 264 CO -0.04 -1.10 1.04 0.00 0.13 0.00 0.00 175.17 175.19 3ho8 h SER 266 N 0.31 0.12 -0.56 0.00 0.02 -1.79 -3.36 113.55 108.29 3ho8 h SER 266 Ca -0.08 -0.02 -0.36 0.00 -0.84 0.00 0.00 61.79 60.49 3ho8 h SER 266 Cb 1.54 -0.03 -0.05 0.00 0.14 0.00 0.00 62.40 64.00 3ho8 h SER 266 CO 0.03 0.21 1.13 -0.69 -1.14 0.00 0.00 176.83 176.37 3ho8 s VAL 267 N -4.87 3.59 0.05 2.27 1.01 -1.26 -3.47 120.40 117.73 3ho8 s VAL 267 Ca -0.05 -0.92 -0.01 0.00 0.00 0.00 0.00 61.98 60.99 3ho8 s VAL 267 Cb 0.16 -4.55 -0.04 0.00 0.00 0.00 0.00 36.38 31.96 3ho8 s VAL 267 CO 0.70 -1.10 -0.01 0.00 0.00 0.00 0.00 175.10 174.69 3ho8 s GLN 268 N 6.31 0.63 0.02 2.72 -2.07 -1.26 -2.27 119.66 123.75 3ho8 s GLN 268 Ca 0.67 -1.21 -0.03 0.00 -1.82 0.00 0.00 55.36 52.97 3ho8 s GLN 268 Cb -0.01 0.22 -0.01 0.00 -1.09 0.00 0.00 33.01 32.11 3ho8 s GLN 268 CO 0.10 -0.12 -0.06 2.89 -1.32 0.00 0.00 175.29 176.78 3ho8 n ARG 269 N 0.09 0.09 0.00 9.60 1.85 -1.00 -4.54 116.66 122.75 3ho8 n ARG 269 Ca -0.14 0.04 0.00 0.00 -1.00 0.00 0.00 57.85 56.75 3ho8 n ARG 269 Cb 0.61 -0.66 0.00 0.00 -1.05 0.00 0.00 32.46 31.37 3ho8 n ARG 269 CO 0.00 0.00 0.00 -2.13 -0.01 0.00 0.00 177.63 175.49 3ho8 n ARG 270 N -3.50 0.00 -0.99 2.89 0.63 -1.26 -4.89 116.66 109.54 3ho8 n ARG 270 Ca -0.05 0.00 -0.06 0.00 -0.92 0.00 0.00 57.85 56.83 3ho8 n ARG 270 Cb 0.25 0.00 0.17 0.00 0.45 0.00 0.00 32.46 33.32 3ho8 n ARG 270 CO 0.00 0.00 0.00 0.72 -2.51 0.00 0.00 177.63 175.84 3ho8 n HIS 271 N 0.00 1.11 -3.98 -0.14 8.25 -1.26 -4.98 115.22 114.22 3ho8 n HIS 271 Ca 0.00 -1.75 -0.31 0.00 -0.26 0.00 0.00 57.72 55.40 3ho8 n HIS 271 Cb 0.00 -0.43 -0.15 0.00 1.12 0.00 0.00 29.99 30.53 3ho8 n HIS 271 CO 0.00 0.00 0.00 -1.14 0.64 0.00 0.00 176.34 175.84 3ho8 s GLN 272 N -3.34 1.76 0.27 -0.41 0.74 -1.26 -5.10 119.66 112.31 3ho8 s GLN 272 Ca 0.44 -1.24 -0.30 0.00 0.05 0.00 0.00 55.36 54.32 3ho8 s GLN 272 Cb 0.40 -2.74 -0.09 0.00 1.10 0.00 0.00 33.01 31.67 3ho8 s GLN 272 CO -0.02 -0.66 1.03 0.15 -0.55 0.00 0.00 175.29 175.25 3ho8 s LYS 273 N 1.24 4.72 0.00 1.67 1.02 -1.26 -2.38 119.74 124.74 3ho8 s LYS 273 Ca -0.04 1.67 0.00 0.00 0.02 0.00 0.00 55.97 57.62 3ho8 s LYS 273 Cb -0.19 -3.21 0.00 0.00 -0.52 0.00 0.00 37.83 33.91 3ho8 s LYS 273 CO -0.07 0.33 0.00 1.33 -0.92 0.00 0.00 175.35 176.02 3ho8 n VAL 274 N 1.28 0.00 -3.83 3.17 0.24 -0.96 -5.00 118.33 113.22 3ho8 n VAL 274 Ca -0.01 0.00 -0.29 0.00 -2.04 0.00 0.00 64.34 62.00 3ho8 n VAL 274 Cb 0.46 -0.44 -0.16 0.00 -1.47 0.00 0.00 33.84 32.23 3ho8 n VAL 274 CO 0.00 0.00 0.00 -0.69 -2.14 0.00 0.00 176.83 174.00 3ho8 s VAL 275 N -1.78 1.02 -0.04 3.34 1.01 -1.09 -3.79 120.40 119.07 3ho8 s VAL 275 Ca 0.00 -0.97 -0.03 0.00 0.00 0.00 0.00 61.98 60.98 3ho8 s VAL 275 Cb 0.00 -1.46 -0.04 0.00 0.00 0.00 0.00 36.38 34.88 3ho8 s VAL 275 CO 0.00 -0.22 0.12 -1.61 0.00 0.00 0.00 175.10 173.39 3ho8 s GLU 276 N 1.62 3.27 -0.05 2.72 8.01 -1.19 -4.02 118.70 129.06 3ho8 s GLU 276 Ca -0.02 -0.34 0.03 0.00 0.01 0.00 0.00 54.97 54.65 3ho8 s GLU 276 Cb -0.18 -3.01 0.00 0.00 -4.31 0.00 0.00 34.13 26.63 3ho8 s GLU 276 CO -0.09 0.69 -0.14 0.08 0.01 0.00 0.00 175.26 175.81 3ho8 s VAL 277 N -1.18 1.20 -0.08 2.63 1.01 -0.81 -1.72 120.40 121.46 3ho8 s VAL 277 Ca 0.22 -0.56 0.02 0.00 0.00 0.00 0.00 61.98 61.66 3ho8 s VAL 277 Cb -0.12 -1.06 0.01 0.00 0.00 0.00 0.00 36.38 35.21 3ho8 s VAL 277 CO 0.12 0.36 -0.13 0.00 0.00 0.00 0.00 175.10 175.46 3ho8 s ALA 278 N 0.33 1.39 0.56 5.51 0.00 0.27 -0.61 121.76 129.20 3ho8 s ALA 278 Ca -0.08 -0.51 0.00 0.00 0.00 0.00 0.00 51.96 51.37 3ho8 s ALA 278 Cb -0.13 -0.66 0.00 0.00 0.00 0.00 0.00 23.12 22.33 3ho8 s ALA 278 CO 0.03 0.04 0.00 -0.35 0.00 0.00 0.00 175.76 175.48 3ho8 n PRO 279 N 3.98 0.71 -1.05 0.00 -0.04 -1.26 -0.07 135.00 137.26 3ho8 n PRO 279 Ca -0.21 0.00 -0.32 0.00 -0.04 0.00 0.00 63.50 62.93 3ho8 n PRO 279 Cb 0.52 0.00 0.13 0.00 -0.04 0.00 0.00 33.50 34.10 3ho8 n PRO 279 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 3ho8 s SER 280 N -1.00 3.62 -0.16 3.54 0.15 -1.26 -4.81 113.70 113.77 3ho8 s SER 280 Ca 0.00 2.21 -0.14 0.00 0.70 0.00 0.00 55.95 58.71 3ho8 s SER 280 Cb 0.00 -2.57 -0.05 0.00 -1.71 0.00 0.00 66.02 61.69 3ho8 s SER 280 CO 0.00 -2.64 -0.28 0.52 1.20 0.00 0.00 173.24 172.04 3ho8 n VAL 281 N -3.56 1.40 1.23 4.45 0.31 -1.26 -4.75 118.33 116.15 3ho8 n VAL 281 Ca 0.12 0.18 0.13 0.00 -0.01 0.00 0.00 64.34 64.76 3ho8 n VAL 281 Cb 0.51 -2.32 0.38 0.00 -0.91 0.00 0.00 33.84 31.50 3ho8 n VAL 281 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3ho8 n GLY 282 N 1.51 0.42 3.75 2.92 0.00 -1.17 -4.93 105.19 107.70 3ho8 n GLY 282 Ca -0.11 -0.52 -0.40 0.00 0.00 0.00 0.00 46.02 44.99 3ho8 n GLY 282 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3ho8 s LEU 283 N -1.87 4.56 0.34 0.99 1.43 -1.26 -5.02 118.68 117.85 3ho8 s LEU 283 Ca 0.35 1.73 -0.28 0.00 -1.03 0.00 0.00 54.13 54.90 3ho8 s LEU 283 Cb 0.20 -3.45 -0.12 0.00 0.03 0.00 0.00 46.19 42.85 3ho8 s LEU 283 CO 0.31 0.08 1.38 -1.20 0.23 0.00 0.00 176.35 177.16 3ho8 n SER 284 N 2.12 3.15 0.16 2.29 7.64 -1.26 -4.77 113.62 122.96 3ho8 n SER 284 Ca -0.02 1.20 0.12 0.00 1.01 0.00 0.00 58.87 61.18 3ho8 n SER 284 Cb 0.49 -1.53 0.59 0.00 -1.01 0.00 0.00 64.21 62.74 3ho8 n SER 284 CO 0.00 0.00 0.00 1.55 -3.01 0.00 0.00 175.04 173.58 3ho8 h PRO 285 N 3.00 0.00 0.00 1.43 0.13 -1.97 0.39 132.00 134.98 3ho8 h PRO 285 Ca -0.47 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 64.60 3ho8 h PRO 285 Cb 1.27 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.39 3ho8 h PRO 285 CO 0.65 0.00 -0.38 1.79 -0.23 0.00 0.00 178.00 179.83 3ho8 h THR 286 N 0.00 0.79 -0.49 1.56 1.35 -1.98 -2.90 112.91 111.24 3ho8 h THR 286 Ca 0.00 -1.71 0.09 0.00 -0.55 0.00 0.00 66.41 64.24 3ho8 h THR 286 Cb 0.12 1.61 -0.10 0.00 -1.73 0.00 0.00 68.15 68.04 3ho8 h THR 286 CO 0.00 0.27 -0.33 0.25 -0.25 0.00 0.00 175.52 175.46 3ho8 h LEU 287 N -1.00 -1.13 -1.30 3.87 7.12 -1.80 0.28 115.31 121.35 3ho8 h LEU 287 Ca -0.08 0.21 0.20 0.00 0.13 0.00 0.00 57.88 58.34 3ho8 h LEU 287 Cb 0.72 0.54 -0.08 0.00 -0.53 0.00 0.00 40.66 41.30 3ho8 h LEU 287 CO -0.05 -0.31 0.61 -0.09 -0.13 0.00 0.00 178.44 178.47 3ho8 h ARG 288 N -0.21 0.55 -0.06 1.25 2.43 -0.39 -2.30 114.38 115.64 3ho8 h ARG 288 Ca 0.20 -0.03 -0.17 0.00 -0.81 0.00 0.00 59.98 59.16 3ho8 h ARG 288 Cb 0.54 -0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 29.96 3ho8 h ARG 288 CO -0.60 0.36 -0.70 1.96 -1.51 0.00 0.00 179.97 179.47 3ho8 h GLN 289 N 0.56 0.31 -0.10 0.20 1.08 -0.29 -3.03 115.11 113.84 3ho8 h GLN 289 Ca 0.52 -0.25 -0.13 0.00 -1.45 0.00 0.00 58.65 57.34 3ho8 h GLN 289 Cb 1.06 0.05 -0.01 0.00 -0.05 0.00 0.00 27.48 28.53 3ho8 h GLN 289 CO -0.26 0.89 -0.52 0.00 -0.95 0.00 0.00 178.83 177.99 3ho8 h ARG 290 N 0.21 0.26 -0.13 1.46 3.08 -0.59 -1.06 114.38 117.61 3ho8 h ARG 290 Ca -0.02 -0.15 -0.02 0.00 0.07 0.00 0.00 59.98 59.85 3ho8 h ARG 290 Cb 1.26 0.01 -0.00 0.00 0.08 0.00 0.00 29.97 31.32 3ho8 h ARG 290 CO 0.11 0.72 -0.01 0.82 -1.07 0.00 0.00 179.97 180.55 3ho8 h ILE 291 N 0.21 1.26 -0.44 2.04 2.04 -1.52 -0.59 117.51 120.51 3ho8 h ILE 291 Ca 0.01 -0.85 -0.12 0.00 1.00 0.00 0.00 64.86 64.90 3ho8 h ILE 291 Cb 0.98 1.56 -0.01 0.00 -0.74 0.00 0.00 36.82 38.61 3ho8 h ILE 291 CO 0.08 0.25 -0.21 0.00 0.00 0.00 0.00 178.15 178.27 3ho8 h ASP 293 N 0.76 0.23 -0.61 0.00 3.32 -1.16 0.31 116.42 119.27 3ho8 h ASP 293 Ca 0.10 -0.01 -0.00 0.00 0.02 0.00 0.00 57.03 57.15 3ho8 h ASP 293 Cb 0.75 -0.06 -0.03 0.00 0.22 0.00 0.00 39.33 40.21 3ho8 h ASP 293 CO 0.06 0.17 0.38 0.00 -1.72 0.00 0.00 179.24 178.13 3ho8 h ALA 294 N 1.08 1.49 -0.72 3.45 0.00 -0.92 1.13 119.26 124.76 3ho8 h ALA 294 Ca 0.08 -0.07 -0.07 0.00 0.00 0.00 0.00 54.91 54.85 3ho8 h ALA 294 Cb -0.03 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 17.48 3ho8 h ALA 294 CO -0.02 0.45 0.18 0.00 0.00 0.00 0.00 179.25 179.86 3ho8 h ALA 295 N 1.56 0.95 0.04 0.00 0.00 -0.53 -1.37 119.26 119.91 3ho8 h ALA 295 Ca 0.23 -0.25 -0.23 0.00 0.00 0.00 0.00 54.91 54.66 3ho8 h ALA 295 Cb -0.03 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.46 3ho8 h ALA 295 CO -0.04 0.67 -1.04 0.82 0.00 0.00 0.00 179.25 179.66 3ho8 h ILE 296 N 1.09 1.61 -0.06 0.00 1.08 -0.42 -2.41 117.51 118.40 3ho8 h ILE 296 Ca 0.23 -3.14 0.04 0.00 -0.39 0.00 0.00 64.86 61.60 3ho8 h ILE 296 Cb 0.37 2.79 -0.06 0.00 -3.07 0.00 0.00 36.82 36.86 3ho8 h ILE 296 CO 0.00 0.90 -0.31 1.56 -0.69 0.00 0.00 178.15 179.62 3ho8 h GLN 297 N 0.04 -0.41 0.80 2.37 4.20 0.15 -2.18 115.11 120.08 3ho8 h GLN 297 Ca -0.05 0.03 -0.04 0.00 0.06 0.00 0.00 58.65 58.64 3ho8 h GLN 297 Cb 1.77 0.09 0.01 0.00 0.30 0.00 0.00 27.48 29.65 3ho8 h GLN 297 CO 0.15 -0.27 -0.38 1.25 -0.67 0.00 0.00 178.83 178.91 3ho8 h LEU 298 N -0.42 -0.91 -1.65 1.46 5.85 -1.30 -3.04 115.31 115.30 3ho8 h LEU 298 Ca 0.08 0.02 0.02 0.00 0.84 0.00 0.00 57.88 58.84 3ho8 h LEU 298 Cb 0.54 0.24 -0.02 0.00 0.37 0.00 0.00 40.66 41.78 3ho8 h LEU 298 CO -0.30 -0.58 0.27 0.24 -0.34 0.00 0.00 178.44 177.73 3ho8 h MET 299 N -1.20 0.45 0.01 1.25 2.86 -1.40 -2.04 114.93 114.86 3ho8 h MET 299 Ca -0.11 -0.03 -0.22 0.00 -2.06 0.00 0.00 59.70 57.28 3ho8 h MET 299 Cb 0.84 -0.10 -0.03 0.00 0.06 0.00 0.00 31.60 32.36 3ho8 h MET 299 CO 0.18 0.30 -1.09 1.49 1.06 0.00 0.00 176.91 178.85 3ho8 h GLU 300 N 0.47 0.02 0.00 1.72 4.81 -1.48 -2.54 114.58 117.58 3ho8 h GLU 300 Ca 0.16 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.35 3ho8 h GLU 300 Cb 0.07 0.01 0.00 0.00 0.63 0.00 0.00 28.75 29.46 3ho8 h GLU 300 CO -0.04 0.97 0.01 -1.71 -0.73 0.00 0.00 179.01 177.51 3ho8 n ASN 301 N -3.34 0.00 0.00 1.04 5.15 -0.77 -1.76 115.26 115.58 3ho8 n ASN 301 Ca -0.02 0.14 0.00 0.00 -0.60 0.00 0.00 54.58 54.09 3ho8 n ASN 301 Cb 0.96 -0.14 0.00 0.00 -0.53 0.00 0.00 39.78 40.07 3ho8 n ASN 301 CO 0.00 0.00 0.00 2.30 1.40 0.00 0.00 177.26 180.96 3ho8 n ILE 302 N -1.12 0.04 -2.29 -1.44 -5.35 -1.22 -5.03 119.36 102.95 3ho8 n ILE 302 Ca 0.00 -0.04 -0.21 0.00 -0.27 0.00 0.00 62.75 62.24 3ho8 n ILE 302 Cb 0.01 1.16 -0.02 0.00 -1.74 0.00 0.00 39.64 39.04 3ho8 n ILE 302 CO 0.00 0.00 0.00 0.29 -1.76 0.00 0.00 176.55 175.08 3ho8 n LYS 303 N -0.02 -1.67 -1.37 6.28 5.02 -0.72 -4.93 118.16 120.75 3ho8 n LYS 303 Ca 0.00 1.03 -0.39 0.00 -2.02 0.00 0.00 58.31 56.93 3ho8 n LYS 303 Cb 0.44 -5.65 0.02 0.00 -0.02 0.00 0.00 35.03 29.82 3ho8 n LYS 303 CO 0.00 0.00 0.00 0.98 -0.52 0.00 0.00 177.40 177.86 3ho8 n TYR 304 N -3.76 -1.70 -4.12 2.13 9.36 -0.96 -4.86 117.16 113.24 3ho8 n TYR 304 Ca -0.24 0.45 -0.15 0.00 3.32 0.00 0.00 57.90 61.29 3ho8 n TYR 304 Cb 0.68 -1.83 -0.14 0.00 -0.63 0.00 0.00 39.34 37.43 3ho8 n TYR 304 CO 0.00 0.00 0.00 0.08 0.22 0.00 0.00 176.86 177.16 3ho8 s VAL 305 N -1.84 0.43 0.00 2.97 1.01 -1.26 -4.37 120.40 117.34 3ho8 s VAL 305 Ca 0.63 -0.46 0.00 0.00 0.00 0.00 0.00 61.98 62.15 3ho8 s VAL 305 Cb -0.47 -0.41 0.00 0.00 0.00 0.00 0.00 36.38 35.50 3ho8 s VAL 305 CO 0.60 -0.03 0.00 -3.20 0.00 0.00 0.00 175.10 172.46 3ho8 n ASN 306 N 2.52 -0.05 -3.22 3.32 2.85 0.16 -3.81 115.26 117.04 3ho8 n ASN 306 Ca -0.16 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.31 3ho8 n ASN 306 Cb 0.57 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.59 3ho8 n ASN 306 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 3ho8 n ALA 307 N 4.89 0.00 0.00 5.20 0.00 -1.26 0.22 120.51 129.56 3ho8 n ALA 307 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 3ho8 n ALA 307 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 3ho8 n ALA 307 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3ho8 n GLY 308 N 3.91 0.72 3.53 0.00 0.00 -1.10 -4.66 105.19 107.59 3ho8 n GLY 308 Ca 0.00 -1.89 -0.01 0.00 0.00 0.00 0.00 46.02 44.12 3ho8 n GLY 308 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3ho8 s THR 309 N -1.27 -0.48 -0.33 2.61 2.01 -1.02 -3.87 115.64 113.28 3ho8 s THR 309 Ca 0.00 0.00 -0.21 0.00 0.31 0.00 0.00 61.69 61.79 3ho8 s THR 309 Cb 0.00 -1.00 -0.00 0.00 0.01 0.00 0.00 72.50 71.51 3ho8 s THR 309 CO 0.00 0.00 0.69 -0.69 -0.69 0.00 0.00 174.62 173.93 3ho8 s VAL 310 N 2.27 4.86 -0.14 3.82 1.01 -1.21 -1.81 120.40 129.20 3ho8 s VAL 310 Ca -0.05 0.83 -0.20 0.00 0.00 0.00 0.00 61.98 62.55 3ho8 s VAL 310 Cb -0.07 -4.09 -0.03 0.00 0.00 0.00 0.00 36.38 32.19 3ho8 s VAL 310 CO -0.18 -0.27 0.59 -1.61 0.00 0.00 0.00 175.10 173.63 3ho8 s GLU 311 N 2.79 4.31 0.11 2.72 2.02 0.42 -2.63 118.70 128.44 3ho8 s GLU 311 Ca 0.27 0.61 0.10 0.00 0.02 0.00 0.00 54.97 55.97 3ho8 s GLU 311 Cb -0.14 -3.50 -0.04 0.00 0.10 0.00 0.00 34.13 30.55 3ho8 s GLU 311 CO 0.14 -0.02 -0.26 -0.06 0.02 0.00 0.00 175.26 175.07 3ho8 s PHE 312 N 1.18 2.23 -0.15 1.61 0.40 0.14 -1.05 117.98 122.34 3ho8 s PHE 312 Ca 0.29 -0.39 0.00 0.00 -0.60 0.00 0.00 56.93 56.24 3ho8 s PHE 312 Cb -0.16 -1.24 -0.00 0.00 0.51 0.00 0.00 43.02 42.13 3ho8 s PHE 312 CO 0.12 0.28 -0.16 -1.17 0.70 0.00 0.00 175.22 174.99 3ho8 s LEU 313 N -1.86 2.44 -0.12 -0.37 2.96 0.36 -1.79 118.68 120.30 3ho8 s LEU 313 Ca 0.12 -0.48 0.01 0.00 -0.22 0.00 0.00 54.13 53.56 3ho8 s LEU 313 Cb -0.10 -1.55 0.02 0.00 0.50 0.00 0.00 46.19 45.06 3ho8 s LEU 313 CO 0.05 0.08 -0.13 -0.69 -1.32 0.00 0.00 176.35 174.34 3ho8 s VAL 314 N 0.81 1.40 -0.36 1.68 1.01 -0.99 -0.06 120.40 123.90 3ho8 s VAL 314 Ca -0.05 -0.56 0.01 0.00 0.00 0.00 0.00 61.98 61.37 3ho8 s VAL 314 Cb -0.15 -1.31 0.11 0.00 0.00 0.00 0.00 36.38 35.02 3ho8 s VAL 314 CO -0.00 0.43 0.13 -0.55 0.00 0.00 0.00 175.10 175.11 3ho8 s SER 315 N 1.22 4.11 0.88 3.32 0.15 -1.08 -0.90 113.70 121.41 3ho8 s SER 315 Ca -0.02 -2.08 0.00 0.00 0.70 0.00 0.00 55.95 54.55 3ho8 s SER 315 Cb -0.14 -1.12 0.00 0.00 -1.71 0.00 0.00 66.02 63.05 3ho8 s SER 315 CO -0.05 -0.36 0.00 0.61 1.20 0.00 0.00 173.24 174.64 3ho8 n GLY 317 N 4.29 1.97 0.15 9.45 0.00 -1.26 -3.78 105.19 116.00 3ho8 n GLY 317 Ca 0.02 -0.51 -0.24 0.00 0.00 0.00 0.00 46.02 45.29 3ho8 n GLY 317 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 3ho8 n ASP 318 N 8.06 1.96 -4.73 1.61 2.03 -1.26 -4.94 116.55 119.28 3ho8 n ASP 318 Ca 0.00 0.13 -0.42 0.00 0.52 0.00 0.00 54.79 55.01 3ho8 n ASP 318 Cb 0.00 -0.62 -0.02 0.00 -0.72 0.00 0.00 41.12 39.76 3ho8 n ASP 318 CO 0.00 0.00 0.00 1.21 -1.92 0.00 0.00 177.20 176.49 3ho8 n GLU 319 N -3.79 2.58 -4.07 -0.67 2.13 -1.25 -5.02 120.64 110.55 3ho8 n GLU 319 Ca -0.50 0.92 -0.08 0.00 0.66 0.00 0.00 57.16 58.16 3ho8 n GLU 319 Cb 0.92 -2.68 -0.10 0.00 0.27 0.00 0.00 31.44 29.85 3ho8 n GLU 319 CO 0.00 0.00 0.00 -0.59 -0.41 0.00 0.00 177.13 176.13 3ho8 s PHE 320 N -0.02 0.52 0.06 4.31 -0.71 -1.26 -2.62 117.98 118.25 3ho8 s PHE 320 Ca 0.65 -0.87 0.02 0.00 -1.04 0.00 0.00 56.93 55.68 3ho8 s PHE 320 Cb -0.52 -0.36 -0.03 0.00 -1.21 0.00 0.00 43.02 40.90 3ho8 s PHE 320 CO 0.49 -0.28 -0.07 -0.06 -1.34 0.00 0.00 175.22 173.96 3ho8 s PHE 321 N -3.09 0.70 -0.11 3.49 0.40 0.92 -4.75 117.98 115.54 3ho8 s PHE 321 Ca 0.01 -0.67 -0.22 0.00 -0.60 0.00 0.00 56.93 55.45 3ho8 s PHE 321 Cb 0.02 -0.42 -0.03 0.00 0.51 0.00 0.00 43.02 43.09 3ho8 s PHE 321 CO -0.06 -0.13 0.64 0.12 0.70 0.00 0.00 175.22 176.48 3ho8 s PHE 322 N -2.24 3.52 0.00 0.36 2.19 0.23 -0.48 117.98 121.55 3ho8 s PHE 322 Ca -0.03 1.10 0.00 0.00 0.33 0.00 0.00 56.93 58.33 3ho8 s PHE 322 Cb -0.04 -2.75 0.00 0.00 -1.31 0.00 0.00 43.02 38.92 3ho8 s PHE 322 CO -0.02 0.05 0.00 -0.89 1.83 0.00 0.00 175.22 176.19 3ho8 n ILE 323 N 3.96 0.00 -3.90 3.12 2.08 -0.22 -4.53 119.36 119.87 3ho8 n ILE 323 Ca -0.02 0.42 -0.09 0.00 0.56 0.00 0.00 62.75 63.62 3ho8 n ILE 323 Cb 0.51 -1.37 -0.02 0.00 -0.75 0.00 0.00 39.64 38.01 3ho8 n ILE 323 CO 0.00 0.00 0.00 -1.83 0.56 0.00 0.00 176.55 175.28 3ho8 s GLU 324 N -0.85 1.86 -0.22 0.38 -1.05 -1.21 -4.93 118.70 112.68 3ho8 s GLU 324 Ca 0.00 -1.22 -0.01 0.00 -0.15 0.00 0.00 54.97 53.58 3ho8 s GLU 324 Cb 0.00 0.57 0.06 0.00 -0.44 0.00 0.00 34.13 34.32 3ho8 s GLU 324 CO 0.00 -0.84 0.01 0.08 0.95 0.00 0.00 175.26 175.46 3ho8 s VAL 325 N -3.46 0.89 -0.46 1.83 1.01 -1.26 -0.44 120.40 118.51 3ho8 s VAL 325 Ca 0.16 -0.85 -0.16 0.00 0.00 0.00 0.00 61.98 61.13 3ho8 s VAL 325 Cb -0.04 -1.34 0.06 0.00 0.00 0.00 0.00 36.38 35.06 3ho8 s VAL 325 CO 0.10 -0.21 0.40 0.54 0.00 0.00 0.00 175.10 175.92 3ho8 s ASN 326 N 1.68 6.15 -1.45 3.32 4.22 -0.75 -4.81 114.94 123.30 3ho8 s ASN 326 Ca -0.02 -1.17 -0.08 0.00 -2.14 0.00 0.00 52.86 49.45 3ho8 s ASN 326 Cb -0.18 -2.19 0.04 0.00 1.28 0.00 0.00 41.25 40.20 3ho8 s ASN 326 CO -0.09 -0.62 2.58 -0.81 -2.04 0.00 0.00 177.10 176.12 3ho8 n PRO 327 N 5.30 4.10 -3.91 3.55 -0.04 -1.26 -2.43 135.00 140.31 3ho8 n PRO 327 Ca -0.11 -2.92 0.00 0.00 -0.04 0.00 0.00 63.50 60.43 3ho8 n PRO 327 Cb 0.45 -2.75 0.01 0.00 -0.04 0.00 0.00 33.50 31.17 3ho8 n PRO 327 CO 0.00 0.00 0.00 -0.98 -0.04 0.00 0.00 175.50 174.48 3ho8 s ARG 328 N 0.47 0.73 0.62 0.54 1.04 -1.26 -4.51 118.95 116.57 3ho8 s ARG 328 Ca 0.59 -0.46 -0.17 0.00 -1.04 0.00 0.00 55.73 54.64 3ho8 s ARG 328 Cb 0.18 0.21 -0.02 0.00 -2.04 0.00 0.00 34.95 33.27 3ho8 s ARG 328 CO -0.07 -0.34 1.16 0.14 -0.04 0.00 0.00 175.30 176.14 3ho8 s VAL 329 N -2.15 2.89 0.31 4.99 -7.23 -1.26 -3.87 120.40 114.08 3ho8 s VAL 329 Ca 0.25 0.50 0.10 0.00 -1.81 0.00 0.00 61.98 61.02 3ho8 s VAL 329 Cb -0.01 -3.11 -0.05 0.00 0.56 0.00 0.00 36.38 33.77 3ho8 s VAL 329 CO 0.01 -0.18 -0.07 -1.10 -0.31 0.00 0.00 175.10 173.46 3ho8 s GLN 330 N -3.61 1.96 0.28 4.82 -0.21 -1.26 -4.44 119.66 117.19 3ho8 s GLN 330 Ca 0.73 -1.74 0.01 0.00 0.02 0.00 0.00 55.36 54.38 3ho8 s GLN 330 Cb -0.26 -1.88 0.56 0.00 1.00 0.00 0.00 33.01 32.44 3ho8 s GLN 330 CO 0.35 0.23 1.80 0.28 -2.12 0.00 0.00 175.29 175.83 3ho8 h VAL 331 N 1.99 0.82 -0.28 1.09 2.07 -2.00 -2.92 116.25 117.01 3ho8 h VAL 331 Ca -0.42 -0.28 0.00 0.00 0.82 0.00 0.00 66.70 66.82 3ho8 h VAL 331 Cb 1.25 -0.07 0.00 0.00 -1.52 0.00 0.00 31.29 30.95 3ho8 h VAL 331 CO 0.65 0.15 0.00 -1.84 0.02 0.00 0.00 177.57 176.55 3ho8 n GLU 332 N -4.73 1.96 0.15 1.57 0.00 -1.26 -4.14 120.64 114.19 3ho8 n GLU 332 Ca 0.19 -1.14 0.03 0.00 0.00 0.00 0.00 57.16 56.23 3ho8 n GLU 332 Cb 0.41 -1.40 0.39 0.00 0.00 0.00 0.00 31.44 30.84 3ho8 n GLU 332 CO 0.00 0.00 0.00 1.12 0.00 0.00 0.00 177.13 178.25 3ho8 h HIS 333 N 1.72 0.14 -0.96 -1.84 2.07 -1.94 -3.15 115.15 111.20 3ho8 h HIS 333 Ca 0.00 -0.02 0.30 0.00 -2.85 0.00 0.00 60.37 57.80 3ho8 h HIS 333 Cb 0.61 -0.04 -0.16 0.00 2.57 0.00 0.00 27.41 30.39 3ho8 h HIS 333 CO 0.27 0.35 0.36 1.79 -3.07 0.00 0.00 177.93 177.63 3ho8 h THR 334 N 0.13 0.19 -0.41 6.12 1.35 -1.84 0.97 112.91 119.41 3ho8 h THR 334 Ca 0.02 -0.06 -0.11 0.00 -0.55 0.00 0.00 66.41 65.71 3ho8 h THR 334 Cb 0.46 0.02 -0.01 0.00 -1.73 0.00 0.00 68.15 66.88 3ho8 h THR 334 CO 0.03 0.03 -0.21 -0.29 -0.25 0.00 0.00 175.52 174.84 3ho8 h ILE 335 N 0.16 1.27 -0.32 6.82 2.10 -1.89 -2.86 117.51 122.79 3ho8 h ILE 335 Ca 0.67 -1.32 -0.16 0.00 1.08 0.00 0.00 64.86 65.13 3ho8 h ILE 335 Cb 1.53 1.17 -0.00 0.00 -1.09 0.00 0.00 36.82 38.43 3ho8 h ILE 335 CO -0.71 0.44 -0.43 0.74 -1.08 0.00 0.00 178.15 177.12 3ho8 h THR 336 N 0.70 1.28 -0.44 2.19 2.02 -1.00 -2.93 112.91 114.73 3ho8 h THR 336 Ca 0.10 -1.61 0.09 0.00 0.77 0.00 0.00 66.41 65.76 3ho8 h THR 336 Cb 0.72 1.55 -0.10 0.00 -1.74 0.00 0.00 68.15 68.58 3ho8 h THR 336 CO 0.06 0.53 -0.27 -0.33 0.37 0.00 0.00 175.52 175.87 3ho8 h GLU 337 N 0.63 -0.18 0.35 6.66 5.08 -1.22 -2.26 114.58 123.64 3ho8 h GLU 337 Ca 0.04 0.01 -0.01 0.00 -1.00 0.00 0.00 59.36 58.40 3ho8 h GLU 337 Cb 1.02 0.04 -0.00 0.00 0.50 0.00 0.00 28.75 30.31 3ho8 h GLU 337 CO 0.10 -0.12 -0.21 0.52 -1.00 0.00 0.00 179.01 178.31 3ho8 h MET 338 N -0.18 -0.51 0.00 2.33 2.86 -1.41 0.52 114.93 118.54 3ho8 h MET 338 Ca 0.20 0.03 -0.01 0.00 -2.06 0.00 0.00 59.70 57.86 3ho8 h MET 338 Cb 0.51 0.12 -0.00 0.00 0.06 0.00 0.00 31.60 32.28 3ho8 h MET 338 CO -0.55 -0.34 -0.07 -0.39 1.06 0.00 0.00 176.91 176.62 3ho8 h VAL 339 N -0.53 0.96 0.00 -2.22 -1.51 -1.33 -3.24 116.25 108.37 3ho8 h VAL 339 Ca -0.04 -0.24 0.00 0.00 -1.23 0.00 0.00 66.70 65.19 3ho8 h VAL 339 Cb 0.43 1.13 0.00 0.00 -2.13 0.00 0.00 31.29 30.73 3ho8 h VAL 339 CO 0.04 0.07 -1.24 0.35 -1.23 0.00 0.00 177.57 175.56 3ho8 n THR 340 N -4.32 0.00 -1.08 7.19 -2.24 -0.87 -1.26 114.28 111.70 3ho8 n THR 340 Ca -0.03 -0.20 -0.03 0.00 -2.27 0.00 0.00 64.05 61.52 3ho8 n THR 340 Cb 0.15 0.41 -0.01 0.00 -2.10 0.00 0.00 70.33 68.77 3ho8 n THR 340 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3ho8 n GLY 341 N 1.92 0.59 3.79 3.38 0.00 0.18 -4.90 105.19 110.16 3ho8 n GLY 341 Ca -0.01 -0.86 -0.36 0.00 0.00 0.00 0.00 46.02 44.79 3ho8 n GLY 341 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3ho8 s ILE 342 N -2.09 5.44 -0.75 -0.61 1.09 -1.22 -5.05 121.20 118.00 3ho8 s ILE 342 Ca 0.00 0.23 -0.24 0.00 -1.10 0.00 0.00 60.65 59.54 3ho8 s ILE 342 Cb 0.00 -3.46 0.05 0.00 -1.06 0.00 0.00 42.46 38.00 3ho8 s ILE 342 CO 0.00 0.51 1.17 -0.62 -0.10 0.00 0.00 174.94 175.90 3ho8 s ASP 343 N -0.23 6.23 0.19 3.58 3.68 -1.26 -4.42 116.67 124.44 3ho8 s ASP 343 Ca 0.12 -0.86 -0.10 0.00 2.13 0.00 0.00 52.55 53.84 3ho8 s ASP 343 Cb -0.12 -2.50 0.10 0.00 -1.45 0.00 0.00 42.92 38.95 3ho8 s ASP 343 CO 0.01 -1.61 1.70 0.40 0.13 0.00 0.00 175.17 175.81 3ho8 h ILE 344 N 6.08 1.26 0.17 4.11 2.04 -1.96 -1.84 117.51 127.36 3ho8 h ILE 344 Ca -0.20 -0.94 -0.29 0.00 1.00 0.00 0.00 64.86 64.43 3ho8 h ILE 344 Cb 1.05 0.60 0.01 0.00 -0.74 0.00 0.00 36.82 37.74 3ho8 h ILE 344 CO 1.25 0.36 -1.32 0.58 0.00 0.00 0.00 178.15 179.01 3ho8 h VAL 345 N 0.98 1.42 -0.84 1.67 2.07 -1.98 -1.89 116.25 117.69 3ho8 h VAL 345 Ca 0.21 -2.95 -0.01 0.00 0.82 0.00 0.00 66.70 64.76 3ho8 h VAL 345 Cb 0.36 2.97 -0.04 0.00 -1.52 0.00 0.00 31.29 33.06 3ho8 h VAL 345 CO 0.00 0.87 0.48 0.50 0.02 0.00 0.00 177.57 179.44 3ho8 h LYS 346 N 0.10 1.16 -0.46 1.57 3.64 -1.92 -2.90 116.57 117.77 3ho8 h LYS 346 Ca -0.17 -0.12 -0.13 0.00 -1.27 0.00 0.00 60.65 58.95 3ho8 h LYS 346 Cb 2.03 -0.23 -0.01 0.00 -0.41 0.00 0.00 32.23 33.61 3ho8 h LYS 346 CO 0.22 0.84 -0.22 1.15 -2.27 0.00 0.00 179.45 179.17 3ho8 h THR 347 N 1.18 1.27 -0.83 1.00 2.02 -1.25 -0.38 112.91 115.92 3ho8 h THR 347 Ca 0.30 -1.39 0.18 0.00 0.77 0.00 0.00 66.41 66.28 3ho8 h THR 347 Cb 0.00 1.17 -0.11 0.00 -1.74 0.00 0.00 68.15 67.47 3ho8 h THR 347 CO -0.05 0.48 0.34 1.56 0.37 0.00 0.00 175.52 178.21 3ho8 h GLN 348 N 0.81 0.40 0.30 6.66 4.20 -1.20 0.61 115.11 126.89 3ho8 h GLN 348 Ca 0.10 -0.02 -0.01 0.00 0.06 0.00 0.00 58.65 58.77 3ho8 h GLN 348 Cb 0.80 -0.09 0.00 0.00 0.30 0.00 0.00 27.48 28.50 3ho8 h GLN 348 CO 0.07 0.26 -0.15 0.82 -0.67 0.00 0.00 178.83 179.17 3ho8 h ILE 349 N 0.41 0.00 -0.55 2.54 2.04 -1.26 -2.21 117.51 118.48 3ho8 h ILE 349 Ca 0.49 -0.38 0.13 0.00 1.00 0.00 0.00 64.86 66.10 3ho8 h ILE 349 Cb 0.85 0.00 -0.03 0.00 -0.74 0.00 0.00 36.82 36.90 3ho8 h ILE 349 CO -0.48 0.00 0.38 -0.07 0.00 0.00 0.00 178.15 177.98 3ho8 h LEU 350 N -0.79 0.17 -0.46 1.44 3.38 -0.93 0.17 115.31 118.29 3ho8 h LEU 350 Ca -0.04 0.01 -0.14 0.00 0.09 0.00 0.00 57.88 57.79 3ho8 h LEU 350 Cb 0.31 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.02 3ho8 h LEU 350 CO 0.07 0.09 -0.26 0.58 0.09 0.00 0.00 178.44 179.01 3ho8 h VAL 351 N 0.18 1.27 -0.28 1.22 2.07 0.14 -1.68 116.25 119.17 3ho8 h VAL 351 Ca 0.26 -1.43 -0.08 0.00 0.82 0.00 0.00 66.70 66.27 3ho8 h VAL 351 Cb 0.80 1.19 -0.02 0.00 -1.52 0.00 0.00 31.29 31.74 3ho8 h VAL 351 CO -0.04 0.49 -0.17 0.00 0.02 0.00 0.00 177.57 177.87 3ho8 h ALA 352 N 0.84 1.20 0.00 1.67 0.00 -0.08 -0.42 119.26 122.47 3ho8 h ALA 352 Ca 0.10 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.71 3ho8 h ALA 352 Cb 0.85 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.51 3ho8 h ALA 352 CO 0.08 0.52 0.00 0.00 0.00 0.00 0.00 179.25 179.84 3ho8 n ALA 353 N -2.48 2.38 -1.53 0.00 0.00 -0.17 -4.90 120.51 113.80 3ho8 n ALA 353 Ca 0.00 -0.04 -0.01 0.00 0.00 0.00 0.00 53.44 53.40 3ho8 n ALA 353 Cb 0.35 -1.10 -0.00 0.00 0.00 0.00 0.00 19.45 18.70 3ho8 n ALA 353 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3ho8 n GLY 354 N 0.43 0.38 3.81 0.00 0.00 -0.16 -5.02 105.19 104.63 3ho8 n GLY 354 Ca 0.05 -0.96 -0.36 0.00 0.00 0.00 0.00 46.02 44.75 3ho8 n GLY 354 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ho8 s ALA 355 N -2.03 3.32 0.10 4.61 0.00 -0.65 -4.96 121.76 122.16 3ho8 s ALA 355 Ca 0.00 0.25 -0.31 0.00 0.00 0.00 0.00 51.96 51.90 3ho8 s ALA 355 Cb 0.00 -2.93 -0.09 0.00 0.00 0.00 0.00 23.12 20.10 3ho8 s ALA 355 CO 0.00 0.28 1.64 0.34 0.00 0.00 0.00 175.76 178.02 3ho8 s ASP 356 N -1.76 6.58 0.33 0.00 3.68 -1.26 -4.64 116.67 119.60 3ho8 s ASP 356 Ca 0.48 2.54 0.09 0.00 2.13 0.00 0.00 52.55 57.79 3ho8 s ASP 356 Cb -0.16 -2.57 0.84 0.00 -1.45 0.00 0.00 42.92 39.58 3ho8 s ASP 356 CO 0.21 -0.88 1.79 -0.07 0.13 0.00 0.00 175.17 176.35 3ho8 h LEU 357 N 8.08 0.68 -2.46 -1.34 3.38 -1.96 -1.85 115.31 119.84 3ho8 h LEU 357 Ca -0.43 0.08 0.00 0.00 0.09 0.00 0.00 57.88 57.62 3ho8 h LEU 357 Cb 1.20 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.91 3ho8 h LEU 357 CO 0.93 0.24 0.00 0.49 0.09 0.00 0.00 178.44 180.19 3ho8 n PHE 357 N -4.70 0.59 -2.11 1.13 3.01 -1.26 0.32 117.46 114.44 3ho8 n PHE 357 Ca 0.23 -0.34 -0.27 0.00 1.01 0.00 0.00 57.45 58.08 3ho8 n PHE 357 Cb 0.62 -0.00 0.08 0.00 -0.01 0.00 0.00 39.48 40.17 3ho8 n PHE 357 CO 0.00 0.00 0.00 0.20 1.01 0.00 0.00 176.76 177.97 3ho8 s GLY 357 N -1.24 1.67 0.62 1.37 0.00 -0.70 -4.76 107.32 104.28 3ho8 s GLY 357 Ca 0.37 -0.90 0.36 0.00 0.00 0.00 0.00 44.72 44.56 3ho8 s GLY 357 CO 0.29 -0.44 2.28 0.83 0.00 0.00 0.00 173.10 176.06 3ho8 h GLU 358 N -0.79 0.00 0.24 2.90 4.39 -1.92 0.13 114.58 119.52 3ho8 h GLU 358 Ca -0.45 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.24 3ho8 h GLU 358 Cb 1.31 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.97 3ho8 h GLU 358 CO 0.60 0.01 -0.11 0.93 -1.16 0.00 0.00 179.01 179.27 3ho8 h GLU 359 N 0.00 -0.31 -0.09 2.33 3.07 -1.94 -3.37 114.58 114.27 3ho8 h GLU 359 Ca -0.00 0.02 -0.16 0.00 -0.50 0.00 0.00 59.36 58.73 3ho8 h GLU 359 Cb 0.05 0.07 0.01 0.00 -0.84 0.00 0.00 28.75 28.04 3ho8 h GLU 359 CO 0.00 -0.20 -0.55 0.82 -1.40 0.00 0.00 179.01 177.68 3ho8 h ILE 360 N -0.88 1.36 -6.34 3.13 2.04 -1.75 -3.48 117.51 111.60 3ho8 h ILE 360 Ca -0.03 -1.88 -0.48 0.00 1.00 0.00 0.00 64.86 63.47 3ho8 h ILE 360 Cb 0.24 2.23 -0.05 0.00 -0.74 0.00 0.00 36.82 38.51 3ho8 h ILE 360 CO 0.05 0.56 -0.78 -3.20 0.00 0.00 0.00 178.15 174.79 3ho8 n ASN 361 N -4.20 -3.97 -4.73 1.72 5.15 0.44 -4.93 115.26 104.73 3ho8 n ASN 361 Ca -0.08 -0.82 -0.38 0.00 -0.60 0.00 0.00 54.58 52.69 3ho8 n ASN 361 Cb 0.63 -3.73 0.05 0.00 -0.53 0.00 0.00 39.78 36.19 3ho8 n ASN 361 CO 0.00 0.00 0.00 0.23 1.40 0.00 0.00 177.26 178.89 3ho8 n MET 362 N -4.59 1.54 -2.47 1.20 2.81 0.15 -4.97 117.12 110.79 3ho8 n MET 362 Ca -0.01 0.57 -0.36 0.00 -1.81 0.00 0.00 57.70 56.09 3ho8 n MET 362 Cb 0.55 -2.54 -0.03 0.00 -0.71 0.00 0.00 33.22 30.49 3ho8 n MET 362 CO 0.00 0.00 0.00 -2.14 1.51 0.00 0.00 175.97 175.34 3ho8 s PRO 362 N -2.95 3.99 0.51 0.03 0.02 -1.26 -4.63 135.00 130.71 3ho8 s PRO 362 Ca 0.74 1.55 -0.21 0.00 0.02 0.00 0.00 61.00 63.10 3ho8 s PRO 362 Cb -0.41 -2.42 -0.09 0.00 0.02 0.00 0.00 34.50 31.60 3ho8 s PRO 362 CO 0.47 -0.30 0.81 0.94 -0.33 0.00 0.00 177.00 178.59 3ho8 n GLN 363 N -0.34 0.91 -0.23 5.54 -0.06 -1.26 -4.68 117.38 117.24 3ho8 n GLN 363 Ca 0.06 0.34 0.03 0.00 -2.00 0.00 0.00 57.00 55.43 3ho8 n GLN 363 Cb 0.50 -1.92 0.15 0.00 -4.06 0.00 0.00 30.24 24.91 3ho8 n GLN 363 CO 0.00 0.00 0.00 0.37 -0.20 0.00 0.00 177.06 177.23 3ho8 h GLN 364 N 0.82 0.41 -2.91 3.69 5.75 -1.94 -2.11 115.11 118.82 3ho8 h GLN 364 Ca -0.45 -0.02 -0.36 0.00 -0.15 0.00 0.00 58.65 57.66 3ho8 h GLN 364 Cb 1.37 -0.09 -0.00 0.00 1.07 0.00 0.00 27.48 29.82 3ho8 h GLN 364 CO 0.52 0.27 1.93 1.63 -2.65 0.00 0.00 178.83 180.53 3ho8 n LYS 365 N -5.01 2.25 0.00 1.69 5.02 -1.26 -2.26 118.16 118.60 3ho8 n LYS 365 Ca 0.12 -1.38 0.00 0.00 -2.02 0.00 0.00 58.31 55.03 3ho8 n LYS 365 Cb 0.35 -2.32 0.00 0.00 -0.02 0.00 0.00 35.03 33.04 3ho8 n LYS 365 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 3ho8 n ASP 366 N 3.49 0.00 -4.71 4.39 9.92 -0.80 -5.11 116.55 123.72 3ho8 n ASP 366 Ca 0.48 0.00 -0.42 0.00 -0.53 0.00 0.00 54.79 54.32 3ho8 n ASP 366 Cb 0.35 0.00 -0.03 0.00 -0.64 0.00 0.00 41.12 40.80 3ho8 n ASP 366 CO 0.00 0.00 0.00 -0.63 0.13 0.00 0.00 177.20 176.70 3ho8 s ILE 367 N -0.79 3.46 0.30 0.53 1.01 -0.96 -4.99 121.20 119.77 3ho8 s ILE 367 Ca 0.00 1.02 0.01 0.00 0.00 0.00 0.00 60.65 61.68 3ho8 s ILE 367 Cb 0.00 -3.65 -0.00 0.00 0.01 0.00 0.00 42.46 38.81 3ho8 s ILE 367 CO 0.00 0.06 0.37 1.07 0.00 0.00 0.00 174.94 176.44 3ho8 n THR 368 N 4.08 0.00 -4.73 2.92 5.66 -1.26 -5.05 114.28 115.90 3ho8 n THR 368 Ca 0.11 -1.79 -0.33 0.00 -3.05 0.00 0.00 64.05 58.99 3ho8 n THR 368 Cb 0.43 1.01 -0.12 0.00 -1.55 0.00 0.00 70.33 70.10 3ho8 n THR 368 CO 0.00 0.00 0.00 0.42 -3.05 0.00 0.00 175.07 172.44 3ho8 s THR 369 N -2.93 3.41 -0.25 1.09 -4.23 -1.26 -4.40 115.64 107.07 3ho8 s THR 369 Ca 0.29 -0.58 -0.05 0.00 -1.18 0.00 0.00 61.69 60.17 3ho8 s THR 369 Cb 0.00 -2.38 -0.00 0.00 1.34 0.00 0.00 72.50 71.45 3ho8 s THR 369 CO 0.21 0.58 0.02 -0.22 -0.54 0.00 0.00 174.62 174.67 3ho8 s LEU 370 N -0.62 3.35 0.00 4.79 2.96 -0.39 -5.04 118.68 123.74 3ho8 s LEU 370 Ca 0.09 -0.50 0.00 0.00 -0.22 0.00 0.00 54.13 53.50 3ho8 s LEU 370 Cb -0.11 -1.82 0.00 0.00 0.50 0.00 0.00 46.19 44.76 3ho8 s LEU 370 CO 0.02 -0.09 0.00 0.61 -1.32 0.00 0.00 176.35 175.57 3ho8 n GLY 371 N 4.83 0.94 3.21 7.98 0.00 -1.26 -4.67 105.19 116.22 3ho8 n GLY 371 Ca -0.16 -0.69 -0.13 0.00 0.00 0.00 0.00 46.02 45.03 3ho8 n GLY 371 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3ho8 s TYR 372 N 0.00 1.13 0.00 1.61 1.51 -0.16 -4.49 117.35 116.95 3ho8 s TYR 372 Ca 0.00 -0.76 -0.05 0.00 -1.01 0.00 0.00 57.07 55.25 3ho8 s TYR 372 Cb 0.00 -0.60 -0.00 0.00 -0.11 0.00 0.00 41.96 41.25 3ho8 s TYR 372 CO 0.00 0.01 0.09 0.00 -1.11 0.00 0.00 175.55 174.54 3ho8 s ALA 373 N -3.14 -0.19 0.02 3.71 0.00 0.91 -2.18 121.76 120.87 3ho8 s ALA 373 Ca 0.12 -0.20 0.02 0.00 0.00 0.00 0.00 51.96 51.91 3ho8 s ALA 373 Cb 0.02 0.08 -0.01 0.00 0.00 0.00 0.00 23.12 23.20 3ho8 s ALA 373 CO -0.01 -0.17 -0.07 0.42 0.00 0.00 0.00 175.76 175.93 3ho8 s ILE 374 N -1.19 0.53 -0.11 0.00 1.01 -0.20 -0.57 121.20 120.68 3ho8 s ILE 374 Ca -0.13 -0.61 0.00 0.00 0.00 0.00 0.00 60.65 59.91 3ho8 s ILE 374 Cb -0.07 -0.51 0.02 0.00 0.01 0.00 0.00 42.46 41.91 3ho8 s ILE 374 CO 0.01 -0.07 -0.10 -1.58 0.00 0.00 0.00 174.94 173.20 3ho8 s GLN 375 N -0.74 1.73 -0.37 2.79 0.74 -0.70 -0.86 119.66 122.24 3ho8 s GLN 375 Ca -0.02 -0.35 -0.01 0.00 0.05 0.00 0.00 55.36 55.03 3ho8 s GLN 375 Cb -0.05 -1.67 0.10 0.00 1.10 0.00 0.00 33.01 32.49 3ho8 s GLN 375 CO 0.00 -0.20 0.13 0.00 -0.55 0.00 0.00 175.29 174.67 3ho8 s ARG 377 N 1.11 3.38 -0.28 0.00 1.70 -1.25 -2.95 118.95 120.66 3ho8 s ARG 377 Ca 0.06 1.17 -0.29 0.00 -0.47 0.00 0.00 55.73 56.20 3ho8 s ARG 377 Cb -0.21 -4.14 0.00 0.00 -0.57 0.00 0.00 34.95 30.03 3ho8 s ARG 377 CO -0.05 -1.80 1.22 0.42 -1.08 0.00 0.00 175.30 174.02 3ho8 s ILE 378 N 6.44 4.28 0.40 4.99 1.01 0.37 -4.98 121.20 133.71 3ho8 s ILE 378 Ca 0.71 1.48 0.02 0.00 0.00 0.00 0.00 60.65 62.85 3ho8 s ILE 378 Cb -0.18 -4.21 0.02 0.00 0.01 0.00 0.00 42.46 38.10 3ho8 s ILE 378 CO 0.32 -0.41 0.13 0.35 0.00 0.00 0.00 174.94 175.33 3ho8 n THR 379 N 5.95 0.00 -0.71 2.92 -2.24 -1.26 -1.04 114.28 117.91 3ho8 n THR 379 Ca 0.14 -1.78 0.08 0.00 -2.27 0.00 0.00 64.05 60.21 3ho8 n THR 379 Cb 0.46 0.17 0.27 0.00 -2.10 0.00 0.00 70.33 69.13 3ho8 n THR 379 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 3ho8 n THR 380 N -1.18 1.92 -2.01 4.28 -2.24 -0.67 -2.53 114.28 111.85 3ho8 n THR 380 Ca -0.10 -1.48 -0.41 0.00 -2.27 0.00 0.00 64.05 59.78 3ho8 n THR 380 Cb 0.49 0.01 -0.02 0.00 -2.10 0.00 0.00 70.33 68.71 3ho8 n THR 380 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 3ho8 s GLU 381 N -2.17 4.26 -0.67 -0.78 2.02 -1.26 -0.56 118.70 119.54 3ho8 s GLU 381 Ca 0.40 2.30 -0.16 0.00 0.02 0.00 0.00 54.97 57.53 3ho8 s GLU 381 Cb 0.29 -3.12 0.16 0.00 0.10 0.00 0.00 34.13 31.55 3ho8 s GLU 381 CO 0.14 -0.45 0.67 0.34 0.02 0.00 0.00 175.26 175.98 3ho8 s ASP 382 N 0.53 6.42 0.14 -0.19 2.15 -0.48 -2.85 116.67 122.39 3ho8 s ASP 382 Ca 0.61 -2.05 0.15 0.00 0.43 0.00 0.00 52.55 51.69 3ho8 s ASP 382 Cb -0.42 -2.24 0.69 0.00 -0.30 0.00 0.00 42.92 40.65 3ho8 s ASP 382 CO 0.41 -0.82 1.46 -2.65 -0.17 0.00 0.00 175.17 173.39 3ho8 n PRO 383 N 5.11 0.08 0.10 4.34 -0.02 -1.26 -0.08 135.00 143.27 3ho8 n PRO 383 Ca -0.01 0.45 0.12 0.00 -2.02 0.00 0.00 63.50 62.05 3ho8 n PRO 383 Cb 0.43 -1.71 0.26 0.00 -0.02 0.00 0.00 33.50 32.46 3ho8 n PRO 383 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 3ho8 h LEU 384 N 0.00 0.00 -5.87 2.45 5.85 -1.95 -3.37 115.31 112.42 3ho8 h LEU 384 Ca 0.00 -0.08 -0.56 0.00 0.84 0.00 0.00 57.88 58.08 3ho8 h LEU 384 Cb 0.15 0.00 -0.41 0.00 0.37 0.00 0.00 40.66 40.78 3ho8 h LEU 384 CO 0.00 0.04 -0.88 -3.20 -0.34 0.00 0.00 178.44 174.06 3ho8 n ASN 385 N -2.35 2.35 -4.21 1.25 2.85 0.88 -4.96 115.26 111.09 3ho8 n ASN 385 Ca 0.04 -3.21 -0.33 0.00 -0.11 0.00 0.00 54.58 50.97 3ho8 n ASN 385 Cb 0.46 -0.62 -0.05 0.00 1.24 0.00 0.00 39.78 40.80 3ho8 n ASN 385 CO 0.00 0.00 0.00 -0.67 -2.11 0.00 0.00 177.26 174.48 3ho8 n ASP 386 N 0.58 -1.19 -3.34 1.20 2.03 -1.23 -1.38 116.55 113.22 3ho8 n ASP 386 Ca 0.27 -1.10 -0.20 0.00 0.52 0.00 0.00 54.79 54.27 3ho8 n ASP 386 Cb 0.49 -2.42 -0.02 0.00 -0.72 0.00 0.00 41.12 38.45 3ho8 n ASP 386 CO 0.00 0.00 0.00 0.49 -1.92 0.00 0.00 177.20 175.77 3ho8 n PHE 387 N -4.39 -1.67 -1.68 -0.67 3.72 -0.86 -4.86 117.46 107.04 3ho8 n PHE 387 Ca -0.13 0.35 -0.48 0.00 -0.05 0.00 0.00 57.45 57.14 3ho8 n PHE 387 Cb 0.59 -2.09 -0.05 0.00 -0.94 0.00 0.00 39.48 37.00 3ho8 n PHE 387 CO 0.00 0.00 0.00 -0.12 -0.05 0.00 0.00 176.76 176.59 3ho8 n MET 388 N -3.38 2.08 -1.83 -1.08 0.00 -0.48 -4.38 117.12 108.05 3ho8 n MET 388 Ca 0.01 0.76 -0.42 0.00 -0.00 0.00 0.00 57.70 58.05 3ho8 n MET 388 Cb 0.51 -2.57 -0.03 0.00 0.00 0.00 0.00 33.22 31.13 3ho8 n MET 388 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 175.97 174.72 3ho8 s PRO 389 N 3.12 4.16 0.33 2.12 0.04 -1.26 -1.38 135.00 142.13 3ho8 s PRO 389 Ca 0.89 2.42 -0.17 0.00 0.04 0.00 0.00 61.00 64.18 3ho8 s PRO 389 Cb -0.72 -4.08 -0.09 0.00 0.04 0.00 0.00 34.50 29.65 3ho8 s PRO 389 CO 0.49 -0.90 0.78 0.34 0.04 0.00 0.00 177.00 177.74 3ho8 s ASP 390 N 3.93 6.84 0.03 6.66 -1.08 0.28 -4.95 116.67 128.37 3ho8 s ASP 390 Ca 0.81 1.37 0.03 0.00 -0.52 0.00 0.00 52.55 54.25 3ho8 s ASP 390 Cb -0.38 -2.41 -0.02 0.00 -1.46 0.00 0.00 42.92 38.65 3ho8 s ASP 390 CO 0.36 -0.21 -0.09 -0.89 0.52 0.00 0.00 175.17 174.86 3ho8 s THR 391 N -1.97 0.71 -2.31 1.71 2.01 -1.26 -4.84 115.64 109.69 3ho8 s THR 391 Ca 0.54 -0.79 0.00 0.00 0.31 0.00 0.00 61.69 61.76 3ho8 s THR 391 Cb -0.11 -0.68 0.00 0.00 0.01 0.00 0.00 72.50 71.73 3ho8 s THR 391 CO 0.17 -0.08 0.00 0.61 -0.69 0.00 0.00 174.62 174.63 3ho8 n GLY 392 N 2.08 -0.53 3.23 4.40 0.00 -1.22 -5.01 105.19 108.14 3ho8 n GLY 392 Ca -0.18 -0.56 -0.30 0.00 0.00 0.00 0.00 46.02 44.99 3ho8 n GLY 392 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3ho8 s THR 393 N -4.00 1.84 -0.48 2.61 2.01 -1.26 -2.53 115.64 113.84 3ho8 s THR 393 Ca 0.00 -0.96 -0.26 0.00 0.31 0.00 0.00 61.69 60.78 3ho8 s THR 393 Cb 0.00 -1.56 0.03 0.00 0.01 0.00 0.00 72.50 70.98 3ho8 s THR 393 CO 0.00 0.52 0.98 -0.63 -0.69 0.00 0.00 174.62 174.80 3ho8 s ILE 394 N -0.21 4.39 -0.09 1.82 1.01 -1.26 -3.90 121.20 122.97 3ho8 s ILE 394 Ca -0.00 0.81 0.14 0.00 0.00 0.00 0.00 60.65 61.60 3ho8 s ILE 394 Cb -0.12 -4.49 -0.11 0.00 0.01 0.00 0.00 42.46 37.75 3ho8 s ILE 394 CO 0.02 -0.91 1.01 0.16 0.00 0.00 0.00 174.94 175.22 3ho8 h ILE 395 N 6.11 0.80 -3.39 2.92 -0.00 -1.64 -3.10 117.51 119.21 3ho8 h ILE 395 Ca -0.24 -2.35 -0.27 0.00 -0.00 0.00 0.00 64.86 62.00 3ho8 h ILE 395 Cb 1.07 2.29 -0.33 0.00 -0.00 0.00 0.00 36.82 39.86 3ho8 h ILE 395 CO 1.06 0.46 -0.66 0.00 -0.00 0.00 0.00 178.15 179.00 3ho8 s ALA 396 N -2.85 -0.09 -0.14 0.16 0.00 -1.23 -4.57 121.76 113.03 3ho8 s ALA 396 Ca -0.01 0.49 -0.04 0.00 0.00 0.00 0.00 51.96 52.40 3ho8 s ALA 396 Cb 0.08 -0.35 0.06 0.00 0.00 0.00 0.00 23.12 22.92 3ho8 s ALA 396 CO 0.80 -0.13 0.17 -0.47 0.00 0.00 0.00 175.76 176.12 3ho8 s TYR 397 N 1.11 -0.14 0.09 0.00 6.14 -1.25 -1.55 117.35 121.75 3ho8 s TYR 397 Ca -0.09 0.30 0.08 0.00 0.64 0.00 0.00 57.07 58.01 3ho8 s TYR 397 Cb -0.12 -0.38 -0.03 0.00 0.42 0.00 0.00 41.96 41.85 3ho8 s TYR 397 CO -0.04 -0.43 -0.21 1.03 0.64 0.00 0.00 175.55 176.54 3ho8 s ARG 398 N 2.27 1.22 0.42 4.97 0.52 0.81 -4.71 118.95 124.46 3ho8 s ARG 398 Ca 0.04 -1.12 0.03 0.00 -0.52 0.00 0.00 55.73 54.17 3ho8 s ARG 398 Cb -0.14 -1.47 -0.04 0.00 0.52 0.00 0.00 34.95 33.83 3ho8 s ARG 398 CO -0.08 0.35 0.07 -1.54 0.02 0.00 0.00 175.30 174.11 3ho8 s SER 399 N -1.72 3.17 0.00 0.23 1.04 -1.26 -2.21 113.70 112.94 3ho8 s SER 399 Ca 0.07 -1.57 0.00 0.00 0.48 0.00 0.00 55.95 54.93 3ho8 s SER 399 Cb -0.10 0.29 0.00 0.00 0.10 0.00 0.00 66.02 66.31 3ho8 s SER 399 CO 0.04 -0.79 0.00 -0.24 0.98 0.00 0.00 173.24 173.23 3ho8 n SER 400 N -1.12 0.88 0.00 7.02 2.88 -1.26 -4.74 113.62 117.28 3ho8 n SER 400 Ca -0.09 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.45 3ho8 n SER 400 Cb 0.66 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.12 3ho8 n SER 400 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3ho8 n GLY 401 N 5.00 0.13 7.00 0.46 0.00 -1.26 -5.07 105.19 111.45 3ho8 n GLY 401 Ca 0.00 -1.13 0.00 0.00 0.00 0.00 0.00 46.02 44.89 3ho8 n GLY 401 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3ho8 n GLY 402 N 0.00 -0.41 3.62 -0.02 0.00 -1.26 -4.76 105.19 102.36 3ho8 n GLY 402 Ca 0.00 -1.08 -0.46 0.00 0.00 0.00 0.00 46.02 44.48 3ho8 n GLY 402 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 3ho8 n PHE 403 N -0.15 1.60 -1.00 1.61 -0.00 -1.26 -2.81 117.46 115.46 3ho8 n PHE 403 Ca 0.00 0.61 0.00 0.00 -0.00 0.00 0.00 57.45 58.06 3ho8 n PHE 403 Cb 0.00 -2.33 0.00 0.00 -0.00 0.00 0.00 39.48 37.15 3ho8 n PHE 403 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 3ho8 n GLY 404 N 1.76 0.32 3.18 7.13 0.00 -1.26 -4.99 105.19 111.34 3ho8 n GLY 404 Ca 0.12 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.83 3ho8 n GLY 404 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3ho8 s VAL 405 N -1.66 1.93 0.06 1.61 1.01 -1.12 0.22 120.40 122.44 3ho8 s VAL 405 Ca 0.00 -0.94 0.07 0.00 0.00 0.00 0.00 61.98 61.11 3ho8 s VAL 405 Cb 0.00 -1.68 -0.03 0.00 0.00 0.00 0.00 36.38 34.67 3ho8 s VAL 405 CO 0.00 0.53 -0.19 -0.60 0.00 0.00 0.00 175.10 174.84 3ho8 s ARG 406 N 0.45 1.18 -0.03 2.72 3.52 0.29 -4.73 118.95 122.34 3ho8 s ARG 406 Ca -0.17 -0.95 0.02 0.00 -0.13 0.00 0.00 55.73 54.50 3ho8 s ARG 406 Cb -0.17 -1.30 0.01 0.00 -1.56 0.00 0.00 34.95 31.92 3ho8 s ARG 406 CO 0.07 0.32 -0.07 -0.51 -0.81 0.00 0.00 175.30 174.30 3ho8 s LEU 407 N -1.38 1.63 -0.50 -0.88 1.43 -1.26 -2.22 118.68 115.49 3ho8 s LEU 407 Ca 0.05 -0.16 0.04 0.00 -1.03 0.00 0.00 54.13 53.03 3ho8 s LEU 407 Cb -0.09 -0.50 0.13 0.00 0.03 0.00 0.00 46.19 45.76 3ho8 s LEU 407 CO 0.02 0.02 0.25 -1.81 0.23 0.00 0.00 176.35 175.06 3ho8 s ASP 408 N 0.46 4.17 0.69 2.29 1.01 -1.09 -5.02 116.67 119.19 3ho8 s ASP 408 Ca -0.07 -2.93 -0.15 0.00 0.71 0.00 0.00 52.55 50.12 3ho8 s ASP 408 Cb -0.11 -1.51 0.02 0.00 1.01 0.00 0.00 42.92 42.33 3ho8 s ASP 408 CO 0.01 -0.24 1.13 0.00 0.21 0.00 0.00 175.17 176.28 3ho8 s ALA 409 N -0.15 2.33 0.00 5.23 0.00 -1.26 -2.13 121.76 125.79 3ho8 s ALA 409 Ca 0.17 0.61 0.00 0.00 0.00 0.00 0.00 51.96 52.74 3ho8 s ALA 409 Cb -0.26 -3.36 0.00 0.00 0.00 0.00 0.00 23.12 19.51 3ho8 s ALA 409 CO 0.00 -1.51 0.00 0.41 0.00 0.00 0.00 175.76 174.66 3ho8 n GLY 410 N -0.32 0.35 0.19 0.00 0.00 -1.10 -3.92 105.19 100.39 3ho8 n GLY 410 Ca 0.11 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.15 3ho8 n GLY 410 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3ho8 n ASP 411 N -0.15 2.16 -4.63 1.61 8.00 -0.95 -4.63 116.55 117.96 3ho8 n ASP 411 Ca 0.00 -1.90 -0.37 0.00 0.71 0.00 0.00 54.79 53.24 3ho8 n ASP 411 Cb 0.00 -0.06 -0.10 0.00 -0.02 0.00 0.00 41.12 40.94 3ho8 n ASP 411 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 3ho8 s GLY 412 N -0.91 1.95 0.24 0.44 0.00 -0.94 -4.85 107.32 103.26 3ho8 s GLY 412 Ca 0.07 -0.93 -0.22 0.00 0.00 0.00 0.00 44.72 43.64 3ho8 s GLY 412 CO 0.05 0.42 0.87 -0.11 0.00 0.00 0.00 173.10 174.33 3ho8 s PHE 413 N 1.16 -0.07 0.10 1.90 -0.12 -1.26 -4.98 117.98 114.71 3ho8 s PHE 413 Ca 0.07 -0.37 -0.08 0.00 -0.05 0.00 0.00 56.93 56.50 3ho8 s PHE 413 Cb -0.14 0.71 0.10 0.00 -0.63 0.00 0.00 43.02 43.05 3ho8 s PHE 413 CO 0.05 -1.10 0.67 1.04 -0.05 0.00 0.00 175.22 175.83 3ho8 n GLN 414 N -0.52 -0.11 0.00 1.99 1.13 -1.26 -4.60 117.38 114.01 3ho8 n GLN 414 Ca -0.05 0.67 0.00 0.00 -1.94 0.00 0.00 57.00 55.67 3ho8 n GLN 414 Cb 0.60 -0.99 0.00 0.00 0.11 0.00 0.00 30.24 29.96 3ho8 n GLN 414 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3ho8 n GLY 415 N -1.20 5.36 1.19 1.08 0.00 -1.17 -3.58 105.19 106.87 3ho8 n GLY 415 Ca 0.04 -1.51 0.00 0.00 0.00 0.00 0.00 46.02 44.55 3ho8 n GLY 415 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ho8 n ALA 416 N -3.00 -2.13 -1.89 4.61 0.00 -1.26 -4.51 120.51 112.33 3ho8 n ALA 416 Ca 0.00 0.32 -0.41 0.00 0.00 0.00 0.00 53.44 53.35 3ho8 n ALA 416 Cb 0.00 -1.14 -0.03 0.00 0.00 0.00 0.00 19.45 18.29 3ho8 n ALA 416 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 3ho8 s GLU 417 N -3.48 4.34 -0.26 0.00 0.41 -1.26 -4.13 118.70 114.31 3ho8 s GLU 417 Ca 0.00 2.19 -0.20 0.00 -0.41 0.00 0.00 54.97 56.55 3ho8 s GLU 417 Cb 0.00 -3.13 -0.02 0.00 -1.78 0.00 0.00 34.13 29.20 3ho8 s GLU 417 CO 0.00 -0.30 0.63 0.42 -0.49 0.00 0.00 175.26 175.53 3ho8 s ILE 418 N -0.26 4.98 0.19 -1.63 1.09 -1.05 -5.04 121.20 119.47 3ho8 s ILE 418 Ca 0.56 1.10 0.01 0.00 -1.10 0.00 0.00 60.65 61.21 3ho8 s ILE 418 Cb -0.39 -3.94 -0.04 0.00 -1.06 0.00 0.00 42.46 37.02 3ho8 s ILE 418 CO 0.44 0.00 0.35 -0.94 -0.10 0.00 0.00 174.94 174.70 3ho8 s SER 419 N 1.49 6.36 -1.36 3.58 1.04 -1.26 -3.42 113.70 120.13 3ho8 s SER 419 Ca 0.26 0.30 -0.09 0.00 0.48 0.00 0.00 55.95 56.90 3ho8 s SER 419 Cb -0.15 -1.97 0.10 0.00 0.10 0.00 0.00 66.02 64.10 3ho8 s SER 419 CO 0.09 -0.01 2.18 -0.81 0.98 0.00 0.00 173.24 175.67 3ho8 n PRO 420 N -0.67 3.72 0.00 4.02 -0.04 -1.26 -3.79 135.00 136.97 3ho8 n PRO 420 Ca -0.06 -3.19 0.00 0.00 -0.04 0.00 0.00 63.50 60.21 3ho8 n PRO 420 Cb 0.54 -2.91 0.00 0.00 -0.04 0.00 0.00 33.50 31.09 3ho8 n PRO 420 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 3ho8 n TYR 421 N 3.74 0.00 -4.39 0.54 4.02 -1.26 -5.13 117.16 114.68 3ho8 n TYR 421 Ca 0.52 0.00 -0.27 0.00 -0.01 0.00 0.00 57.90 58.13 3ho8 n TYR 421 Cb 0.33 0.00 -0.11 0.00 -0.02 0.00 0.00 39.34 39.53 3ho8 n TYR 421 CO 0.00 0.00 0.00 0.71 -1.01 0.00 0.00 176.86 176.56 3ho8 s TYR 422 N -0.77 2.37 -0.27 -0.72 4.12 -1.25 -4.94 117.35 115.88 3ho8 s TYR 422 Ca 0.00 -0.33 -0.25 0.00 0.02 0.00 0.00 57.07 56.50 3ho8 s TYR 422 Cb 0.00 -1.19 -0.11 0.00 -1.52 0.00 0.00 41.96 39.14 3ho8 s TYR 422 CO 0.00 0.48 0.93 -0.25 0.02 0.00 0.00 175.55 176.73 3ho8 n ASP 423 N 0.32 0.62 -1.74 2.29 8.00 -1.26 -4.65 116.55 120.12 3ho8 n ASP 423 Ca -0.13 0.60 0.00 0.00 0.71 0.00 0.00 54.79 55.97 3ho8 n ASP 423 Cb 0.55 -0.48 0.00 0.00 -0.02 0.00 0.00 41.12 41.17 3ho8 n ASP 423 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 3ho8 n SER 424 N 2.54 2.35 -4.62 -2.24 3.41 -1.26 -4.83 113.62 108.97 3ho8 n SER 424 Ca 0.19 -1.60 -0.39 0.00 -0.26 0.00 0.00 58.87 56.82 3ho8 n SER 424 Cb -0.03 -0.49 -0.08 0.00 -0.26 0.00 0.00 64.21 63.34 3ho8 n SER 424 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 3ho8 s LEU 425 N 0.00 4.07 -0.20 1.04 2.96 -1.26 -1.67 118.68 123.62 3ho8 s LEU 425 Ca 0.00 0.37 -0.16 0.00 -0.22 0.00 0.00 54.13 54.12 3ho8 s LEU 425 Cb 0.00 -2.47 -0.11 0.00 0.50 0.00 0.00 46.19 44.12 3ho8 s LEU 425 CO 0.00 -0.16 -0.12 0.18 -1.32 0.00 0.00 176.35 174.93 3ho8 n LEU 426 N 5.12 1.88 -3.75 -0.68 4.77 -0.20 -3.84 117.00 120.29 3ho8 n LEU 426 Ca -0.08 0.46 -0.13 0.00 -0.03 0.00 0.00 56.01 56.23 3ho8 n LEU 426 Cb 0.51 -0.87 -0.11 0.00 -2.33 0.00 0.00 43.42 40.62 3ho8 n LEU 426 CO 0.38 0.01 0.02 -0.69 -1.33 0.00 0.00 177.39 175.79 3ho8 s VAL 427 N -2.45 -0.00 -0.93 4.08 1.01 -0.98 -2.20 120.40 118.92 3ho8 s VAL 427 Ca -0.27 0.00 -0.10 0.00 0.00 0.00 0.00 61.98 61.61 3ho8 s VAL 427 Cb 0.06 -0.50 0.24 0.00 0.00 0.00 0.00 36.38 36.18 3ho8 s VAL 427 CO 0.43 0.00 0.88 -0.54 0.00 0.00 0.00 175.10 175.87 3ho8 s LYS 428 N 0.24 3.74 -0.24 2.72 1.02 -0.91 -0.48 119.74 125.83 3ho8 s LYS 428 Ca -0.00 -2.83 -0.29 0.00 0.02 0.00 0.00 55.97 52.87 3ho8 s LYS 428 Cb -0.03 -4.39 0.01 0.00 -0.52 0.00 0.00 37.83 32.90 3ho8 s LYS 428 CO -0.00 -1.26 1.09 -1.17 -0.92 0.00 0.00 175.35 173.09 3ho8 s LEU 429 N -0.53 4.07 -0.04 3.17 2.96 -1.15 -2.67 118.68 124.50 3ho8 s LEU 429 Ca 0.24 1.36 0.02 0.00 -0.22 0.00 0.00 54.13 55.52 3ho8 s LEU 429 Cb -0.11 -3.54 0.01 0.00 0.50 0.00 0.00 46.19 43.06 3ho8 s LEU 429 CO -0.08 -0.74 -0.08 -0.44 -1.32 0.00 0.00 176.35 173.69 3ho8 s SER 430 N 1.45 1.16 0.12 3.68 0.01 -0.94 -0.43 113.70 118.75 3ho8 s SER 430 Ca 0.46 -0.18 0.10 0.00 1.31 0.00 0.00 55.95 57.65 3ho8 s SER 430 Cb -0.15 -0.44 -0.04 0.00 0.21 0.00 0.00 66.02 65.60 3ho8 s SER 430 CO 0.10 0.02 -0.25 0.42 0.41 0.00 0.00 173.24 173.93 3ho8 s THR 431 N 0.52 2.12 0.04 1.44 -4.23 -0.04 -0.55 115.64 114.94 3ho8 s THR 431 Ca -0.08 -1.69 -0.03 0.00 -1.18 0.00 0.00 61.69 58.71 3ho8 s THR 431 Cb -0.12 -1.88 -0.02 0.00 1.34 0.00 0.00 72.50 71.82 3ho8 s THR 431 CO 0.01 0.07 0.04 -2.28 -0.54 0.00 0.00 174.62 171.91 3ho8 s HIS 432 N -1.07 0.31 -1.01 3.99 5.65 0.13 -1.03 115.29 122.27 3ho8 s HIS 432 Ca 0.12 -0.69 0.00 0.00 0.25 0.00 0.00 55.06 54.74 3ho8 s HIS 432 Cb -0.10 -0.22 0.00 0.00 -1.18 0.00 0.00 32.58 31.08 3ho8 s HIS 432 CO 0.05 -0.35 0.00 0.00 -0.65 0.00 0.00 174.74 173.80 3ho8 n ALA 433 N 0.68 0.00 -1.00 1.58 0.00 -0.93 -4.43 120.51 116.41 3ho8 n ALA 433 Ca -0.18 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.26 3ho8 n ALA 433 Cb 0.59 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.04 3ho8 n ALA 433 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 3ho8 n ILE 434 N 1.81 0.00 -1.59 0.00 5.41 -1.26 -0.99 119.36 122.74 3ho8 n ILE 434 Ca 0.00 0.03 -0.41 0.00 1.00 0.00 0.00 62.75 63.37 3ho8 n ILE 434 Cb 0.00 -0.18 0.01 0.00 -0.71 0.00 0.00 39.64 38.77 3ho8 n ILE 434 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 176.55 175.01 3ho8 n SER 435 N 0.00 1.00 0.04 4.38 3.41 -1.26 -1.53 113.62 119.65 3ho8 n SER 435 Ca 0.00 1.00 -0.11 0.00 -0.26 0.00 0.00 58.87 59.50 3ho8 n SER 435 Cb 0.00 -1.33 -0.05 0.00 -0.26 0.00 0.00 64.21 62.56 3ho8 n SER 435 CO 0.00 0.00 0.00 0.15 -0.16 0.00 0.00 175.04 175.03 3ho8 h PHE 436 N 1.36 -0.16 -0.71 7.33 3.57 -1.92 -2.49 116.94 123.92 3ho8 h PHE 436 Ca -0.44 0.01 0.16 0.00 3.53 0.00 0.00 57.97 61.22 3ho8 h PHE 436 Cb 1.35 0.08 -0.12 0.00 2.79 0.00 0.00 35.95 40.04 3ho8 h PHE 436 CO 0.42 -0.10 0.01 -0.22 -2.23 0.00 0.00 178.31 176.19 3ho8 h LYS 437 N -0.11 0.11 0.40 1.11 3.64 -1.95 0.50 116.57 120.28 3ho8 h LYS 437 Ca 0.03 -0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 59.40 3ho8 h LYS 437 Cb 0.15 -0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 31.93 3ho8 h LYS 437 CO -0.08 0.07 -0.38 1.96 -2.27 0.00 0.00 179.45 178.75 3ho8 h GLN 438 N 0.11 -0.77 -1.00 1.90 1.08 -1.82 -0.22 115.11 114.40 3ho8 h GLN 438 Ca 0.38 0.05 0.06 0.00 -1.45 0.00 0.00 58.65 57.70 3ho8 h GLN 438 Cb 0.66 0.17 -0.07 0.00 -0.05 0.00 0.00 27.48 28.20 3ho8 h GLN 438 CO -0.62 -0.51 0.64 0.00 -0.95 0.00 0.00 178.83 177.40 3ho8 h ALA 439 N -0.40 1.37 -0.37 3.87 0.00 -0.89 -1.28 119.26 121.56 3ho8 h ALA 439 Ca -0.03 -0.03 0.06 0.00 0.00 0.00 0.00 54.91 54.91 3ho8 h ALA 439 Cb 0.71 -0.31 -0.05 0.00 0.00 0.00 0.00 17.79 18.13 3ho8 h ALA 439 CO -0.05 0.46 0.07 1.49 0.00 0.00 0.00 179.25 181.21 3ho8 h GLU 440 N 1.18 0.18 0.00 0.00 4.81 0.49 -1.21 114.58 120.04 3ho8 h GLU 440 Ca 0.42 -0.01 -0.06 0.00 -0.13 0.00 0.00 59.36 59.58 3ho8 h GLU 440 Cb 0.14 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.47 3ho8 h GLU 440 CO -0.16 0.12 -0.54 1.05 -0.73 0.00 0.00 179.01 178.74 3ho8 h GLU 441 N 0.19 0.00 -0.67 1.92 4.11 -0.79 0.29 114.58 119.62 3ho8 h GLU 441 Ca 0.18 0.00 -0.01 0.00 0.07 0.00 0.00 59.36 59.60 3ho8 h GLU 441 Cb 0.21 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.43 3ho8 h GLU 441 CO -0.24 0.23 0.40 0.87 0.07 0.00 0.00 179.01 180.34 3ho8 h LYS 442 N 0.00 0.92 0.11 1.06 1.57 -1.11 -2.49 116.57 116.62 3ho8 h LYS 442 Ca -0.02 -0.09 -0.01 0.00 -1.87 0.00 0.00 60.65 58.66 3ho8 h LYS 442 Cb 1.23 -0.19 0.00 0.00 0.08 0.00 0.00 32.23 33.35 3ho8 h LYS 442 CO 0.03 0.66 -0.05 1.98 -0.57 0.00 0.00 179.45 181.50 3ho8 h MET 443 N 0.92 -0.14 0.28 3.15 4.05 -0.79 -2.07 114.93 120.33 3ho8 h MET 443 Ca 0.24 0.01 -0.01 0.00 -0.28 0.00 0.00 59.70 59.66 3ho8 h MET 443 Cb -0.02 0.03 -0.00 0.00 -0.80 0.00 0.00 31.60 30.81 3ho8 h MET 443 CO -0.04 0.03 -0.15 -0.39 0.23 0.00 0.00 176.91 176.58 3ho8 h VAL 444 N -0.29 0.69 0.00 -5.77 -1.51 -0.89 -1.63 116.25 106.85 3ho8 h VAL 444 Ca -0.02 0.00 -0.13 0.00 -1.23 0.00 0.00 66.70 65.33 3ho8 h VAL 444 Cb 0.23 0.69 -0.02 0.00 -2.13 0.00 0.00 31.29 30.06 3ho8 h VAL 444 CO 0.02 0.00 -0.60 0.08 -1.23 0.00 0.00 177.57 175.85 3ho8 h ARG 445 N -0.40 0.00 0.00 5.19 -0.00 -1.55 -2.24 114.38 115.37 3ho8 h ARG 445 Ca -0.03 0.00 -0.01 0.00 -0.00 0.00 0.00 59.98 59.93 3ho8 h ARG 445 Cb 0.32 0.00 -0.00 0.00 -0.00 0.00 0.00 29.97 30.29 3ho8 h ARG 445 CO 0.05 0.60 -0.05 1.03 -0.00 0.00 0.00 179.97 181.59 3ho8 h SER 446 N 0.00 0.00 0.46 0.08 0.87 -1.20 -1.54 113.55 112.23 3ho8 h SER 446 Ca -0.01 0.00 -0.23 0.00 -1.23 0.00 0.00 61.79 60.33 3ho8 h SER 446 Cb 1.23 0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 63.19 3ho8 h SER 446 CO 0.08 0.05 -0.98 -0.07 -0.53 0.00 0.00 176.83 175.38 3ho8 h LEU 447 N 0.00 0.44 -0.42 2.23 3.38 -0.69 -2.98 115.31 117.27 3ho8 h LEU 447 Ca -0.00 -0.37 -0.02 0.00 0.09 0.00 0.00 57.88 57.58 3ho8 h LEU 447 Cb 0.10 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 40.71 3ho8 h LEU 447 CO 0.01 1.19 -0.08 0.03 0.09 0.00 0.00 178.44 179.67 3ho8 h ARG 448 N 0.17 0.00 0.12 1.13 3.08 -1.20 -3.03 114.38 114.66 3ho8 h ARG 448 Ca -0.08 0.00 -0.28 0.00 0.07 0.00 0.00 59.98 59.69 3ho8 h ARG 448 Cb 1.63 0.00 0.02 0.00 0.08 0.00 0.00 29.97 31.70 3ho8 h ARG 448 CO 0.16 0.08 -1.22 1.49 -1.07 0.00 0.00 179.97 179.41 3ho8 h GLU 449 N 0.00 0.43 -6.43 0.04 4.81 -1.35 -3.45 114.58 108.63 3ho8 h GLU 449 Ca -0.00 -0.63 -0.60 0.00 -0.13 0.00 0.00 59.36 58.00 3ho8 h GLU 449 Cb 0.92 0.22 0.05 0.00 0.63 0.00 0.00 28.75 30.57 3ho8 h GLU 449 CO 0.01 1.27 0.81 -0.12 -0.73 0.00 0.00 179.01 180.25 3ho8 n MET 450 N -3.67 2.01 -4.03 1.92 1.56 -1.13 -4.70 117.12 109.09 3ho8 n MET 450 Ca -0.11 0.73 -0.24 0.00 -0.27 0.00 0.00 57.70 57.81 3ho8 n MET 450 Cb 0.99 -2.49 -0.17 0.00 2.15 0.00 0.00 33.22 33.70 3ho8 n MET 450 CO 0.00 0.00 0.00 0.50 -0.73 0.00 0.00 175.97 175.74 3ho8 s ARG 451 N 1.43 1.13 -0.05 2.12 6.06 -0.94 -4.98 118.95 123.72 3ho8 s ARG 451 Ca 0.82 -0.14 -0.01 0.00 -2.50 0.00 0.00 55.73 53.90 3ho8 s ARG 451 Cb -0.72 -1.21 0.03 0.00 0.06 0.00 0.00 34.95 33.11 3ho8 s ARG 451 CO 0.42 -0.19 0.03 0.42 -2.50 0.00 0.00 175.30 173.48 3ho8 s ILE 452 N 1.43 0.14 0.51 4.11 1.01 -1.26 -0.13 121.20 127.01 3ho8 s ILE 452 Ca -0.02 0.25 0.03 0.00 0.00 0.00 0.00 60.65 60.92 3ho8 s ILE 452 Cb -0.13 -0.34 -0.00 0.00 0.01 0.00 0.00 42.46 42.00 3ho8 s ILE 452 CO -0.04 0.21 0.16 -0.13 0.00 0.00 0.00 174.94 175.15 3ho8 s ARG 453 N 1.96 2.21 0.00 2.79 1.81 -0.60 -4.74 118.95 122.38 3ho8 s ARG 453 Ca 0.03 -2.20 0.00 0.00 -1.72 0.00 0.00 55.73 51.84 3ho8 s ARG 453 Cb -0.12 -1.78 0.00 0.00 -0.45 0.00 0.00 34.95 32.60 3ho8 s ARG 453 CO -0.04 -0.42 0.00 0.41 -0.68 0.00 0.00 175.30 174.58 3ho8 n GLY 454 N -1.43 1.01 3.45 -3.53 0.00 -1.26 -3.39 105.19 100.04 3ho8 n GLY 454 Ca -0.11 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.61 3ho8 n GLY 454 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3ho8 s VAL 455 N 0.00 2.74 0.18 1.61 -7.23 -1.25 -4.57 120.40 111.88 3ho8 s VAL 455 Ca 0.00 -1.22 -0.30 0.00 -1.81 0.00 0.00 61.98 58.64 3ho8 s VAL 455 Cb 0.00 -2.16 -0.08 0.00 0.56 0.00 0.00 36.38 34.70 3ho8 s VAL 455 CO 0.00 0.32 1.26 -0.54 -0.31 0.00 0.00 175.10 175.84 3ho8 s LYS 456 N -1.47 4.43 0.49 4.82 1.02 -1.26 -4.99 119.74 122.78 3ho8 s LYS 456 Ca 0.15 1.97 0.05 0.00 0.02 0.00 0.00 55.97 58.16 3ho8 s LYS 456 Cb -0.10 -3.22 -0.00 0.00 -0.52 0.00 0.00 37.83 33.98 3ho8 s LYS 456 CO 0.05 -0.20 0.25 0.95 -0.92 0.00 0.00 175.35 175.49 3ho8 s THR 457 N 0.13 1.82 -2.05 2.17 -4.23 -1.26 -4.46 115.64 107.77 3ho8 s THR 457 Ca 0.56 -1.65 0.17 0.00 -1.18 0.00 0.00 61.69 59.59 3ho8 s THR 457 Cb -0.35 -2.47 0.48 0.00 1.34 0.00 0.00 72.50 71.50 3ho8 s THR 457 CO 0.37 0.00 1.41 -0.46 -0.54 0.00 0.00 174.62 175.40 3ho8 n ASN 458 N -1.48 2.87 0.01 3.99 6.94 -1.05 -4.65 115.26 121.88 3ho8 n ASN 458 Ca -0.05 -1.98 -0.12 0.00 -0.02 0.00 0.00 54.58 52.41 3ho8 n ASN 458 Cb 0.65 -0.34 -0.07 0.00 -2.36 0.00 0.00 39.78 37.65 3ho8 n ASN 458 CO 0.00 0.00 0.00 0.40 -1.03 0.00 0.00 177.26 176.63 3ho8 h ILE 459 N 3.20 1.16 -0.24 1.53 2.04 -1.88 -2.27 117.51 121.03 3ho8 h ILE 459 Ca 0.00 -0.47 0.01 0.00 1.00 0.00 0.00 64.86 65.40 3ho8 h ILE 459 Cb 0.73 1.41 -0.01 0.00 -0.74 0.00 0.00 36.82 38.20 3ho8 h ILE 459 CO 0.00 0.13 0.16 1.55 0.00 0.00 0.00 178.15 179.99 3ho8 h PRO 460 N -0.13 0.31 -0.32 2.37 0.13 -1.96 -0.67 132.00 131.73 3ho8 h PRO 460 Ca 0.01 -0.02 0.02 0.00 -0.87 0.00 0.00 66.00 65.14 3ho8 h PRO 460 Cb 0.19 -0.07 -0.03 0.00 0.13 0.00 0.00 31.00 31.23 3ho8 h PRO 460 CO -0.00 0.20 0.16 0.35 -0.23 0.00 0.00 178.00 178.48 3ho8 h PHE 461 N 0.32 0.30 -0.70 1.56 3.57 -1.76 -1.23 116.94 119.00 3ho8 h PHE 461 Ca 0.09 0.01 0.04 0.00 3.53 0.00 0.00 57.97 61.64 3ho8 h PHE 461 Cb -0.02 -0.09 -0.05 0.00 2.79 0.00 0.00 35.95 38.59 3ho8 h PHE 461 CO -0.00 0.16 0.43 -0.07 -2.23 0.00 0.00 178.31 176.60 3ho8 h LEU 462 N 0.33 0.69 -0.09 0.59 3.38 -0.69 -2.39 115.31 117.12 3ho8 h LEU 462 Ca 0.13 0.01 0.04 0.00 0.09 0.00 0.00 57.88 58.15 3ho8 h LEU 462 Cb 0.04 -0.14 -0.05 0.00 0.09 0.00 0.00 40.66 40.61 3ho8 h LEU 462 CO -0.09 0.47 -0.19 0.40 0.09 0.00 0.00 178.44 179.12 3ho8 h ILE 463 N 0.82 0.53 0.00 1.22 2.04 -0.78 -1.94 117.51 119.41 3ho8 h ILE 463 Ca 0.29 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 66.14 3ho8 h ILE 463 Cb 0.07 0.53 -0.00 0.00 -0.74 0.00 0.00 36.82 36.68 3ho8 h ILE 463 CO -0.13 0.00 -0.03 0.78 0.00 0.00 0.00 178.15 178.77 3ho8 h ASN 464 N -0.26 0.00 0.21 1.72 2.35 -0.82 -1.86 115.58 116.93 3ho8 h ASN 464 Ca 0.09 0.00 -0.29 0.00 -0.55 0.00 0.00 56.30 55.55 3ho8 h ASN 464 Cb 0.38 0.00 0.03 0.00 0.05 0.00 0.00 38.32 38.78 3ho8 h ASN 464 CO -0.24 0.03 -1.27 0.58 -1.65 0.00 0.00 177.43 174.88 3ho8 h VAL 465 N 0.00 1.34 -0.31 2.81 2.07 -1.04 -3.20 116.25 117.92 3ho8 h VAL 465 Ca -0.00 -2.63 -0.03 0.00 0.82 0.00 0.00 66.70 64.86 3ho8 h VAL 465 Cb 0.14 3.08 -0.01 0.00 -1.52 0.00 0.00 31.29 32.98 3ho8 h VAL 465 CO 0.00 0.78 0.07 0.24 0.02 0.00 0.00 177.57 178.68 3ho8 h MET 466 N -0.04 0.50 -0.44 1.57 2.86 -0.68 -2.85 114.93 115.85 3ho8 h MET 466 Ca -0.22 -0.12 0.00 0.00 -2.06 0.00 0.00 59.70 57.29 3ho8 h MET 466 Cb 1.98 -0.06 0.00 0.00 0.06 0.00 0.00 31.60 33.58 3ho8 h MET 466 CO 0.23 0.57 0.00 1.63 1.06 0.00 0.00 176.91 180.40 3ho8 n LYS 467 N -4.65 1.47 -3.25 1.72 4.76 -0.77 -4.64 118.16 112.80 3ho8 n LYS 467 Ca -0.02 -0.52 -0.39 0.00 -2.87 0.00 0.00 58.31 54.51 3ho8 n LYS 467 Cb 0.19 -1.31 -0.06 0.00 -1.84 0.00 0.00 35.03 32.01 3ho8 n LYS 467 CO 0.00 0.00 0.00 1.21 -1.37 0.00 0.00 177.40 177.24 3ho8 s ASN 468 N -0.67 6.70 0.32 4.39 3.84 -1.08 -4.98 114.94 123.46 3ho8 s ASN 468 Ca 0.09 0.83 0.00 0.00 0.21 0.00 0.00 52.86 54.00 3ho8 s ASN 468 Cb 0.06 -2.31 0.52 0.00 -0.55 0.00 0.00 41.25 38.97 3ho8 s ASN 468 CO 0.05 -0.08 1.97 0.11 -2.79 0.00 0.00 177.10 176.36 3ho8 h LYS 469 N 6.96 0.99 -0.06 0.43 1.57 -1.88 -0.17 116.57 124.41 3ho8 h LYS 469 Ca -0.38 -0.06 0.02 0.00 -1.87 0.00 0.00 60.65 58.35 3ho8 h LYS 469 Cb 1.17 -0.22 -0.00 0.00 0.08 0.00 0.00 32.23 33.26 3ho8 h LYS 469 CO 0.75 0.65 0.09 0.87 -0.57 0.00 0.00 179.45 181.25 3ho8 h LYS 470 N 1.02 0.00 0.01 3.15 1.57 -1.93 -2.25 116.57 118.13 3ho8 h LYS 470 Ca 0.30 0.00 -0.17 0.00 -1.87 0.00 0.00 60.65 58.91 3ho8 h LYS 470 Cb -0.03 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.25 3ho8 h LYS 470 CO -0.08 0.00 -0.94 0.35 -0.57 0.00 0.00 179.45 178.21 3ho8 h PHE 471 N 0.00 0.02 -0.00 -1.35 3.04 -1.30 -3.38 116.94 113.98 3ho8 h PHE 471 Ca 0.03 -0.02 0.00 0.00 3.98 0.00 0.00 57.97 61.96 3ho8 h PHE 471 Cb 0.22 -0.00 -0.00 0.00 2.56 0.00 0.00 35.95 38.73 3ho8 h PHE 471 CO 0.00 1.37 0.00 1.79 -2.02 0.00 0.00 178.31 179.45 3ho8 h THR 472 N -0.96 0.81 0.00 4.41 1.35 -1.31 -2.49 112.91 114.71 3ho8 h THR 472 Ca -0.26 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.60 3ho8 h THR 472 Cb 1.25 1.00 0.00 0.00 -1.73 0.00 0.00 68.15 68.67 3ho8 h THR 472 CO -0.14 0.00 0.00 0.77 -0.25 0.00 0.00 175.52 175.90 3ho8 h SER 473 N 0.00 0.00 0.00 5.36 4.64 -1.58 -3.46 113.55 118.51 3ho8 h SER 473 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3ho8 h SER 473 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 3ho8 h SER 473 CO -0.00 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.57 3ho8 n GLY 474 N -0.89 0.80 2.84 -0.77 0.00 -0.94 -4.71 105.19 101.53 3ho8 n GLY 474 Ca -0.01 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.74 3ho8 n GLY 474 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 3ho8 s ASP 475 N -2.63 2.48 0.16 1.61 1.47 -1.26 -3.03 116.67 115.47 3ho8 s ASP 475 Ca 0.00 -0.51 -0.15 0.00 1.18 0.00 0.00 52.55 53.07 3ho8 s ASP 475 Cb 0.00 -0.74 0.02 0.00 -0.34 0.00 0.00 42.92 41.86 3ho8 s ASP 475 CO 0.00 -0.20 0.42 -0.72 0.68 0.00 0.00 175.17 175.35 3ho8 s TYR 476 N 1.76 -0.01 0.37 2.11 1.13 -1.26 -4.87 117.35 116.57 3ho8 s TYR 476 Ca 0.02 -0.34 0.04 0.00 -1.41 0.00 0.00 57.07 55.38 3ho8 s TYR 476 Cb -0.15 0.23 -0.04 0.00 -1.10 0.00 0.00 41.96 40.90 3ho8 s TYR 476 CO -0.07 -0.79 0.09 0.95 -2.51 0.00 0.00 175.55 173.21 3ho8 s THR 477 N -3.88 0.92 0.17 -3.49 -4.23 -1.26 -4.68 115.64 99.19 3ho8 s THR 477 Ca 0.09 -2.00 -0.21 0.00 -1.18 0.00 0.00 61.69 58.39 3ho8 s THR 477 Cb 0.01 -2.56 0.09 0.00 1.34 0.00 0.00 72.50 71.37 3ho8 s THR 477 CO -0.05 0.00 1.61 0.71 -0.54 0.00 0.00 174.62 176.35 3ho8 h THR 478 N 1.94 0.31 -2.75 3.99 1.35 -0.93 -3.29 112.91 113.54 3ho8 h THR 478 Ca -0.39 0.00 -0.56 0.00 -0.55 0.00 0.00 66.41 64.92 3ho8 h THR 478 Cb 1.26 0.31 -0.02 0.00 -1.73 0.00 0.00 68.15 67.97 3ho8 h THR 478 CO 0.64 0.00 1.01 -0.54 -0.25 0.00 0.00 175.52 176.38 3ho8 s LYS 479 N -6.07 4.19 0.00 4.72 -0.14 -1.26 -4.29 119.74 116.88 3ho8 s LYS 479 Ca -0.15 1.94 0.00 0.00 -1.36 0.00 0.00 55.97 56.40 3ho8 s LYS 479 Cb 0.14 -3.89 0.00 0.00 -1.68 0.00 0.00 37.83 32.40 3ho8 s LYS 479 CO 0.69 -0.81 0.00 0.34 -0.76 0.00 0.00 175.35 174.81 3ho8 n PHE 480 N 6.96 -1.88 0.23 3.18 7.35 -1.24 -4.80 117.46 127.26 3ho8 n PHE 480 Ca 0.16 0.00 0.07 0.00 -0.76 0.00 0.00 57.45 56.92 3ho8 n PHE 480 Cb 0.44 0.38 0.53 0.00 0.35 0.00 0.00 39.48 41.17 3ho8 n PHE 480 CO 0.00 0.00 0.00 0.82 -0.76 0.00 0.00 176.76 176.82 3ho8 h ILE 481 N 0.00 0.99 0.07 -2.13 1.08 -1.80 0.04 117.51 115.77 3ho8 h ILE 481 Ca 0.00 -0.77 -0.28 0.00 -0.39 0.00 0.00 64.86 63.43 3ho8 h ILE 481 Cb 0.00 1.43 -0.02 0.00 -3.07 0.00 0.00 36.82 35.16 3ho8 h ILE 481 CO 0.00 0.21 -1.42 -0.33 -0.69 0.00 0.00 178.15 175.92 3ho8 h GLU 482 N 0.00 0.14 -0.16 2.37 3.07 -1.89 -3.34 114.58 114.77 3ho8 h GLU 482 Ca -0.00 -0.24 -0.14 0.00 -0.50 0.00 0.00 59.36 58.48 3ho8 h GLU 482 Cb 0.41 0.09 0.00 0.00 -0.84 0.00 0.00 28.75 28.42 3ho8 h GLU 482 CO 0.03 0.98 -0.45 0.93 -1.40 0.00 0.00 179.01 179.09 3ho8 h GLU 483 N 0.04 0.58 -5.02 2.33 5.08 -1.82 -3.44 114.58 112.33 3ho8 h GLU 483 Ca -0.19 -0.42 -0.66 0.00 -1.00 0.00 0.00 59.36 57.09 3ho8 h GLU 483 Cb 1.95 0.07 -0.17 0.00 0.50 0.00 0.00 28.75 31.10 3ho8 h GLU 483 CO 0.14 1.04 -0.19 0.99 -1.00 0.00 0.00 179.01 179.98 3ho8 s THR 484 N -3.90 5.10 0.06 1.13 2.01 -0.02 -4.97 115.64 115.06 3ho8 s THR 484 Ca -0.12 0.05 -0.16 0.00 0.31 0.00 0.00 61.69 61.76 3ho8 s THR 484 Cb 0.07 -3.92 -0.19 0.00 0.01 0.00 0.00 72.50 68.46 3ho8 s THR 484 CO 0.83 -0.21 1.22 1.55 -0.69 0.00 0.00 174.62 177.32 3ho8 h PRO 485 N 8.53 0.64 0.00 4.92 0.13 -1.85 -3.36 132.00 141.01 3ho8 h PRO 485 Ca -0.28 -0.57 0.00 0.00 -0.87 0.00 0.00 66.00 64.27 3ho8 h PRO 485 Cb 1.13 0.14 0.00 0.00 0.13 0.00 0.00 31.00 32.40 3ho8 h PRO 485 CO 0.74 1.19 0.03 0.39 -0.23 0.00 0.00 178.00 180.12 3ho8 n GLU 486 N -4.05 0.00 0.20 0.86 4.71 -1.26 -1.19 120.64 119.91 3ho8 n GLU 486 Ca -0.09 0.29 0.09 0.00 -0.01 0.00 0.00 57.16 57.44 3ho8 n GLU 486 Cb 0.72 -1.53 0.27 0.00 -1.01 0.00 0.00 31.44 29.89 3ho8 n GLU 486 CO 0.00 0.00 0.00 -0.07 0.09 0.00 0.00 177.13 177.15 3ho8 h LEU 487 N 0.00 0.00 -2.53 -4.62 4.07 -1.89 -3.01 115.31 107.32 3ho8 h LEU 487 Ca 0.00 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.96 3ho8 h LEU 487 Cb 0.07 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.81 3ho8 h LEU 487 CO 0.00 0.22 0.00 0.49 -1.08 0.00 0.00 178.44 178.07 3ho8 n PHE 488 N -3.22 0.76 -2.78 1.13 3.72 -0.33 -4.54 117.46 112.20 3ho8 n PHE 488 Ca 0.02 -0.38 -0.41 0.00 -0.05 0.00 0.00 57.45 56.63 3ho8 n PHE 488 Cb 0.54 0.00 0.01 0.00 -0.94 0.00 0.00 39.48 39.09 3ho8 n PHE 488 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 176.76 176.46 3ho8 n ASP 489 N 1.59 6.88 -4.86 4.37 10.43 -1.14 -4.99 116.55 128.83 3ho8 n ASP 489 Ca 0.22 -3.60 -0.32 0.00 2.57 0.00 0.00 54.79 53.66 3ho8 n ASP 489 Cb 0.62 -1.16 -0.06 0.00 1.84 0.00 0.00 41.12 42.36 3ho8 n ASP 489 CO 0.00 0.00 0.00 0.27 -1.07 0.00 0.00 177.20 176.40 3ho8 s ILE 490 N -3.84 4.80 -0.16 0.53 -5.25 -1.26 -5.04 121.20 110.98 3ho8 s ILE 490 Ca 0.37 0.72 -0.00 0.00 -0.99 0.00 0.00 60.65 60.75 3ho8 s ILE 490 Cb 0.15 -3.62 -0.00 0.00 2.95 0.00 0.00 42.46 41.93 3ho8 s ILE 490 CO -0.05 -0.10 -0.14 0.00 -1.79 0.00 0.00 174.94 172.85 3ho8 s GLN 491 N -2.83 3.24 0.75 0.37 0.00 -1.26 -5.10 119.66 114.82 3ho8 s GLN 491 Ca 0.50 -0.74 -0.15 0.00 -0.00 0.00 0.00 55.36 54.97 3ho8 s GLN 491 Cb -0.11 -2.65 -0.01 0.00 0.00 0.00 0.00 33.01 30.24 3ho8 s GLN 491 CO 0.19 0.01 0.71 -0.35 0.00 0.00 0.00 175.29 175.86 3ho8 n PRO 492 N 4.08 0.29 -2.48 9.60 -0.04 -1.26 -4.93 135.00 140.27 3ho8 n PRO 492 Ca -0.19 0.15 -0.42 0.00 -0.04 0.00 0.00 63.50 63.00 3ho8 n PRO 492 Cb 0.52 -2.01 -0.03 0.00 -0.04 0.00 0.00 33.50 31.94 3ho8 n PRO 492 CO 0.00 0.00 0.00 -1.12 -0.04 0.00 0.00 175.50 174.34 3ho8 s SER 493 N -1.64 7.12 -0.80 3.54 0.01 -1.26 -4.94 113.70 115.73 3ho8 s SER 493 Ca 0.68 1.90 -0.26 0.00 1.31 0.00 0.00 55.95 59.58 3ho8 s SER 493 Cb -0.33 -2.57 -0.11 0.00 0.21 0.00 0.00 66.02 63.22 3ho8 s SER 493 CO 0.56 -0.46 2.29 -0.76 0.41 0.00 0.00 173.24 175.28 3ho8 s LEU 494 N 1.36 2.97 -1.10 2.44 1.02 -1.26 -4.84 118.68 119.27 3ho8 s LEU 494 Ca 0.57 -0.07 -0.08 0.00 0.02 0.00 0.00 54.13 54.56 3ho8 s LEU 494 Cb -0.27 -2.55 -0.13 0.00 0.02 0.00 0.00 46.19 43.26 3ho8 s LEU 494 CO 0.27 -3.55 3.14 -0.67 0.02 0.00 0.00 176.35 175.57 3ho8 n ASP 495 N 17.35 7.64 0.00 2.29 2.03 -1.26 -4.69 116.55 139.91 3ho8 n ASP 495 Ca 0.44 -2.58 0.04 0.00 0.52 0.00 0.00 54.79 53.22 3ho8 n ASP 495 Cb 0.45 -1.50 0.24 0.00 -0.72 0.00 0.00 41.12 39.58 3ho8 n ASP 495 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 3ho8 n ARG 496 N 3.13 0.81 -0.02 -0.67 1.74 -1.26 -2.14 116.66 118.24 3ho8 n ARG 496 Ca 0.67 0.00 -0.02 0.00 -0.77 0.00 0.00 57.85 57.73 3ho8 n ARG 496 Cb 0.45 -1.15 -0.01 0.00 -1.02 0.00 0.00 32.46 30.73 3ho8 n ARG 496 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3ho8 n GLY 497 N 0.40 -0.61 0.32 -0.13 0.00 -1.26 -3.73 105.19 100.17 3ho8 n GLY 497 Ca 0.06 -0.06 0.16 0.00 0.00 0.00 0.00 46.02 46.18 3ho8 n GLY 497 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 3ho8 h THR 498 N -0.28 0.38 -0.35 2.61 2.02 -1.96 -2.21 112.91 113.12 3ho8 h THR 498 Ca 0.00 -0.11 -0.01 0.00 0.77 0.00 0.00 66.41 67.05 3ho8 h THR 498 Cb 0.18 0.02 -0.02 0.00 -1.74 0.00 0.00 68.15 66.59 3ho8 h THR 498 CO 0.00 0.06 0.17 0.11 0.37 0.00 0.00 175.52 176.23 3ho8 h LYS 499 N 0.33 0.50 0.16 6.66 1.57 -1.64 0.90 116.57 125.06 3ho8 h LYS 499 Ca 0.61 -0.07 -0.00 0.00 -1.87 0.00 0.00 60.65 59.31 3ho8 h LYS 499 Cb 1.25 -0.09 -0.00 0.00 0.08 0.00 0.00 32.23 33.47 3ho8 h LYS 499 CO -0.59 0.45 -0.10 1.15 -0.57 0.00 0.00 179.45 179.79 3ho8 h THR 500 N 0.43 0.79 -0.98 -0.16 2.02 -1.50 0.76 112.91 114.27 3ho8 h THR 500 Ca 0.12 0.00 0.14 0.00 0.77 0.00 0.00 66.41 67.44 3ho8 h THR 500 Cb 0.11 0.79 -0.09 0.00 -1.74 0.00 0.00 68.15 67.23 3ho8 h THR 500 CO -0.02 0.00 0.61 -0.07 0.37 0.00 0.00 175.52 176.42 3ho8 h LEU 501 N -0.25 0.82 -0.08 2.58 3.38 -1.13 -1.08 115.31 119.55 3ho8 h LEU 501 Ca -0.02 0.06 -0.00 0.00 0.09 0.00 0.00 57.88 58.01 3ho8 h LEU 501 Cb 0.21 -0.10 -0.00 0.00 0.09 0.00 0.00 40.66 40.85 3ho8 h LEU 501 CO 0.02 0.40 0.05 -0.33 0.09 0.00 0.00 178.44 178.67 3ho8 h GLU 502 N 0.86 0.11 -0.09 1.13 4.39 0.14 -2.85 114.58 118.26 3ho8 h GLU 502 Ca 0.50 -0.01 -0.01 0.00 0.34 0.00 0.00 59.36 60.19 3ho8 h GLU 502 Cb 0.65 -0.02 -0.00 0.00 -0.10 0.00 0.00 28.75 29.27 3ho8 h GLU 502 CO -0.27 0.11 0.04 -0.92 -1.16 0.00 0.00 179.01 176.80 3ho8 h TYR 503 N 0.09 0.14 -0.17 4.33 5.03 -0.25 -3.13 116.97 123.02 3ho8 h TYR 503 Ca 0.03 -0.01 0.04 0.00 2.58 0.00 0.00 58.73 61.37 3ho8 h TYR 503 Cb 0.02 -0.04 -0.04 0.00 1.55 0.00 0.00 36.73 38.22 3ho8 h TYR 503 CO -0.06 0.25 -0.08 0.82 -1.32 0.00 0.00 178.16 177.76 3ho8 h ILE 504 N -0.00 0.74 -0.23 1.81 2.04 -1.19 -2.58 117.51 118.09 3ho8 h ILE 504 Ca 0.03 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.89 3ho8 h ILE 504 Cb 0.16 0.74 -0.01 0.00 -0.74 0.00 0.00 36.82 36.97 3ho8 h ILE 504 CO -0.00 0.00 0.15 1.23 0.00 0.00 0.00 178.15 179.52 3ho8 h GLY 505 N -0.07 0.32 -0.17 5.37 0.00 -1.54 0.24 103.07 107.23 3ho8 h GLY 505 Ca 0.09 -0.12 0.04 0.00 0.00 0.00 0.00 47.33 47.34 3ho8 h GLY 505 CO -0.21 0.12 -0.50 -0.57 0.00 0.00 0.00 176.54 175.38 3ho8 h ASN 506 N 0.30 -1.60 -0.64 0.19 -0.00 -1.46 0.22 115.58 112.58 3ho8 h ASN 506 Ca 0.08 0.21 0.02 0.00 -0.00 0.00 0.00 56.30 56.60 3ho8 h ASN 506 Cb -0.02 0.65 -0.04 0.00 -0.00 0.00 0.00 38.32 38.91 3ho8 h ASN 506 CO -0.02 -0.44 0.41 0.58 -0.00 0.00 0.00 177.43 177.96 3ho8 h VAL 507 N -0.49 1.13 -0.77 2.57 2.07 -1.13 0.53 116.25 120.15 3ho8 h VAL 507 Ca 0.07 -0.28 0.09 0.00 0.82 0.00 0.00 66.70 67.39 3ho8 h VAL 507 Cb 0.64 0.23 -0.07 0.00 -1.52 0.00 0.00 31.29 30.57 3ho8 h VAL 507 CO -0.48 0.15 0.43 0.74 0.02 0.00 0.00 177.57 178.44 3ho8 h THR 508 N 0.82 0.91 0.05 2.57 2.02 0.11 0.40 112.91 119.81 3ho8 h THR 508 Ca 0.24 -0.25 -0.33 0.00 0.77 0.00 0.00 66.41 66.84 3ho8 h THR 508 Cb -0.04 0.11 -0.03 0.00 -1.74 0.00 0.00 68.15 66.44 3ho8 h THR 508 CO -0.08 0.14 -1.83 -0.38 0.37 0.00 0.00 175.52 173.75 3ho8 n ILE 509 N -4.77 1.63 1.02 3.11 5.41 0.70 -4.51 119.36 121.96 3ho8 n ILE 509 Ca 0.12 -0.37 0.11 0.00 1.00 0.00 0.00 62.75 63.61 3ho8 n ILE 509 Cb 0.25 -1.84 -0.00 0.00 -0.71 0.00 0.00 39.64 37.34 3ho8 n ILE 509 CO 0.00 0.00 0.00 0.59 0.00 0.00 0.00 176.55 177.14 3ho8 n ASN 510 N -3.92 1.49 -0.66 4.38 3.02 0.18 -4.90 115.26 114.85 3ho8 n ASN 510 Ca -0.36 -1.21 0.08 0.00 -0.03 0.00 0.00 54.58 53.07 3ho8 n ASN 510 Cb 0.88 0.63 -0.04 0.00 -0.61 0.00 0.00 39.78 40.65 3ho8 n ASN 510 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3ho8 n GLY 511 N 1.45 -2.65 3.86 7.41 0.00 0.13 -4.94 105.19 110.44 3ho8 n GLY 511 Ca 0.07 -1.29 -0.34 0.00 0.00 0.00 0.00 46.02 44.46 3ho8 n GLY 511 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 3ho8 s PHE 512 N -3.13 3.55 0.34 1.61 5.36 -1.26 -4.73 117.98 119.72 3ho8 s PHE 512 Ca 0.00 0.94 -0.28 0.00 -0.96 0.00 0.00 56.93 56.63 3ho8 s PHE 512 Cb 0.00 -2.29 -0.10 0.00 -0.34 0.00 0.00 43.02 40.29 3ho8 s PHE 512 CO 0.00 0.40 1.30 -1.25 -1.46 0.00 0.00 175.22 174.22 3ho8 s PRO 513 N -2.21 4.32 -1.48 10.12 0.04 -1.26 -3.08 135.00 141.45 3ho8 s PRO 513 Ca 0.40 2.21 0.00 0.00 0.04 0.00 0.00 61.00 63.64 3ho8 s PRO 513 Cb -0.14 -3.04 0.00 0.00 0.04 0.00 0.00 34.50 31.37 3ho8 s PRO 513 CO 0.20 -0.22 0.00 -1.71 0.04 0.00 0.00 177.00 175.31 3ho8 n ASN 515 N 0.73 -4.91 -3.92 6.66 5.15 -1.26 -5.00 115.26 112.70 3ho8 n ASN 515 Ca 0.00 0.07 -0.17 0.00 -0.60 0.00 0.00 54.58 53.88 3ho8 n ASN 515 Cb 0.42 -3.99 -0.15 0.00 -0.53 0.00 0.00 39.78 35.53 3ho8 n ASN 515 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 3ho8 s VAL 516 N -2.78 0.43 -0.30 3.44 1.01 -1.18 -4.88 120.40 116.14 3ho8 s VAL 516 Ca 0.00 -0.15 -0.28 0.00 0.00 0.00 0.00 61.98 61.54 3ho8 s VAL 516 Cb 0.00 -0.42 -0.02 0.00 0.00 0.00 0.00 36.38 35.94 3ho8 s VAL 516 CO 0.00 0.16 1.81 -0.70 0.00 0.00 0.00 175.10 176.37 3ho8 s GLU 517 N 0.38 3.40 -0.12 2.72 2.12 -1.26 -4.71 118.70 121.23 3ho8 s GLU 517 Ca -0.04 1.53 -0.29 0.00 0.36 0.00 0.00 54.97 56.52 3ho8 s GLU 517 Cb -0.08 -4.19 -0.05 0.00 0.26 0.00 0.00 34.13 30.08 3ho8 s GLU 517 CO -0.00 -1.78 1.67 -1.59 -0.54 0.00 0.00 175.26 173.02 3ho8 s LYS 518 N 5.54 4.01 0.17 4.30 0.00 -1.26 -4.95 119.74 127.55 3ho8 s LYS 518 Ca 0.80 2.01 -0.22 0.00 0.00 0.00 0.00 55.97 58.56 3ho8 s LYS 518 Cb -0.24 -4.02 0.06 0.00 0.00 0.00 0.00 37.83 33.63 3ho8 s LYS 518 CO 0.33 -1.05 0.60 -0.98 0.00 0.00 0.00 175.35 174.26 3ho8 s ARG 519 N 4.35 1.32 0.58 1.78 1.70 -1.26 -5.15 118.95 122.27 3ho8 s ARG 519 Ca 0.74 -0.53 -0.20 0.00 -0.47 0.00 0.00 55.73 55.26 3ho8 s ARG 519 Cb -0.31 0.59 -0.04 0.00 -0.57 0.00 0.00 34.95 34.62 3ho8 s ARG 519 CO 0.30 -0.58 1.25 -2.30 -1.08 0.00 0.00 175.30 172.89 3ho8 n PRO 520 N -0.38 1.37 -1.39 3.89 -0.02 -1.26 -4.84 135.00 132.37 3ho8 n PRO 520 Ca -0.16 0.51 -0.56 0.00 -2.02 0.00 0.00 63.50 61.27 3ho8 n PRO 520 Cb 0.64 -2.47 -0.09 0.00 -0.02 0.00 0.00 33.50 31.56 3ho8 n PRO 520 CO 0.00 0.00 0.00 1.17 1.98 0.00 0.00 175.50 178.65 3ho8 n LYS 521 N -1.22 0.55 -1.92 -0.52 4.81 -1.26 -4.84 118.16 113.76 3ho8 n LYS 521 Ca 0.13 0.16 -0.39 0.00 -0.87 0.00 0.00 58.31 57.34 3ho8 n LYS 521 Cb 0.46 -1.95 0.02 0.00 0.02 0.00 0.00 35.03 33.57 3ho8 n LYS 521 CO 0.00 0.00 0.00 -2.14 1.17 0.00 0.00 177.40 176.43 3ho8 s PRO 522 N 5.74 3.57 -0.95 1.64 0.02 -1.26 -4.84 135.00 138.92 3ho8 s PRO 522 Ca 1.13 2.19 -0.24 0.00 0.02 0.00 0.00 61.00 64.10 3ho8 s PRO 522 Cb -1.20 -2.50 -0.17 0.00 0.02 0.00 0.00 34.50 30.65 3ho8 s PRO 522 CO 0.60 -0.83 1.93 -3.47 -0.33 0.00 0.00 177.00 174.90 3ho8 n ASP 523 N -0.45 2.35 -3.63 2.53 2.03 -1.26 -4.93 116.55 113.18 3ho8 n ASP 523 Ca 0.07 -2.63 -0.29 0.00 0.52 0.00 0.00 54.79 52.46 3ho8 n ASP 523 Cb 0.44 -1.48 0.23 0.00 -0.72 0.00 0.00 41.12 39.59 3ho8 n ASP 523 CO 0.00 0.00 0.00 -1.22 -1.92 0.00 0.00 177.20 174.06 3ho8 n TYR 524 N 13.71 -3.91 -3.86 -0.67 0.53 -1.26 -5.07 117.16 116.63 3ho8 n TYR 524 Ca 0.45 -1.02 -0.28 0.00 -1.02 0.00 0.00 57.90 56.03 3ho8 n TYR 524 Cb 0.45 -1.07 -0.03 0.00 -1.03 0.00 0.00 39.34 37.66 3ho8 n TYR 524 CO 0.00 0.00 0.00 -2.00 -1.02 0.00 0.00 176.86 173.84 3ho8 s GLU 525 N -5.54 3.47 0.06 -0.72 2.12 -1.26 -5.07 118.70 111.76 3ho8 s GLU 525 Ca 0.70 -0.46 -0.25 0.00 0.36 0.00 0.00 54.97 55.32 3ho8 s GLU 525 Cb -0.05 -2.94 -0.12 0.00 0.26 0.00 0.00 34.13 31.27 3ho8 s GLU 525 CO 0.52 0.51 1.39 1.37 -0.54 0.00 0.00 175.26 178.52 3ho8 h LEU 526 N 2.40 -1.00 -2.09 2.70 -0.00 -1.98 -3.48 115.31 111.87 3ho8 h LEU 526 Ca -0.47 0.08 -0.35 0.00 -0.00 0.00 0.00 57.88 57.14 3ho8 h LEU 526 Cb 1.18 0.33 0.13 0.00 -0.00 0.00 0.00 40.66 42.30 3ho8 h LEU 526 CO 0.71 -0.47 -0.83 0.00 -0.00 0.00 0.00 178.44 177.84 3ho8 n ALA 527 N -2.66 -2.20 -1.61 0.17 0.00 -1.26 -4.92 120.51 108.03 3ho8 n ALA 527 Ca -0.08 -0.07 -0.48 0.00 0.00 0.00 0.00 53.44 52.81 3ho8 n ALA 527 Cb 0.33 -3.34 -0.04 0.00 0.00 0.00 0.00 19.45 16.40 3ho8 n ALA 527 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 3ho8 n SER 528 N -3.08 1.79 -4.54 0.00 2.88 -1.26 -4.90 113.62 104.51 3ho8 n SER 528 Ca -0.21 1.14 -0.43 0.00 -1.33 0.00 0.00 58.87 58.04 3ho8 n SER 528 Cb 0.65 -1.28 -0.06 0.00 -0.75 0.00 0.00 64.21 62.77 3ho8 n SER 528 CO 0.00 0.00 0.00 -0.63 -1.23 0.00 0.00 175.04 173.18 3ho8 s ILE 529 N -0.11 4.69 0.27 2.46 1.09 -1.26 -4.93 121.20 123.40 3ho8 s ILE 529 Ca 0.72 0.44 -0.30 0.00 -1.10 0.00 0.00 60.65 60.41 3ho8 s ILE 529 Cb -0.79 -4.29 -0.10 0.00 -1.06 0.00 0.00 42.46 36.21 3ho8 s ILE 529 CO 0.51 -0.66 1.46 -2.16 -0.10 0.00 0.00 174.94 173.99 3ho8 s PRO 530 N 3.20 4.24 -0.06 2.79 0.04 -1.26 -5.00 135.00 138.95 3ho8 s PRO 530 Ca 0.29 2.35 0.03 0.00 0.04 0.00 0.00 61.00 63.71 3ho8 s PRO 530 Cb -0.12 -3.09 0.01 0.00 0.04 0.00 0.00 34.50 31.33 3ho8 s PRO 530 CO 0.21 -0.45 -0.14 0.99 0.04 0.00 0.00 177.00 177.66 3ho8 s THR 531 N -0.10 1.24 -0.10 1.26 2.01 -1.26 -4.10 115.64 114.59 3ho8 s THR 531 Ca 0.59 -0.56 0.01 0.00 0.31 0.00 0.00 61.69 62.04 3ho8 s THR 531 Cb -0.43 -1.11 -0.02 0.00 0.01 0.00 0.00 72.50 70.95 3ho8 s THR 531 CO 0.45 0.37 -0.12 -0.69 -0.69 0.00 0.00 174.62 173.95 3ho8 s VAL 532 N 0.46 3.21 0.22 3.82 1.01 -1.26 -4.91 120.40 122.95 3ho8 s VAL 532 Ca -0.12 -0.63 -0.30 0.00 0.00 0.00 0.00 61.98 60.93 3ho8 s VAL 532 Cb -0.14 -2.32 -0.09 0.00 0.00 0.00 0.00 36.38 33.82 3ho8 s VAL 532 CO 0.04 0.55 1.38 -0.94 0.00 0.00 0.00 175.10 176.13 3ho8 s SER 533 N -0.16 6.77 0.26 3.32 1.04 -1.26 -4.73 113.70 118.94 3ho8 s SER 533 Ca 0.00 2.53 -0.02 0.00 0.48 0.00 0.00 55.95 58.94 3ho8 s SER 533 Cb -0.13 -2.61 0.48 0.00 0.10 0.00 0.00 66.02 63.86 3ho8 s SER 533 CO 0.03 -0.62 1.80 0.77 0.98 0.00 0.00 173.24 176.20 3ho8 h SER 534 N 5.33 0.69 1.13 7.02 4.64 -1.99 -0.49 113.55 129.89 3ho8 h SER 534 Ca -0.45 0.06 0.00 0.00 -0.47 0.00 0.00 61.79 60.93 3ho8 h SER 534 Cb 1.22 -0.07 0.00 0.00 -0.31 0.00 0.00 62.40 63.24 3ho8 h SER 534 CO 0.78 0.36 0.00 0.77 -0.87 0.00 0.00 176.83 177.87 3ho8 h SER 535 N 0.78 0.00 0.41 4.97 4.64 -1.99 -0.99 113.55 121.37 3ho8 h SER 535 Ca 0.45 0.00 -0.31 0.00 -0.47 0.00 0.00 61.79 61.45 3ho8 h SER 535 Cb 0.50 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.58 3ho8 h SER 535 CO -0.29 0.00 -1.59 0.50 -0.87 0.00 0.00 176.83 174.58 3ho8 h LYS 536 N 0.00 0.25 -0.36 4.77 1.63 -1.53 -3.34 116.57 117.99 3ho8 h LYS 536 Ca 0.00 -0.43 -0.11 0.00 -0.85 0.00 0.00 60.65 59.26 3ho8 h LYS 536 Cb 0.56 0.16 -0.01 0.00 -0.60 0.00 0.00 32.23 32.34 3ho8 h LYS 536 CO 0.00 1.11 -0.23 0.82 -3.45 0.00 0.00 179.45 177.70 3ho8 h ILE 537 N 0.07 1.27 0.00 2.00 2.04 -0.76 -2.22 117.51 119.91 3ho8 h ILE 537 Ca -0.27 -1.32 0.00 0.00 1.00 0.00 0.00 64.86 64.27 3ho8 h ILE 537 Cb 2.03 1.24 0.00 0.00 -0.74 0.00 0.00 36.82 39.34 3ho8 h ILE 537 CO 0.15 0.44 0.00 0.00 0.00 0.00 0.00 178.15 178.74 3ho8 n ALA 538 N -2.50 1.40 0.03 1.87 0.00 -0.42 -1.78 120.51 119.12 3ho8 n ALA 538 Ca 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 53.44 53.39 3ho8 n ALA 538 Cb 0.43 -1.18 -0.10 0.00 0.00 0.00 0.00 19.45 18.59 3ho8 n ALA 538 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 3ho8 h SER 538 N 0.00 0.00 -3.54 0.00 4.64 -1.52 -3.47 113.55 109.67 3ho8 h SER 538 Ca 0.00 0.00 -0.56 0.00 -0.47 0.00 0.00 61.79 60.76 3ho8 h SER 538 Cb 0.16 0.00 0.11 0.00 -0.31 0.00 0.00 62.40 62.37 3ho8 h SER 538 CO 0.00 0.84 0.56 0.49 -0.87 0.00 0.00 176.83 177.85 3ho8 n PHE 538 N -3.11 2.40 -4.17 4.77 0.99 -0.73 -5.02 117.46 112.58 3ho8 n PHE 538 Ca -0.08 0.51 -0.30 0.00 -0.00 0.00 0.00 57.45 57.57 3ho8 n PHE 538 Cb 0.93 -2.43 -0.16 0.00 -1.00 0.00 0.00 39.48 36.82 3ho8 n PHE 538 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.76 177.21 3ho8 s SER 539 N -0.35 2.73 0.00 4.37 0.15 -1.26 -4.81 113.70 114.54 3ho8 s SER 539 Ca 0.57 -0.51 0.00 0.00 0.70 0.00 0.00 55.95 56.71 3ho8 s SER 539 Cb -0.53 -1.22 0.00 0.00 -1.71 0.00 0.00 66.02 62.56 3ho8 s SER 539 CO 0.61 -0.02 0.00 0.61 1.20 0.00 0.00 173.24 175.64 3ho8 n GLY 540 N 4.58 6.70 0.29 9.45 0.00 -1.23 -5.00 105.19 119.99 3ho8 n GLY 540 Ca -0.18 -1.83 0.18 0.00 0.00 0.00 0.00 46.02 44.19 3ho8 n GLY 540 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 3ho8 h THR 541 N 0.00 0.11 -0.24 2.61 1.35 -1.70 -2.37 112.91 112.67 3ho8 h THR 541 Ca 0.00 -0.40 -0.04 0.00 -0.55 0.00 0.00 66.41 65.42 3ho8 h THR 541 Cb 0.00 1.36 -0.01 0.00 -1.73 0.00 0.00 68.15 67.77 3ho8 h THR 541 CO 0.00 0.03 -0.01 0.50 -0.25 0.00 0.00 175.52 175.79 3ho8 h LYS 542 N 0.00 0.43 0.00 4.72 3.11 -1.46 -2.11 116.57 121.26 3ho8 h LYS 542 Ca -0.00 -0.14 0.00 0.00 -2.81 0.00 0.00 60.65 57.70 3ho8 h LYS 542 Cb 0.35 -0.04 0.00 0.00 -1.00 0.00 0.00 32.23 31.55 3ho8 h LYS 542 CO 0.00 0.62 0.00 1.96 -2.81 0.00 0.00 179.45 179.22 3ho8 h GLN 543 N 0.20 0.00 -0.03 1.90 7.50 -1.63 -2.27 115.11 120.78 3ho8 h GLN 543 Ca 0.07 0.00 -0.23 0.00 0.50 0.00 0.00 58.65 58.99 3ho8 h GLN 543 Cb 0.43 0.00 0.00 0.00 0.05 0.00 0.00 27.48 27.96 3ho8 h GLN 543 CO 0.01 0.00 -0.91 1.25 -1.50 0.00 0.00 178.83 177.68 3ho8 h LEU 544 N 0.00 0.62 -1.27 1.46 5.85 -0.93 -2.26 115.31 118.77 3ho8 h LEU 544 Ca 0.00 -0.47 -0.05 0.00 0.84 0.00 0.00 57.88 58.20 3ho8 h LEU 544 Cb 0.38 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 41.22 3ho8 h LEU 544 CO 0.00 1.26 -0.24 0.25 -0.34 0.00 0.00 178.44 179.38 3ho8 h LEU 545 N 0.29 0.00 -2.26 2.25 5.85 -1.18 -2.99 115.31 117.27 3ho8 h LEU 545 Ca -0.08 0.00 -0.08 0.00 0.84 0.00 0.00 57.88 58.56 3ho8 h LEU 545 Cb 1.54 0.00 -0.05 0.00 0.37 0.00 0.00 40.66 42.52 3ho8 h LEU 545 CO 0.16 0.24 0.11 0.47 -0.34 0.00 0.00 178.44 179.07 3ho8 n ASP 546 N -3.50 2.93 0.00 1.25 8.00 -0.87 -3.81 116.55 120.56 3ho8 n ASP 546 Ca -0.00 -2.43 0.00 0.00 0.71 0.00 0.00 54.79 53.06 3ho8 n ASP 546 Cb 0.40 -0.59 0.00 0.00 -0.02 0.00 0.00 41.12 40.91 3ho8 n ASP 546 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 3ho8 n GLU 547 N 0.08 0.00 -1.62 -1.24 1.02 -1.13 -4.97 120.64 112.79 3ho8 n GLU 547 Ca 0.15 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.29 3ho8 n GLU 547 Cb 0.73 -0.46 0.00 0.00 -0.02 0.00 0.00 31.44 31.69 3ho8 n GLU 547 CO 0.00 0.00 0.00 1.33 1.18 0.00 0.00 177.13 179.64 3ho8 n VAL 548 N -1.06 0.00 -1.39 2.62 0.24 -1.13 -5.13 118.33 112.48 3ho8 n VAL 548 Ca 0.00 0.00 -0.29 0.00 -2.04 0.00 0.00 64.34 62.01 3ho8 n VAL 548 Cb 0.00 0.00 0.19 0.00 -1.47 0.00 0.00 33.84 32.56 3ho8 n VAL 548 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 3ho8 s GLY 549 N -0.81 1.61 0.12 7.63 0.00 -1.26 -4.61 107.32 110.01 3ho8 s GLY 549 Ca 0.00 -0.79 -0.16 0.00 0.00 0.00 0.00 44.72 43.77 3ho8 s GLY 549 CO 0.00 -0.06 1.62 -2.55 0.00 0.00 0.00 173.10 172.11 3ho8 h PRO 550 N -1.99 0.60 0.00 2.90 0.11 -1.88 -1.89 132.00 129.84 3ho8 h PRO 550 Ca -0.48 -0.14 0.00 0.00 0.11 0.00 0.00 66.00 65.49 3ho8 h PRO 550 Cb 1.30 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.33 3ho8 h PRO 550 CO 0.47 0.64 0.00 1.17 -0.21 0.00 0.00 178.00 180.06 3ho8 n LYS 551 N -4.59 0.37 -0.11 1.05 4.81 -1.26 -1.36 118.16 117.07 3ho8 n LYS 551 Ca -0.01 0.08 0.11 0.00 -0.87 0.00 0.00 58.31 57.62 3ho8 n LYS 551 Cb 0.20 -1.50 0.30 0.00 0.02 0.00 0.00 35.03 34.05 3ho8 n LYS 551 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3ho8 n GLY 552 N 0.29 0.84 0.15 3.14 0.00 -0.75 -3.32 105.19 105.54 3ho8 n GLY 552 Ca 0.11 -0.56 -0.08 0.00 0.00 0.00 0.00 46.02 45.48 3ho8 n GLY 552 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3ho8 n VAL 553 N 0.82 0.62 0.03 1.61 0.31 -0.47 -4.49 118.33 116.76 3ho8 n VAL 553 Ca 0.17 -0.23 -0.03 0.00 -0.01 0.00 0.00 64.34 64.25 3ho8 n VAL 553 Cb 0.45 -1.01 0.23 0.00 -0.91 0.00 0.00 33.84 32.60 3ho8 n VAL 553 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3ho8 h ALA 554 N -0.07 1.16 -0.04 3.52 0.00 -1.61 -0.17 119.26 122.05 3ho8 h ALA 554 Ca -0.25 -0.33 0.00 0.00 0.00 0.00 0.00 54.91 54.33 3ho8 h ALA 554 Cb 1.36 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 19.03 3ho8 h ALA 554 CO -0.06 0.53 0.00 0.39 0.00 0.00 0.00 179.25 180.11 3ho8 n GLU 555 N -4.14 1.12 -0.06 0.00 1.02 -1.21 -2.92 120.64 114.45 3ho8 n GLU 555 Ca -0.00 -0.18 -0.06 0.00 -0.02 0.00 0.00 57.16 56.90 3ho8 n GLU 555 Cb 0.39 -1.19 -0.10 0.00 -0.02 0.00 0.00 31.44 30.52 3ho8 n GLU 555 CO 0.00 0.00 0.00 1.87 1.18 0.00 0.00 177.13 180.18 3ho8 n TRP 556 N -0.50 0.00 0.30 -0.32 -0.00 -0.22 -4.46 117.44 112.24 3ho8 n TRP 556 Ca 0.09 0.00 0.18 0.00 -0.00 0.00 0.00 57.50 57.77 3ho8 n TRP 556 Cb 0.08 -0.60 0.94 0.00 -0.00 0.00 0.00 31.31 31.73 3ho8 n TRP 556 CO 0.00 0.00 0.00 0.28 -0.00 0.00 0.00 177.69 177.97 3ho8 h VAL 557 N 0.00 0.18 -0.10 5.87 2.07 -1.03 -3.33 116.25 119.91 3ho8 h VAL 557 Ca -0.32 -0.27 0.00 0.00 0.82 0.00 0.00 66.70 66.93 3ho8 h VAL 557 Cb 1.72 1.22 -0.01 0.00 -1.52 0.00 0.00 31.29 32.71 3ho8 h VAL 557 CO 0.02 0.03 0.06 0.07 0.02 0.00 0.00 177.57 177.76 3ho8 h LYS 558 N 0.00 0.12 -0.00 1.57 2.10 -1.77 -3.23 116.57 115.36 3ho8 h LYS 558 Ca -0.00 -0.01 0.00 0.00 -2.00 0.00 0.00 60.65 58.64 3ho8 h LYS 558 Cb 0.22 -0.03 0.00 0.00 -0.90 0.00 0.00 32.23 31.52 3ho8 h LYS 558 CO 0.00 0.08 -0.64 1.17 -2.00 0.00 0.00 179.45 178.06 3ho8 n LYS 559 N -5.03 0.29 -1.57 0.07 4.81 -1.25 -4.88 118.16 110.60 3ho8 n LYS 559 Ca -0.05 -0.21 -0.42 0.00 -0.87 0.00 0.00 58.31 56.75 3ho8 n LYS 559 Cb 0.03 -1.50 -0.04 0.00 0.02 0.00 0.00 35.03 33.55 3ho8 n LYS 559 CO 0.00 0.00 0.00 1.04 1.17 0.00 0.00 177.40 179.61 3ho8 n GLN 560 N -1.17 1.60 -0.06 1.64 1.13 -1.22 -4.84 117.38 114.47 3ho8 n GLN 560 Ca 0.07 0.37 -0.06 0.00 -1.94 0.00 0.00 57.00 55.44 3ho8 n GLN 560 Cb 0.35 -3.16 0.14 0.00 0.11 0.00 0.00 30.24 27.68 3ho8 n GLN 560 CO 0.00 0.00 0.00 0.22 -1.44 0.00 0.00 177.06 175.84 3ho8 h ASP 561 N 15.77 0.68 -4.06 1.08 -0.00 -1.91 -3.43 116.42 124.55 3ho8 h ASP 561 Ca -0.35 -0.22 -0.52 0.00 -0.00 0.00 0.00 57.03 55.94 3ho8 h ASP 561 Cb 1.26 -0.19 0.10 0.00 -0.00 0.00 0.00 39.33 40.50 3ho8 h ASP 561 CO 1.02 0.87 0.49 -1.81 -0.00 0.00 0.00 179.24 179.81 3ho8 s ASP 562 N -6.75 5.54 0.10 2.28 1.01 -1.26 -4.60 116.67 112.99 3ho8 s ASP 562 Ca -0.09 2.40 -0.30 0.00 0.71 0.00 0.00 52.55 55.27 3ho8 s ASP 562 Cb 0.14 -2.60 -0.06 0.00 1.01 0.00 0.00 42.92 41.40 3ho8 s ASP 562 CO 0.82 -1.36 1.12 -0.69 0.21 0.00 0.00 175.17 175.27 3ho8 s VAL 563 N -1.56 4.11 0.56 -1.27 1.01 0.33 -4.93 120.40 118.65 3ho8 s VAL 563 Ca 0.72 1.63 -0.05 0.00 0.00 0.00 0.00 61.98 64.28 3ho8 s VAL 563 Cb -0.31 -4.04 0.12 0.00 0.00 0.00 0.00 36.38 32.15 3ho8 s VAL 563 CO 0.35 0.19 0.77 0.18 0.00 0.00 0.00 175.10 176.59 3ho8 n LEU 564 N 3.29 0.00 -3.68 3.92 4.77 -0.40 -1.78 117.00 123.12 3ho8 n LEU 564 Ca 0.06 -1.22 -0.14 0.00 -0.03 0.00 0.00 56.01 54.68 3ho8 n LEU 564 Cb 0.47 -0.55 -0.08 0.00 -2.33 0.00 0.00 43.42 40.93 3ho8 n LEU 564 CO 0.54 -0.97 0.26 -1.48 -1.33 0.00 0.00 177.39 174.41 3ho8 s LEU 565 N 0.00 -0.17 -0.13 2.23 2.34 -1.26 -3.86 118.68 117.83 3ho8 s LEU 565 Ca 0.47 1.12 -0.01 0.00 0.06 0.00 0.00 54.13 55.77 3ho8 s LEU 565 Cb -0.02 1.95 -0.02 0.00 -0.56 0.00 0.00 46.19 47.54 3ho8 s LEU 565 CO 0.32 -0.21 -0.09 -0.89 -1.06 0.00 0.00 176.35 174.42 3ho8 s THR 566 N 0.24 3.41 -0.21 5.48 2.01 -0.09 -1.30 115.64 125.18 3ho8 s THR 566 Ca -0.00 -0.54 -0.13 0.00 0.31 0.00 0.00 61.69 61.33 3ho8 s THR 566 Cb -0.04 -2.45 -0.05 0.00 0.01 0.00 0.00 72.50 69.98 3ho8 s THR 566 CO 0.01 0.52 0.27 -0.62 -0.69 0.00 0.00 174.62 174.11 3ho8 s ASP 567 N 0.19 6.29 0.00 3.53 2.15 -1.11 -0.80 116.67 126.92 3ho8 s ASP 567 Ca -0.05 0.33 0.23 0.00 0.43 0.00 0.00 52.55 53.49 3ho8 s ASP 567 Cb -0.15 -2.16 0.59 0.00 -0.30 0.00 0.00 42.92 40.90 3ho8 s ASP 567 CO 0.04 0.02 1.51 0.35 -0.17 0.00 0.00 175.17 176.92 3ho8 n THR 568 N 4.15 0.86 -0.22 1.71 -2.24 0.76 -1.04 114.28 118.25 3ho8 n THR 568 Ca -0.12 -0.92 -0.06 0.00 -2.27 0.00 0.00 64.05 60.67 3ho8 n THR 568 Cb 0.52 0.63 0.04 0.00 -2.10 0.00 0.00 70.33 69.41 3ho8 n THR 568 CO 0.00 0.00 0.00 0.74 -0.57 0.00 0.00 175.07 175.24 3ho8 h THR 569 N 4.37 1.19 0.00 4.28 2.02 -1.77 -0.35 112.91 122.65 3ho8 h THR 569 Ca 0.00 -0.44 0.00 0.00 0.77 0.00 0.00 66.41 66.74 3ho8 h THR 569 Cb 0.99 0.36 0.00 0.00 -1.74 0.00 0.00 68.15 67.76 3ho8 h THR 569 CO 0.00 0.20 0.00 0.49 0.37 0.00 0.00 175.52 176.58 3ho8 n PHE 570 N -4.59 0.00 0.00 3.16 3.72 -1.26 -4.26 117.46 114.23 3ho8 n PHE 570 Ca 0.04 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.44 3ho8 n PHE 570 Cb 0.07 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.61 3ho8 n PHE 570 CO 0.00 0.00 0.00 -2.13 -0.05 0.00 0.00 176.76 174.58 3ho8 n ARG 571 N -0.88 0.00 -0.15 -1.08 0.00 -0.24 -4.65 116.66 109.65 3ho8 n ARG 571 Ca 0.12 0.00 0.20 0.00 -0.00 0.00 0.00 57.85 58.18 3ho8 n ARG 571 Cb 0.06 0.00 0.60 0.00 0.00 0.00 0.00 32.46 33.11 3ho8 n ARG 571 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.63 177.85 3ho8 h ASP 572 N 0.00 0.22 -0.31 6.15 1.82 -1.59 -0.57 116.42 122.15 3ho8 h ASP 572 Ca 0.00 0.02 -0.01 0.00 -0.39 0.00 0.00 57.03 56.65 3ho8 h ASP 572 Cb 0.00 -0.02 -0.01 0.00 0.68 0.00 0.00 39.33 39.97 3ho8 h ASP 572 CO 0.00 0.10 0.17 0.00 -1.61 0.00 0.00 179.24 177.90 3ho8 h ALA 573 N 1.63 0.40 0.00 -0.78 0.00 -1.65 0.37 119.26 119.24 3ho8 h ALA 573 Ca 0.39 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.22 3ho8 h ALA 573 Cb 1.17 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.84 3ho8 h ALA 573 CO -0.09 -0.07 -0.53 1.12 0.00 0.00 0.00 179.25 179.69 3ho8 h HIS 574 N 0.39 0.00 0.00 0.00 2.07 -1.51 -1.60 115.15 114.50 3ho8 h HIS 574 Ca 0.11 0.00 -0.06 0.00 -2.85 0.00 0.00 60.37 57.57 3ho8 h HIS 574 Cb 0.06 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 30.03 3ho8 h HIS 574 CO -0.03 0.00 -0.31 0.37 -3.07 0.00 0.00 177.93 174.89 3ho8 h GLN 575 N 0.00 0.00 0.16 5.12 4.15 -0.70 0.21 115.11 124.05 3ho8 h GLN 575 Ca 0.00 0.00 -0.32 0.00 0.77 0.00 0.00 58.65 59.10 3ho8 h GLN 575 Cb 0.88 0.00 0.01 0.00 0.21 0.00 0.00 27.48 28.58 3ho8 h GLN 575 CO 0.00 0.31 -1.58 0.77 -1.93 0.00 0.00 178.83 176.39 3ho8 h SER 576 N 0.00 0.53 0.00 -0.69 0.02 -0.11 -3.39 113.55 109.91 3ho8 h SER 576 Ca -0.00 -0.91 -0.23 0.00 -0.84 0.00 0.00 61.79 59.80 3ho8 h SER 576 Cb 0.58 -0.17 -0.04 0.00 0.14 0.00 0.00 62.40 62.91 3ho8 h SER 576 CO 0.04 1.71 -1.88 0.18 -1.14 0.00 0.00 176.83 175.74 3ho8 n LEU 577 N -3.74 0.22 -1.87 5.07 4.77 -0.61 -4.73 117.00 116.11 3ho8 n LEU 577 Ca -0.24 -0.01 -0.19 0.00 -0.03 0.00 0.00 56.01 55.54 3ho8 n LEU 577 Cb 1.00 0.25 0.05 0.00 -2.33 0.00 0.00 43.42 42.38 3ho8 n LEU 577 CO 0.47 0.35 0.19 0.18 -1.33 0.00 0.00 177.39 177.26 3ho8 n LEU 578 N -2.51 4.45 -2.30 2.23 4.77 -0.30 -3.50 117.00 119.84 3ho8 n LEU 578 Ca -0.21 -4.54 -0.10 0.00 -0.03 0.00 0.00 56.01 51.13 3ho8 n LEU 578 Cb 0.91 -0.32 -0.01 0.00 -2.33 0.00 0.00 43.42 41.67 3ho8 n LEU 578 CO 0.26 1.96 -0.12 0.00 -1.33 0.00 0.00 177.39 178.16 3ho8 n ALA 579 N -0.75 -0.74 -1.39 -1.18 0.00 -1.05 -0.32 120.51 115.08 3ho8 n ALA 579 Ca 0.39 0.09 -0.13 0.00 0.00 0.00 0.00 53.44 53.78 3ho8 n ALA 579 Cb 0.93 -1.25 -0.06 0.00 0.00 0.00 0.00 19.45 19.06 3ho8 n ALA 579 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 3ho8 n THR 580 N -2.99 0.00 1.81 0.00 -1.04 0.60 -4.89 114.28 107.77 3ho8 n THR 580 Ca -0.11 0.00 0.14 0.00 -2.04 0.00 0.00 64.05 62.04 3ho8 n THR 580 Cb 0.55 -1.61 0.72 0.00 -1.82 0.00 0.00 70.33 68.17 3ho8 n THR 580 CO 0.00 0.00 0.00 0.54 -0.64 0.00 0.00 175.07 174.97 3ho8 n ARG 581 N -1.36 1.22 -1.83 -2.82 5.12 0.56 -4.85 116.66 112.70 3ho8 n ARG 581 Ca -0.13 -0.32 -0.42 0.00 -1.93 0.00 0.00 57.85 55.04 3ho8 n ARG 581 Cb 0.60 -1.44 -0.03 0.00 -1.16 0.00 0.00 32.46 30.43 3ho8 n ARG 581 CO 0.00 0.00 0.00 0.08 -1.93 0.00 0.00 177.63 175.78 3ho8 s VAL 582 N -1.98 2.38 0.33 1.55 1.01 -1.26 -4.97 120.40 117.46 3ho8 s VAL 582 Ca 0.40 0.23 -0.03 0.00 0.00 0.00 0.00 61.98 62.59 3ho8 s VAL 582 Cb 0.20 -3.15 -0.04 0.00 0.00 0.00 0.00 36.38 33.38 3ho8 s VAL 582 CO 0.32 0.02 0.57 -0.13 0.00 0.00 0.00 175.10 175.87 3ho8 s ARG 583 N 1.39 3.56 0.13 2.72 0.52 -1.26 -5.01 118.95 121.01 3ho8 s ARG 583 Ca 0.73 -0.11 -0.28 0.00 -0.52 0.00 0.00 55.73 55.55 3ho8 s ARG 583 Cb -0.46 -2.63 -0.04 0.00 0.52 0.00 0.00 34.95 32.33 3ho8 s ARG 583 CO 0.32 0.16 1.59 1.15 0.02 0.00 0.00 175.30 178.54 3ho8 h THR 584 N 1.03 0.20 -0.44 0.02 2.02 -1.93 -2.81 112.91 111.01 3ho8 h THR 584 Ca -0.48 0.00 0.04 0.00 0.77 0.00 0.00 66.41 66.74 3ho8 h THR 584 Cb 1.20 0.20 -0.05 0.00 -1.74 0.00 0.00 68.15 67.76 3ho8 h THR 584 CO 0.64 0.00 -0.26 1.17 0.37 0.00 0.00 175.52 177.44 3ho8 n LYS 585 N -5.43 -0.19 0.22 6.66 3.00 -1.26 -0.64 118.16 120.52 3ho8 n LYS 585 Ca -0.04 0.77 0.05 0.00 -0.00 0.00 0.00 58.31 59.09 3ho8 n LYS 585 Cb 0.35 -1.13 0.51 0.00 0.00 0.00 0.00 35.03 34.75 3ho8 n LYS 585 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.40 176.96 3ho8 h ASP 586 N 0.00 0.00 -0.04 3.14 5.19 -1.86 -2.11 116.42 120.74 3ho8 h ASP 586 Ca 0.07 -0.00 -0.05 0.00 -0.62 0.00 0.00 57.03 56.43 3ho8 h ASP 586 Cb 0.18 -0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.69 3ho8 h ASP 586 CO -0.41 0.18 -0.15 0.24 -3.12 0.00 0.00 179.24 175.97 3ho8 h MET 587 N 0.00 0.17 0.00 3.56 2.86 -0.88 -3.25 114.93 117.40 3ho8 h MET 587 Ca -0.00 -0.13 0.00 0.00 -2.06 0.00 0.00 59.70 57.51 3ho8 h MET 587 Cb 0.31 0.02 0.00 0.00 0.06 0.00 0.00 31.60 31.99 3ho8 h MET 587 CO 0.02 0.77 0.00 0.97 1.06 0.00 0.00 176.91 179.73 3ho8 h ILE 588 N -0.38 0.00 -0.26 -1.22 -0.00 -1.05 -2.81 117.51 111.78 3ho8 h ILE 588 Ca -0.01 -0.35 -0.05 0.00 -0.00 0.00 0.00 64.86 64.46 3ho8 h ILE 588 Cb 0.79 1.32 -0.01 0.00 -0.00 0.00 0.00 36.82 38.92 3ho8 h ILE 588 CO 0.03 0.00 -0.02 0.78 -0.00 0.00 0.00 178.15 178.94 3ho8 h ASN 589 N 0.00 0.48 -0.19 2.19 4.21 -1.42 -2.81 115.58 118.04 3ho8 h ASN 589 Ca 0.00 -0.33 0.00 0.00 1.21 0.00 0.00 56.30 57.18 3ho8 h ASN 589 Cb 0.36 -0.13 0.00 0.00 -1.12 0.00 0.00 38.32 37.43 3ho8 h ASN 589 CO 0.00 0.69 0.00 2.30 -1.29 0.00 0.00 177.43 179.13 3ho8 n ILE 590 N -4.58 0.24 -0.30 2.81 -6.64 -1.20 -4.39 119.36 105.31 3ho8 n ILE 590 Ca -0.03 -0.37 0.17 0.00 -1.77 0.00 0.00 62.75 60.75 3ho8 n ILE 590 Cb 0.27 0.37 0.44 0.00 -1.44 0.00 0.00 39.64 39.28 3ho8 n ILE 590 CO 0.00 0.00 0.00 0.00 -1.77 0.00 0.00 176.55 174.78 3ho8 h ALA 591 N 4.02 2.01 0.19 -1.28 0.00 -1.22 1.32 119.26 124.29 3ho8 h ALA 591 Ca 0.00 0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 3ho8 h ALA 591 Cb 0.50 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.24 3ho8 h ALA 591 CO 0.00 -0.34 -0.14 0.66 0.00 0.00 0.00 179.25 179.43 3ho8 h SER 592 N 0.55 -0.36 -0.69 0.00 4.64 -1.77 -3.06 113.55 112.86 3ho8 h SER 592 Ca 0.53 0.02 -0.01 0.00 -0.47 0.00 0.00 61.79 61.86 3ho8 h SER 592 Cb 1.11 0.11 -0.03 0.00 -0.31 0.00 0.00 62.40 63.27 3ho8 h SER 592 CO -0.26 -0.20 0.38 0.50 -0.87 0.00 0.00 176.83 176.38 3ho8 h LYS 593 N -0.31 0.97 -0.89 4.77 1.63 -1.41 -2.59 116.57 118.74 3ho8 h LYS 593 Ca -0.03 -0.10 0.16 0.00 -0.85 0.00 0.00 60.65 59.83 3ho8 h LYS 593 Cb 0.26 -0.19 -0.07 0.00 -0.60 0.00 0.00 32.23 31.62 3ho8 h LYS 593 CO 0.01 0.71 0.58 1.15 -3.45 0.00 0.00 179.45 178.45 3ho8 h THR 594 N 0.98 0.79 -0.61 1.00 2.02 0.16 -2.25 112.91 115.00 3ho8 h THR 594 Ca 0.25 -0.21 -0.08 0.00 0.77 0.00 0.00 66.41 67.13 3ho8 h THR 594 Cb 0.02 0.12 -0.02 0.00 -1.74 0.00 0.00 68.15 66.53 3ho8 h THR 594 CO -0.04 0.11 0.05 0.00 0.37 0.00 0.00 175.52 176.02 3ho8 h ALA 595 N 1.61 0.81 0.00 6.16 0.00 -1.35 -2.53 119.26 123.96 3ho8 h ALA 595 Ca 0.46 -0.28 -0.10 0.00 0.00 0.00 0.00 54.91 54.98 3ho8 h ALA 595 Cb 0.84 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.39 3ho8 h ALA 595 CO -0.21 0.61 -0.47 0.22 0.00 0.00 0.00 179.25 179.40 3ho8 h ASP 596 N 0.94 0.00 0.03 0.00 3.58 -1.49 -2.18 116.42 117.29 3ho8 h ASP 596 Ca 0.18 0.00 -0.00 0.00 0.42 0.00 0.00 57.03 57.63 3ho8 h ASP 596 Cb 0.49 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.54 3ho8 h ASP 596 CO 0.02 0.47 -0.01 0.58 -2.88 0.00 0.00 179.24 177.41 3ho8 h VAL 597 N 0.00 0.53 -0.72 2.25 2.07 -1.45 -3.36 116.25 115.57 3ho8 h VAL 597 Ca -0.00 -1.35 -0.37 0.00 0.82 0.00 0.00 66.70 65.80 3ho8 h VAL 597 Cb 0.95 0.99 -0.22 0.00 -1.52 0.00 0.00 31.29 31.50 3ho8 h VAL 597 CO 0.06 0.18 0.47 0.49 0.02 0.00 0.00 177.57 178.78 3ho8 n PHE 598 N -4.76 2.24 -0.35 1.57 3.01 -0.96 -3.30 117.46 114.91 3ho8 n PHE 598 Ca -0.03 -1.46 0.05 0.00 1.01 0.00 0.00 57.45 57.02 3ho8 n PHE 598 Cb 0.15 -0.75 0.21 0.00 -0.01 0.00 0.00 39.48 39.09 3ho8 n PHE 598 CO 0.00 0.00 0.00 1.57 1.01 0.00 0.00 176.76 179.34 3ho8 h LYS 599 N 0.82 0.98 -0.53 -1.08 2.10 -1.55 0.15 116.57 117.46 3ho8 h LYS 599 Ca 0.45 -0.06 0.00 0.00 -2.00 0.00 0.00 60.65 59.04 3ho8 h LYS 599 Cb 2.35 -0.22 0.00 0.00 -0.90 0.00 0.00 32.23 33.46 3ho8 h LYS 599 CO 0.80 0.65 0.00 -0.25 -2.00 0.00 0.00 179.45 178.65 3ho8 n ASP 600 N -4.61 2.83 -4.78 7.07 8.00 -1.26 -4.55 116.55 119.25 3ho8 n ASP 600 Ca 0.17 -2.12 -0.34 0.00 0.71 0.00 0.00 54.79 53.21 3ho8 n ASP 600 Cb 0.30 -0.38 0.01 0.00 -0.02 0.00 0.00 41.12 41.03 3ho8 n ASP 600 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 3ho8 s GLY 601 N -0.89 2.39 0.04 0.44 0.00 0.52 -4.72 107.32 105.09 3ho8 s GLY 601 Ca 0.32 0.63 -0.16 0.00 0.00 0.00 0.00 44.72 45.51 3ho8 s GLY 601 CO 0.19 0.97 1.10 -2.75 0.00 0.00 0.00 173.10 172.61 3ho8 h PHE 602 N 0.82 0.91 -2.94 1.90 3.57 -1.48 -3.42 116.94 116.31 3ho8 h PHE 602 Ca -0.48 -0.55 0.07 0.00 3.53 0.00 0.00 57.97 60.53 3ho8 h PHE 602 Cb 1.24 -0.08 -0.06 0.00 2.79 0.00 0.00 35.95 39.84 3ho8 h PHE 602 CO 0.54 1.40 0.25 -1.54 -2.23 0.00 0.00 178.31 176.73 3ho8 s SER 603 N -7.25 -0.28 -0.25 0.41 1.04 -1.25 -4.00 113.70 102.12 3ho8 s SER 603 Ca -0.11 -0.53 0.03 0.00 0.48 0.00 0.00 55.95 55.82 3ho8 s SER 603 Cb 0.05 0.69 0.06 0.00 0.10 0.00 0.00 66.02 66.92 3ho8 s SER 603 CO 0.90 -1.27 -0.11 -0.76 0.98 0.00 0.00 173.24 172.98 3ho8 s LEU 604 N -2.90 3.20 -0.12 2.42 1.43 0.22 -2.75 118.68 120.18 3ho8 s LEU 604 Ca 0.10 -1.29 -0.29 0.00 -1.03 0.00 0.00 54.13 51.62 3ho8 s LEU 604 Cb -0.05 -1.50 -0.03 0.00 0.03 0.00 0.00 46.19 44.64 3ho8 s LEU 604 CO 0.04 -0.17 1.42 -0.70 0.23 0.00 0.00 176.35 177.17 3ho8 s GLU 605 N 1.15 4.22 0.00 1.70 2.12 -0.21 -2.00 118.70 125.68 3ho8 s GLU 605 Ca -0.07 1.87 0.00 0.00 0.36 0.00 0.00 54.97 57.13 3ho8 s GLU 605 Cb -0.19 -3.84 0.00 0.00 0.26 0.00 0.00 34.13 30.36 3ho8 s GLU 605 CO -0.06 -0.75 0.62 0.00 -0.54 0.00 0.00 175.26 174.53 3ho8 n MET 606 N 6.76 0.00 -3.68 4.30 0.00 -0.96 -3.80 117.12 119.74 3ho8 n MET 606 Ca 0.15 -0.31 -0.10 0.00 0.00 0.00 0.00 57.70 57.44 3ho8 n MET 606 Cb 0.44 -0.16 -0.05 0.00 0.00 0.00 0.00 33.22 33.45 3ho8 n MET 606 CO 0.00 0.00 0.00 -0.46 0.00 0.00 0.00 175.97 175.51 3ho8 s TRP 607 N 0.00 -0.13 0.00 3.17 -0.00 -1.25 -4.79 118.94 115.94 3ho8 s TRP 607 Ca 0.00 -0.20 0.00 0.00 -0.00 0.00 0.00 56.10 55.90 3ho8 s TRP 607 Cb 0.00 0.19 0.00 0.00 -0.00 0.00 0.00 33.47 33.66 3ho8 s TRP 607 CO 0.00 -0.66 0.00 0.41 -0.00 0.00 0.00 176.95 176.70 3ho8 n GLY 608 N -0.16 -1.89 6.54 5.86 0.00 -1.26 -2.32 105.19 111.97 3ho8 n GLY 608 Ca -0.16 -1.39 0.00 0.00 0.00 0.00 0.00 46.02 44.47 3ho8 n GLY 608 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3ho8 n GLY 609 N 0.00 1.89 0.00 -0.02 0.00 -1.14 -2.46 105.19 103.46 3ho8 n GLY 609 Ca 0.00 0.03 0.00 0.00 0.00 0.00 0.00 46.02 46.05 3ho8 n GLY 609 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ho8 n ALA 610 N 3.79 0.45 -0.33 4.61 0.00 -1.26 -4.84 120.51 122.92 3ho8 n ALA 610 Ca 0.00 -0.07 0.05 0.00 0.00 0.00 0.00 53.44 53.42 3ho8 n ALA 610 Cb 0.00 0.00 0.20 0.00 0.00 0.00 0.00 19.45 19.65 3ho8 n ALA 610 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.50 179.29 3ho8 h THR 611 N 0.60 0.92 -0.15 0.00 1.35 -1.84 0.20 112.91 114.00 3ho8 h THR 611 Ca 0.00 -0.31 0.02 0.00 -0.55 0.00 0.00 66.41 65.57 3ho8 h THR 611 Cb 0.30 -0.06 -0.02 0.00 -1.73 0.00 0.00 68.15 66.65 3ho8 h THR 611 CO 0.00 0.16 0.04 0.15 -0.25 0.00 0.00 175.52 175.62 3ho8 h PHE 612 N 0.90 0.07 -0.20 4.73 3.57 -1.89 -1.40 116.94 122.72 3ho8 h PHE 612 Ca 0.44 0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.93 3ho8 h PHE 612 Cb 0.41 -0.01 -0.01 0.00 2.79 0.00 0.00 35.95 39.13 3ho8 h PHE 612 CO -0.03 0.03 0.04 0.22 -2.23 0.00 0.00 178.31 176.34 3ho8 h ASP 613 N 0.11 0.30 0.69 0.41 1.82 -1.56 -3.06 116.42 115.14 3ho8 h ASP 613 Ca 0.07 -0.24 -0.18 0.00 -0.39 0.00 0.00 57.03 56.29 3ho8 h ASP 613 Cb 0.05 -0.08 -0.02 0.00 0.68 0.00 0.00 39.33 39.96 3ho8 h ASP 613 CO -0.08 0.46 -0.81 0.58 -1.61 0.00 0.00 179.24 177.78 3ho8 h VAL 614 N 0.13 1.53 0.16 2.25 2.07 -0.61 -2.21 116.25 119.57 3ho8 h VAL 614 Ca 0.06 -2.64 -0.01 0.00 0.82 0.00 0.00 66.70 64.94 3ho8 h VAL 614 Cb 0.28 2.44 0.00 0.00 -1.52 0.00 0.00 31.29 32.49 3ho8 h VAL 614 CO 0.00 0.76 -0.08 0.00 0.02 0.00 0.00 177.57 178.28 3ho8 h ALA 615 N 1.12 -0.21 -0.25 1.67 0.00 -1.32 -1.10 119.26 119.17 3ho8 h ALA 615 Ca -0.02 -0.20 0.05 0.00 0.00 0.00 0.00 54.91 54.74 3ho8 h ALA 615 Cb 1.42 0.08 -0.04 0.00 0.00 0.00 0.00 17.79 19.25 3ho8 h ALA 615 CO 0.11 -0.41 -0.04 1.88 0.00 0.00 0.00 179.25 180.79 3ho8 h TYR 616 N -0.62 -0.08 0.00 0.00 -1.99 -1.47 -2.17 116.97 110.62 3ho8 h TYR 616 Ca -0.02 0.02 0.00 0.00 2.00 0.00 0.00 58.73 60.73 3ho8 h TYR 616 Cb 0.47 0.08 0.00 0.00 2.00 0.00 0.00 36.73 39.27 3ho8 h TYR 616 CO 0.05 -0.08 0.00 -1.71 -0.00 0.00 0.00 178.16 176.42 3ho8 n ASN 617 N -5.20 0.00 0.05 3.88 4.05 -0.83 -3.63 115.26 113.58 3ho8 n ASN 617 Ca -0.01 0.46 -0.19 0.00 0.45 0.00 0.00 54.58 55.29 3ho8 n ASN 617 Cb 0.14 -0.49 -0.09 0.00 1.23 0.00 0.00 39.78 40.57 3ho8 n ASN 617 CO 0.00 0.00 0.00 -0.26 -3.05 0.00 0.00 177.26 173.95 3ho8 h PHE 618 N 0.00 0.96 -0.01 1.20 -1.00 -1.44 -3.31 116.94 113.34 3ho8 h PHE 618 Ca 0.00 -0.53 0.00 0.00 2.81 0.00 0.00 57.97 60.25 3ho8 h PHE 618 Cb 0.00 -0.11 0.00 0.00 3.61 0.00 0.00 35.95 39.45 3ho8 h PHE 618 CO 0.00 1.36 -0.07 1.28 -1.61 0.00 0.00 178.31 179.27 3ho8 n LEU 619 N -3.83 1.50 -3.72 1.54 4.77 -0.67 -4.97 117.00 111.62 3ho8 n LEU 619 Ca -0.10 -0.48 -0.08 0.00 -0.03 0.00 0.00 56.01 55.31 3ho8 n LEU 619 Cb 0.88 -0.03 0.00 0.00 -2.33 0.00 0.00 43.42 41.94 3ho8 n LEU 619 CO 0.55 0.26 -0.04 0.29 -1.33 0.00 0.00 177.39 177.12 3ho8 n LYS 620 N 0.05 -0.91 -4.32 3.23 4.01 -0.87 -4.83 118.16 114.52 3ho8 n LYS 620 Ca 0.17 -0.39 -0.18 0.00 -0.51 0.00 0.00 58.31 57.40 3ho8 n LYS 620 Cb 0.37 0.26 -0.09 0.00 -0.51 0.00 0.00 35.03 35.06 3ho8 n LYS 620 CO 0.00 0.00 0.00 -1.83 -1.11 0.00 0.00 177.40 174.46 3ho8 s GLU 621 N -5.33 1.54 -0.22 1.97 -1.05 -0.89 -4.37 118.70 110.34 3ho8 s GLU 621 Ca 0.08 -1.87 -0.06 0.00 -0.15 0.00 0.00 54.97 52.98 3ho8 s GLU 621 Cb -0.05 -0.08 -0.03 0.00 -0.44 0.00 0.00 34.13 33.54 3ho8 s GLU 621 CO 0.18 -0.43 0.03 1.21 0.95 0.00 0.00 175.26 177.20 3ho8 s ASN 622 N -3.35 4.98 0.26 0.83 3.04 -1.26 -3.13 114.94 116.31 3ho8 s ASN 622 Ca 0.36 -0.20 -0.03 0.00 0.04 0.00 0.00 52.86 53.04 3ho8 s ASN 622 Cb 0.05 -1.87 0.40 0.00 -1.54 0.00 0.00 41.25 38.30 3ho8 s ASN 622 CO 0.17 0.02 1.85 -0.65 -3.04 0.00 0.00 177.10 175.45 3ho8 h PRO 623 N 7.80 0.98 -0.14 0.43 0.11 -1.90 -2.38 132.00 136.90 3ho8 h PRO 623 Ca -0.37 -0.06 0.02 0.00 0.11 0.00 0.00 66.00 65.69 3ho8 h PRO 623 Cb 1.17 -0.22 -0.02 0.00 0.11 0.00 0.00 31.00 32.05 3ho8 h PRO 623 CO 0.60 0.65 0.03 -1.49 -0.21 0.00 0.00 178.00 177.59 3ho8 h TRP 624 N 1.01 0.06 -0.55 0.65 4.06 -1.98 0.22 115.95 119.42 3ho8 h TRP 624 Ca 0.42 0.01 0.11 0.00 2.06 0.00 0.00 58.89 61.49 3ho8 h TRP 624 Cb 0.26 -0.01 -0.09 0.00 -1.00 0.00 0.00 29.16 28.32 3ho8 h TRP 624 CO -0.02 0.02 0.02 0.93 -3.56 0.00 0.00 178.44 175.83 3ho8 h GLU 625 N 0.10 0.13 -0.24 0.49 5.08 -1.95 -0.73 114.58 117.46 3ho8 h GLU 625 Ca 0.06 -0.01 -0.01 0.00 -1.00 0.00 0.00 59.36 58.40 3ho8 h GLU 625 Cb 0.05 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.26 3ho8 h GLU 625 CO -0.08 0.09 0.10 -0.09 -1.00 0.00 0.00 179.01 178.03 3ho8 h ARG 626 N 0.14 0.33 0.00 2.33 2.43 -0.71 0.86 114.38 119.76 3ho8 h ARG 626 Ca 0.28 -0.03 -0.03 0.00 -0.81 0.00 0.00 59.98 59.39 3ho8 h ARG 626 Cb 0.44 -0.07 -0.00 0.00 -0.42 0.00 0.00 29.97 29.92 3ho8 h ARG 626 CO -0.45 0.28 -0.15 1.25 -1.51 0.00 0.00 179.97 179.39 3ho8 h LEU 627 N 0.34 0.00 0.02 3.80 5.85 0.82 -2.65 115.31 123.48 3ho8 h LEU 627 Ca 0.09 0.00 -0.40 0.00 0.84 0.00 0.00 57.88 58.41 3ho8 h LEU 627 Cb 0.07 0.00 -0.06 0.00 0.37 0.00 0.00 40.66 41.04 3ho8 h LEU 627 CO -0.01 0.15 -2.32 -0.62 -0.34 0.00 0.00 178.44 175.29 3ho8 n GLU 628 N -3.31 0.64 -0.09 1.25 1.02 -0.53 -3.18 120.64 116.44 3ho8 n GLU 628 Ca 0.00 0.24 -0.11 0.00 -0.02 0.00 0.00 57.16 57.27 3ho8 n GLU 628 Cb 0.38 -1.56 -0.04 0.00 -0.02 0.00 0.00 31.44 30.21 3ho8 n GLU 628 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3ho8 h ARG 629 N -0.42 0.48 -0.33 3.49 3.08 -0.99 0.40 114.38 120.09 3ho8 h ARG 629 Ca -0.58 -0.15 -0.01 0.00 0.07 0.00 0.00 59.98 59.31 3ho8 h ARG 629 Cb 1.77 -0.04 -0.02 0.00 0.08 0.00 0.00 29.97 31.76 3ho8 h ARG 629 CO -0.19 0.64 0.17 -0.07 -1.07 0.00 0.00 179.97 179.45 3ho8 h LEU 630 N 0.26 0.40 0.14 3.04 3.38 -1.69 -2.73 115.31 118.12 3ho8 h LEU 630 Ca 0.08 -0.03 -0.01 0.00 0.09 0.00 0.00 57.88 58.01 3ho8 h LEU 630 Cb 0.42 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.07 3ho8 h LEU 630 CO 0.01 0.34 -0.07 -0.09 0.09 0.00 0.00 178.44 178.73 3ho8 h ARG 631 N 0.46 -0.18 -1.49 1.13 9.65 -1.42 -2.33 114.38 120.19 3ho8 h ARG 631 Ca 0.12 0.01 0.44 0.00 -1.10 0.00 0.00 59.98 59.45 3ho8 h ARG 631 Cb 0.04 0.04 -0.07 0.00 -1.39 0.00 0.00 29.97 28.59 3ho8 h ARG 631 CO -0.02 0.18 1.06 -0.22 2.80 0.00 0.00 179.97 183.78 3ho8 h LYS 632 N -0.96 0.03 0.00 0.20 1.63 -0.22 -0.81 116.57 116.43 3ho8 h LYS 632 Ca -0.02 -0.00 -0.30 0.00 -0.85 0.00 0.00 60.65 59.48 3ho8 h LYS 632 Cb 0.44 -0.01 -0.05 0.00 -0.60 0.00 0.00 32.23 32.02 3ho8 h LYS 632 CO 0.03 0.02 -1.73 0.00 -3.45 0.00 0.00 179.45 174.32 3ho8 n ALA 633 N -2.79 1.48 -3.79 5.00 0.00 -1.03 -4.58 120.51 114.79 3ho8 n ALA 633 Ca 0.34 -0.77 -0.33 0.00 0.00 0.00 0.00 53.44 52.68 3ho8 n ALA 633 Cb 1.54 -0.84 -0.10 0.00 0.00 0.00 0.00 19.45 20.05 3ho8 n ALA 633 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 3ho8 s ILE 634 N -2.59 3.45 -2.39 0.00 1.01 -0.31 -4.71 121.20 115.65 3ho8 s ILE 634 Ca -0.05 -3.52 0.27 0.00 0.00 0.00 0.00 60.65 57.34 3ho8 s ILE 634 Cb 0.08 -3.24 0.57 0.00 0.01 0.00 0.00 42.46 39.88 3ho8 s ILE 634 CO 0.82 -0.93 1.76 -0.81 0.00 0.00 0.00 174.94 175.78 3ho8 n PRO 635 N 2.82 1.58 -0.07 2.79 -0.04 -1.25 -4.28 135.00 136.56 3ho8 n PRO 635 Ca 0.13 -0.85 -0.09 0.00 -0.04 0.00 0.00 63.50 62.65 3ho8 n PRO 635 Cb 0.36 -1.46 -0.08 0.00 -0.04 0.00 0.00 33.50 32.28 3ho8 n PRO 635 CO 0.00 0.00 0.00 0.27 -0.04 0.00 0.00 175.50 175.73 3ho8 n ASN 636 N 0.04 2.58 -4.89 3.54 6.94 -1.26 -4.64 115.26 117.57 3ho8 n ASN 636 Ca 0.19 -0.05 -0.31 0.00 -0.02 0.00 0.00 54.58 54.39 3ho8 n ASN 636 Cb 0.32 0.15 -0.05 0.00 -2.36 0.00 0.00 39.78 37.84 3ho8 n ASN 636 CO 0.00 0.00 0.00 -0.69 -1.03 0.00 0.00 177.26 175.54 3ho8 s VAL 637 N -2.29 5.05 0.41 3.53 1.01 -1.26 -1.36 120.40 125.49 3ho8 s VAL 637 Ca -0.15 0.17 -0.24 0.00 0.00 0.00 0.00 61.98 61.77 3ho8 s VAL 637 Cb 0.05 -3.65 -0.09 0.00 0.00 0.00 0.00 36.38 32.69 3ho8 s VAL 637 CO 0.39 -0.09 1.07 -0.76 0.00 0.00 0.00 175.10 175.71 3ho8 s LEU 638 N -2.95 4.12 -0.30 3.92 1.43 -1.26 -4.55 118.68 119.09 3ho8 s LEU 638 Ca 0.44 2.08 -0.09 0.00 -1.03 0.00 0.00 54.13 55.53 3ho8 s LEU 638 Cb -0.11 -4.19 -0.01 0.00 0.03 0.00 0.00 46.19 41.90 3ho8 s LEU 638 CO 0.25 -0.56 0.14 -0.36 0.23 0.00 0.00 176.35 176.05 3ho8 s PHE 639 N -1.64 3.16 0.04 0.29 0.40 -1.26 0.69 117.98 119.66 3ho8 s PHE 639 Ca 0.59 -0.51 0.04 0.00 -0.60 0.00 0.00 56.93 56.45 3ho8 s PHE 639 Cb -0.23 -2.33 -0.04 0.00 0.51 0.00 0.00 43.02 40.93 3ho8 s PHE 639 CO 0.29 -0.42 -0.03 -1.14 0.70 0.00 0.00 175.22 174.61 3ho8 s GLN 640 N 1.62 2.56 0.10 0.44 0.74 -0.85 0.51 119.66 124.79 3ho8 s GLN 640 Ca 0.05 -0.76 0.03 0.00 0.05 0.00 0.00 55.36 54.73 3ho8 s GLN 640 Cb -0.17 -2.53 -0.04 0.00 1.10 0.00 0.00 33.01 31.37 3ho8 s GLN 640 CO 0.06 0.58 -0.09 0.00 -0.55 0.00 0.00 175.29 175.29 3ho8 s MET 641 N -1.80 0.86 -0.19 1.67 0.23 -1.26 -2.26 119.30 116.54 3ho8 s MET 641 Ca 0.21 -1.25 -0.13 0.00 -1.03 0.00 0.00 55.69 53.49 3ho8 s MET 641 Cb -0.11 -0.41 -0.05 0.00 -1.53 0.00 0.00 34.83 32.73 3ho8 s MET 641 CO 0.12 0.04 0.27 -1.17 -2.03 0.00 0.00 175.02 172.25 3ho8 s LEU 642 N -2.74 4.19 -0.16 0.18 2.96 -0.98 -0.27 118.68 121.87 3ho8 s LEU 642 Ca 0.09 0.40 -0.03 0.00 -0.22 0.00 0.00 54.13 54.36 3ho8 s LEU 642 Cb 0.01 -2.32 0.05 0.00 0.50 0.00 0.00 46.19 44.43 3ho8 s LEU 642 CO -0.02 0.06 0.04 -0.22 -1.32 0.00 0.00 176.35 174.89 3ho8 s LEU 643 N 0.80 0.87 0.52 -0.68 0.20 0.67 -2.86 118.68 118.19 3ho8 s LEU 643 Ca 0.14 -0.61 -0.21 0.00 0.69 0.00 0.00 54.13 54.14 3ho8 s LEU 643 Cb -0.13 -0.48 -0.06 0.00 -0.43 0.00 0.00 46.19 45.09 3ho8 s LEU 643 CO 0.04 -0.29 1.19 -0.60 -0.29 0.00 0.00 176.35 176.40 3ho8 s ARG 644 N 1.95 3.40 -0.08 1.98 3.52 -0.11 -0.91 118.95 128.70 3ho8 s ARG 644 Ca 0.01 1.81 -0.27 0.00 -0.13 0.00 0.00 55.73 57.15 3ho8 s ARG 644 Cb -0.16 -2.18 -0.23 0.00 -1.56 0.00 0.00 34.95 30.82 3ho8 s ARG 644 CO -0.07 -0.86 1.00 0.00 -0.81 0.00 0.00 175.30 174.56 3ho8 h ALA 645 N 1.49 0.01 -0.95 6.12 0.00 -0.96 -1.41 119.26 123.56 3ho8 h ALA 645 Ca -0.50 -0.41 0.02 0.00 0.00 0.00 0.00 54.91 54.02 3ho8 h ALA 645 Cb 1.27 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 19.01 3ho8 h ALA 645 CO 0.58 -0.05 0.63 0.66 0.00 0.00 0.00 179.25 181.07 3ho8 h SER 646 N -0.68 1.06 0.00 0.00 4.64 -1.85 -3.37 113.55 113.35 3ho8 h SER 646 Ca -0.01 -0.02 0.00 0.00 -0.47 0.00 0.00 61.79 61.29 3ho8 h SER 646 Cb 0.85 -0.25 0.00 0.00 -0.31 0.00 0.00 62.40 62.69 3ho8 h SER 646 CO 0.02 0.74 0.00 -0.46 -0.87 0.00 0.00 176.83 176.26 3ho8 n ASN 647 N -4.42 0.00 0.00 4.97 0.23 -1.26 -4.01 115.26 110.77 3ho8 n ASN 647 Ca 0.12 -1.00 0.00 0.00 -0.53 0.00 0.00 54.58 53.17 3ho8 n ASN 647 Cb 0.06 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 37.76 3ho8 n ASN 647 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 3ho8 n ALA 648 N 0.00 0.00 -1.18 -2.53 0.00 -0.53 -1.42 120.51 114.86 3ho8 n ALA 648 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 3ho8 n ALA 648 Cb 0.49 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.94 3ho8 n ALA 648 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 177.50 179.05 3ho8 n VAL 649 N 0.00 0.00 -0.91 0.00 3.14 -1.26 -0.94 118.33 118.36 3ho8 n VAL 649 Ca 0.00 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.38 3ho8 n VAL 649 Cb 0.00 1.26 0.00 0.00 -1.06 0.00 0.00 33.84 34.04 3ho8 n VAL 649 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 3ho8 n GLY 650 N 0.00 -1.31 0.36 7.55 0.00 -0.51 -4.70 105.19 106.59 3ho8 n GLY 650 Ca 0.00 -1.64 -0.18 0.00 0.00 0.00 0.00 46.02 44.20 3ho8 n GLY 650 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 173.32 174.90 3ho8 n TYR 651 N -2.04 0.00 -0.92 1.61 0.18 -1.26 -4.99 117.16 109.75 3ho8 n TYR 651 Ca 0.00 0.00 0.00 0.00 1.88 0.00 0.00 57.90 59.78 3ho8 n TYR 651 Cb 0.00 -0.66 0.00 0.00 -0.38 0.00 0.00 39.34 38.30 3ho8 n TYR 651 CO 0.00 0.00 0.00 0.36 -2.08 0.00 0.00 176.86 175.14 3ho8 n LYS 652 N -3.66 1.89 -4.37 -3.48 2.85 -1.26 -5.10 118.16 105.02 3ho8 n LYS 652 Ca -0.35 0.00 -0.33 0.00 -1.05 0.00 0.00 58.31 56.58 3ho8 n LYS 652 Cb 0.77 0.00 -0.09 0.00 -0.65 0.00 0.00 35.03 35.06 3ho8 n LYS 652 CO 0.00 0.00 0.00 1.21 -0.05 0.00 0.00 177.40 178.56 3ho8 s ASN 653 N -1.00 5.00 0.09 -5.58 3.84 -1.26 -4.74 114.94 111.29 3ho8 s ASN 653 Ca 0.00 -0.00 0.05 0.00 0.21 0.00 0.00 52.86 53.12 3ho8 s ASN 653 Cb 0.00 -1.30 -0.03 0.00 -0.55 0.00 0.00 41.25 39.37 3ho8 s ASN 653 CO 0.00 0.31 -0.14 -0.31 -2.79 0.00 0.00 177.10 174.17 3ho8 s TYR 654 N -1.00 1.27 0.92 0.43 1.51 -1.26 -5.04 117.35 114.19 3ho8 s TYR 654 Ca 0.17 -0.51 -0.12 0.00 -1.01 0.00 0.00 57.07 55.60 3ho8 s TYR 654 Cb -0.11 -0.70 0.14 0.00 -0.11 0.00 0.00 41.96 41.18 3ho8 s TYR 654 CO 0.07 0.08 1.12 -1.25 -1.11 0.00 0.00 175.55 174.46 3ho8 s PRO 655 N -2.13 1.11 0.61 -1.71 0.04 -1.26 -4.53 135.00 127.12 3ho8 s PRO 655 Ca 0.02 0.43 0.37 0.00 0.04 0.00 0.00 61.00 61.86 3ho8 s PRO 655 Cb -0.08 -1.82 2.02 0.00 0.04 0.00 0.00 34.50 34.66 3ho8 s PRO 655 CO 0.02 -2.25 2.13 -0.44 0.04 0.00 0.00 177.00 176.51 3ho8 h ASP 656 N -1.54 0.00 0.89 6.66 3.32 -1.81 -2.91 116.42 121.02 3ho8 h ASP 656 Ca -0.51 0.00 -0.04 0.00 0.02 0.00 0.00 57.03 56.50 3ho8 h ASP 656 Cb 1.32 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.87 3ho8 h ASP 656 CO 0.60 0.00 -0.47 -1.13 -1.72 0.00 0.00 179.24 176.52 3ho8 h ASN 657 N 0.00 -1.14 1.24 6.45 -0.00 -1.93 -3.25 115.58 116.95 3ho8 h ASN 657 Ca 0.00 0.05 0.00 0.00 -0.00 0.00 0.00 56.30 56.35 3ho8 h ASN 657 Cb 0.18 0.31 0.00 0.00 -0.00 0.00 0.00 38.32 38.81 3ho8 h ASN 657 CO 0.00 -0.76 -0.06 1.33 -0.00 0.00 0.00 177.43 177.93 3ho8 n VAL 658 N -5.47 0.36 -0.01 2.57 0.24 -1.10 -2.93 118.33 111.99 3ho8 n VAL 658 Ca -0.15 -0.18 -0.13 0.00 -2.04 0.00 0.00 64.34 61.84 3ho8 n VAL 658 Cb 0.50 -0.49 -0.09 0.00 -1.47 0.00 0.00 33.84 32.29 3ho8 n VAL 658 CO 0.00 0.00 0.00 0.40 -2.14 0.00 0.00 176.83 175.09 3ho8 h ILE 659 N 0.00 1.32 0.03 1.34 1.08 -1.66 -2.96 117.51 116.65 3ho8 h ILE 659 Ca 0.00 -0.97 0.00 0.00 -0.39 0.00 0.00 64.86 63.50 3ho8 h ILE 659 Cb 0.65 1.91 -0.01 0.00 -3.07 0.00 0.00 36.82 36.30 3ho8 h ILE 659 CO 0.00 0.26 -0.11 0.45 -0.69 0.00 0.00 178.15 178.06 3ho8 h HIS 660 N -0.32 -0.31 -0.92 1.37 3.86 -1.56 -2.03 115.15 115.23 3ho8 h HIS 660 Ca 0.01 0.01 0.13 0.00 -1.16 0.00 0.00 60.37 59.35 3ho8 h HIS 660 Cb 0.43 0.13 -0.07 0.00 1.06 0.00 0.00 27.41 28.95 3ho8 h HIS 660 CO 0.06 -0.12 0.59 0.87 0.86 0.00 0.00 177.93 180.19 3ho8 h LYS 661 N -0.15 0.79 0.73 2.45 6.56 -1.65 0.18 116.57 125.47 3ho8 h LYS 661 Ca -0.00 -0.05 -0.03 0.00 -1.06 0.00 0.00 60.65 59.51 3ho8 h LYS 661 Cb 0.15 -0.18 0.00 0.00 -0.57 0.00 0.00 32.23 31.64 3ho8 h LYS 661 CO -0.06 0.52 -0.41 0.35 -2.06 0.00 0.00 179.45 177.79 3ho8 h PHE 662 N 0.81 -1.08 -0.42 -1.35 3.57 -1.51 -2.10 116.94 114.87 3ho8 h PHE 662 Ca 0.45 -0.02 0.09 0.00 3.53 0.00 0.00 57.97 62.03 3ho8 h PHE 662 Cb 0.60 0.37 -0.09 0.00 2.79 0.00 0.00 35.95 39.63 3ho8 h PHE 662 CO -0.00 -0.63 -0.16 0.28 -2.23 0.00 0.00 178.31 175.56 3ho8 h VAL 663 N -1.06 0.47 -0.55 1.41 2.07 -0.29 0.31 116.25 118.61 3ho8 h VAL 663 Ca -0.10 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.44 3ho8 h VAL 663 Cb 0.84 0.47 -0.03 0.00 -1.52 0.00 0.00 31.29 31.05 3ho8 h VAL 663 CO 0.12 0.00 0.35 1.56 0.02 0.00 0.00 177.57 179.62 3ho8 h GLN 664 N -0.08 0.68 -0.05 1.57 1.08 -0.69 0.06 115.11 117.68 3ho8 h GLN 664 Ca 0.20 -0.04 -0.22 0.00 -1.45 0.00 0.00 58.65 57.14 3ho8 h GLN 664 Cb 0.39 -0.15 0.01 0.00 -0.05 0.00 0.00 27.48 27.67 3ho8 h GLN 664 CO -0.47 0.45 -0.87 0.93 -0.95 0.00 0.00 178.83 177.92 3ho8 h GLU 665 N 0.70 0.53 -0.80 1.46 4.39 -1.16 -1.83 114.58 117.87 3ho8 h GLU 665 Ca 0.21 -0.50 0.08 0.00 0.34 0.00 0.00 59.36 59.48 3ho8 h GLU 665 Cb -0.03 0.13 -0.07 0.00 -0.10 0.00 0.00 28.75 28.68 3ho8 h GLU 665 CO -0.07 1.13 0.47 0.77 -1.16 0.00 0.00 179.01 180.16 3ho8 h SER 666 N 0.33 0.71 1.29 1.42 0.02 0.33 -0.45 113.55 117.18 3ho8 h SER 666 Ca -0.07 0.03 -0.10 0.00 -0.84 0.00 0.00 61.79 60.81 3ho8 h SER 666 Cb 1.49 -0.11 -0.02 0.00 0.14 0.00 0.00 62.40 63.91 3ho8 h SER 666 CO 0.16 0.43 -0.74 0.00 -1.14 0.00 0.00 176.83 175.54 3ho8 h ALA 667 N 1.41 0.68 0.00 3.77 0.00 -1.05 -2.76 119.26 121.32 3ho8 h ALA 667 Ca 0.37 -0.47 0.00 0.00 0.00 0.00 0.00 54.91 54.81 3ho8 h ALA 667 Cb 0.26 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.08 3ho8 h ALA 667 CO -0.21 0.58 0.00 1.17 0.00 0.00 0.00 179.25 180.79 3ho8 n LYS 668 N -3.07 0.18 -0.00 0.00 0.00 -0.69 -3.50 118.16 111.08 3ho8 n LYS 668 Ca -0.01 0.18 0.04 0.00 0.00 0.00 0.00 58.31 58.52 3ho8 n LYS 668 Cb 0.73 -1.73 0.04 0.00 0.00 0.00 0.00 35.03 34.07 3ho8 n LYS 668 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 3ho8 n ALA 669 N -1.71 2.48 0.00 3.14 0.00 -0.25 -5.03 120.51 119.14 3ho8 n ALA 669 Ca 0.06 -0.58 0.00 0.00 0.00 0.00 0.00 53.44 52.91 3ho8 n ALA 669 Cb 0.38 -0.29 0.00 0.00 0.00 0.00 0.00 19.45 19.54 3ho8 n ALA 669 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3ho8 n GLY 670 N 0.48 0.46 3.76 0.00 0.00 -1.18 -4.53 105.19 104.19 3ho8 n GLY 670 Ca 0.05 0.12 -0.41 0.00 0.00 0.00 0.00 46.02 45.78 3ho8 n GLY 670 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 3ho8 n ILE 671 N 0.00 1.48 -2.06 -0.61 2.08 -1.05 -4.70 119.36 114.51 3ho8 n ILE 671 Ca 0.00 -0.37 0.01 0.00 0.56 0.00 0.00 62.75 62.95 3ho8 n ILE 671 Cb 0.00 -1.99 0.00 0.00 -0.75 0.00 0.00 39.64 36.90 3ho8 n ILE 671 CO 0.00 0.00 0.00 0.47 0.56 0.00 0.00 176.55 177.58 3ho8 n ASP 672 N 1.35 0.17 0.00 4.38 9.92 0.18 -4.49 116.55 128.06 3ho8 n ASP 672 Ca 0.05 -2.02 0.00 0.00 -0.53 0.00 0.00 54.79 52.29 3ho8 n ASP 672 Cb 0.38 -0.22 0.00 0.00 -0.64 0.00 0.00 41.12 40.64 3ho8 n ASP 672 CO 0.00 0.00 0.00 0.52 0.13 0.00 0.00 177.20 177.85 3ho8 n VAL 673 N 0.05 0.00 -1.14 2.53 0.31 -0.90 -3.45 118.33 115.73 3ho8 n VAL 673 Ca 0.01 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.34 3ho8 n VAL 673 Cb 0.76 1.56 0.00 0.00 -0.91 0.00 0.00 33.84 35.25 3ho8 n VAL 673 CO 0.00 0.00 0.00 0.49 -1.32 0.00 0.00 176.83 176.00 3ho8 n PHE 674 N 0.00 0.00 -2.34 3.52 3.72 -1.22 -3.58 117.46 117.56 3ho8 n PHE 674 Ca 0.00 0.00 -0.42 0.00 -0.05 0.00 0.00 57.45 56.98 3ho8 n PHE 674 Cb 0.33 0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 38.85 3ho8 n PHE 674 CO 0.00 0.00 0.00 0.50 -0.05 0.00 0.00 176.76 177.21 3ho8 s ARG 675 N -0.64 3.33 -0.14 -1.08 3.52 0.63 -1.90 118.95 122.67 3ho8 s ARG 675 Ca 0.00 0.63 -0.14 0.00 -0.13 0.00 0.00 55.73 56.09 3ho8 s ARG 675 Cb 0.00 -4.12 -0.05 0.00 -1.56 0.00 0.00 34.95 29.23 3ho8 s ARG 675 CO 0.00 -1.89 0.32 0.42 -0.81 0.00 0.00 175.30 173.34 3ho8 s ILE 676 N 6.12 5.28 0.10 4.11 1.01 0.18 -0.24 121.20 137.74 3ho8 s ILE 676 Ca 0.57 0.61 -0.02 0.00 0.00 0.00 0.00 60.65 61.80 3ho8 s ILE 676 Cb -0.12 -3.65 -0.04 0.00 0.01 0.00 0.00 42.46 38.66 3ho8 s ILE 676 CO 0.27 0.41 0.04 0.72 0.00 0.00 0.00 174.94 176.39 3ho8 s PHE 677 N 0.26 0.63 -0.06 3.97 -0.71 -0.08 -2.47 117.98 119.52 3ho8 s PHE 677 Ca 0.18 -1.08 0.03 0.00 -1.04 0.00 0.00 56.93 55.02 3ho8 s PHE 677 Cb -0.14 -0.38 0.01 0.00 -1.21 0.00 0.00 43.02 41.30 3ho8 s PHE 677 CO 0.05 -0.48 -0.15 0.34 -1.34 0.00 0.00 175.22 173.65 3ho8 s ASP 678 N -2.97 2.00 0.10 1.98 -1.08 -1.26 -0.30 116.67 115.13 3ho8 s ASP 678 Ca 0.15 -0.34 0.06 0.00 -0.52 0.00 0.00 52.55 51.90 3ho8 s ASP 678 Cb 0.07 -0.79 0.33 0.00 -1.46 0.00 0.00 42.92 41.07 3ho8 s ASP 678 CO -0.04 0.09 1.14 -1.20 0.52 0.00 0.00 175.17 175.67 3ho8 n SER 679 N 3.55 0.16 -0.04 -0.34 7.64 -1.26 -1.75 113.62 121.57 3ho8 n SER 679 Ca -0.21 0.53 0.01 0.00 1.01 0.00 0.00 58.87 60.21 3ho8 n SER 679 Cb 0.52 -0.54 0.01 0.00 -1.01 0.00 0.00 64.21 63.19 3ho8 n SER 679 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 3ho8 n LEU 680 N -1.68 0.93 -3.92 -3.43 4.77 -1.26 -4.23 117.00 108.18 3ho8 n LEU 680 Ca -0.00 -1.06 -0.27 0.00 -0.03 0.00 0.00 56.01 54.65 3ho8 n LEU 680 Cb 0.07 -0.03 0.00 0.00 -2.33 0.00 0.00 43.42 41.14 3ho8 n LEU 680 CO 0.03 0.26 -0.09 0.59 -1.33 0.00 0.00 177.39 176.85 3ho8 n ASN 681 N -0.29 -1.90 -4.40 -1.43 3.02 -0.72 -4.63 115.26 104.91 3ho8 n ASN 681 Ca 0.01 -0.91 -0.42 0.00 -0.03 0.00 0.00 54.58 53.23 3ho8 n ASN 681 Cb 0.43 -3.45 -0.10 0.00 -0.61 0.00 0.00 39.78 36.04 3ho8 n ASN 681 CO 0.00 0.00 0.00 0.86 -2.62 0.00 0.00 177.26 175.50 3ho8 s TRP 682 N -3.65 3.25 0.13 3.10 -0.00 -1.26 -4.97 118.94 115.54 3ho8 s TRP 682 Ca 0.25 -0.88 0.30 0.00 -0.00 0.00 0.00 56.10 55.76 3ho8 s TRP 682 Cb -0.13 -2.67 1.19 0.00 -0.00 0.00 0.00 33.47 31.87 3ho8 s TRP 682 CO 0.86 -0.67 1.93 0.28 -0.00 0.00 0.00 176.95 179.34 3ho8 h VAL 683 N 5.79 0.24 -0.85 5.86 2.07 -1.96 -2.91 116.25 124.49 3ho8 h VAL 683 Ca -0.26 -0.75 0.01 0.00 0.82 0.00 0.00 66.70 66.53 3ho8 h VAL 683 Cb 1.11 1.60 -0.04 0.00 -1.52 0.00 0.00 31.29 32.44 3ho8 h VAL 683 CO 0.74 0.09 0.56 -0.78 0.02 0.00 0.00 177.57 178.19 3ho8 h ASP 684 N 0.00 0.96 1.74 0.57 1.82 -2.01 -2.78 116.42 116.73 3ho8 h ASP 684 Ca -0.00 -0.02 0.00 0.00 -0.39 0.00 0.00 57.03 56.62 3ho8 h ASP 684 Cb 0.60 -0.23 0.00 0.00 0.68 0.00 0.00 39.33 40.37 3ho8 h ASP 684 CO 0.01 0.68 0.00 -0.61 -1.61 0.00 0.00 179.24 177.72 3ho8 h GLN 685 N 1.13 0.00 0.00 0.28 5.75 -1.93 -3.05 115.11 117.29 3ho8 h GLN 685 Ca 0.32 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.82 3ho8 h GLN 685 Cb -0.10 0.00 0.00 0.00 1.07 0.00 0.00 27.48 28.45 3ho8 h GLN 685 CO -0.08 0.00 0.00 -1.33 -2.65 0.00 0.00 178.83 174.77 3ho8 n MET 686 N -2.92 0.16 0.00 1.69 2.81 -1.05 -4.32 117.12 113.49 3ho8 n MET 686 Ca 0.04 0.24 0.00 0.00 -1.81 0.00 0.00 57.70 56.17 3ho8 n MET 686 Cb 0.47 -1.73 0.00 0.00 -0.71 0.00 0.00 33.22 31.26 3ho8 n MET 686 CO 0.00 0.00 0.00 1.17 1.51 0.00 0.00 175.97 178.65 3ho8 n LYS 687 N -2.01 0.00 -0.19 0.03 4.81 -1.15 -0.41 118.16 119.24 3ho8 n LYS 687 Ca 0.04 0.57 -0.04 0.00 -0.87 0.00 0.00 58.31 58.02 3ho8 n LYS 687 Cb 0.32 -1.37 0.02 0.00 0.02 0.00 0.00 35.03 34.01 3ho8 n LYS 687 CO 0.00 0.00 0.00 0.28 1.17 0.00 0.00 177.40 178.85 3ho8 h VAL 688 N 0.00 0.23 -0.51 3.15 2.07 -1.83 0.12 116.25 119.48 3ho8 h VAL 688 Ca 0.00 0.00 0.10 0.00 0.82 0.00 0.00 66.70 67.62 3ho8 h VAL 688 Cb 0.00 0.23 -0.10 0.00 -1.52 0.00 0.00 31.29 29.90 3ho8 h VAL 688 CO 0.00 0.00 -0.23 0.00 0.02 0.00 0.00 177.57 177.36 3ho8 h ALA 689 N 1.14 0.14 -0.53 1.67 0.00 -1.77 0.20 119.26 120.12 3ho8 h ALA 689 Ca 0.24 0.18 -0.01 0.00 0.00 0.00 0.00 54.91 55.32 3ho8 h ALA 689 Cb 0.53 0.56 -0.02 0.00 0.00 0.00 0.00 17.79 18.86 3ho8 h ALA 689 CO -0.65 -0.56 0.27 -0.97 0.00 0.00 0.00 179.25 177.34 3ho8 h ASN 690 N -0.11 0.67 1.32 0.00 -1.24 0.12 -2.84 115.58 113.51 3ho8 h ASN 690 Ca 0.24 -0.11 -0.05 0.00 0.71 0.00 0.00 56.30 57.08 3ho8 h ASN 690 Cb 0.48 -0.17 -0.01 0.00 0.73 0.00 0.00 38.32 39.35 3ho8 h ASN 690 CO -0.58 0.59 -0.24 -0.33 -1.29 0.00 0.00 177.43 175.59 3ho8 h GLU 691 N 0.70 0.00 0.00 6.67 5.08 0.04 -2.06 114.58 125.01 3ho8 h GLU 691 Ca 0.18 0.00 -0.06 0.00 -1.00 0.00 0.00 59.36 58.48 3ho8 h GLU 691 Cb 0.08 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.33 3ho8 h GLU 691 CO -0.03 0.24 -0.40 0.00 -1.00 0.00 0.00 179.01 177.82 3ho8 h ALA 692 N 1.76 0.79 0.10 3.43 0.00 -0.59 -3.26 119.26 121.49 3ho8 h ALA 692 Ca -0.00 -0.26 -0.18 0.00 0.00 0.00 0.00 54.91 54.46 3ho8 h ALA 692 Cb 0.96 -0.02 0.02 0.00 0.00 0.00 0.00 17.79 18.75 3ho8 h ALA 692 CO 0.03 0.34 -0.77 0.28 0.00 0.00 0.00 179.25 179.13 3ho8 h VAL 693 N 0.00 1.48 -0.70 0.00 2.07 -1.23 -3.15 116.25 114.72 3ho8 h VAL 693 Ca -0.01 -2.40 0.13 0.00 0.82 0.00 0.00 66.70 65.23 3ho8 h VAL 693 Cb 1.21 3.00 -0.09 0.00 -1.52 0.00 0.00 31.29 33.90 3ho8 h VAL 693 CO 0.03 0.69 0.25 1.56 0.02 0.00 0.00 177.57 180.12 3ho8 h GLN 694 N -0.26 0.39 -0.13 1.57 1.08 -1.48 0.11 115.11 116.38 3ho8 h GLN 694 Ca -0.12 -0.02 -0.08 0.00 -1.45 0.00 0.00 58.65 56.97 3ho8 h GLN 694 Cb 1.56 -0.09 -0.01 0.00 -0.05 0.00 0.00 27.48 28.89 3ho8 h GLN 694 CO 0.15 0.26 -0.27 1.49 -0.95 0.00 0.00 178.83 179.50 3ho8 h GLU 695 N 0.40 0.24 0.00 1.46 4.81 -1.69 -2.65 114.58 117.14 3ho8 h GLU 695 Ca 0.37 -0.08 0.00 0.00 -0.13 0.00 0.00 59.36 59.52 3ho8 h GLU 695 Cb 0.54 -0.02 0.00 0.00 0.63 0.00 0.00 28.75 29.90 3ho8 h GLU 695 CO -0.38 0.50 0.00 0.00 -0.73 0.00 0.00 179.01 178.39 3ho8 n ALA 696 N -2.48 1.91 -1.11 2.92 0.00 0.32 -4.89 120.51 117.18 3ho8 n ALA 696 Ca -0.01 -0.07 -0.04 0.00 0.00 0.00 0.00 53.44 53.32 3ho8 n ALA 696 Cb 0.37 -1.31 -0.02 0.00 0.00 0.00 0.00 19.45 18.49 3ho8 n ALA 696 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3ho8 n GLY 697 N 0.47 0.63 3.83 0.00 0.00 -0.87 -4.99 105.19 104.26 3ho8 n GLY 697 Ca 0.06 -0.26 -0.23 0.00 0.00 0.00 0.00 46.02 45.59 3ho8 n GLY 697 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3ho8 s LYS 698 N -1.69 2.38 0.35 1.61 -0.14 -1.24 -4.68 119.74 116.34 3ho8 s LYS 698 Ca 0.00 -1.71 -0.27 0.00 -1.36 0.00 0.00 55.97 52.62 3ho8 s LYS 698 Cb 0.00 -2.20 -0.09 0.00 -1.68 0.00 0.00 37.83 33.86 3ho8 s LYS 698 CO 0.00 -0.22 1.20 0.42 -0.76 0.00 0.00 175.35 175.99 3ho8 s ILE 699 N -2.56 3.07 -0.23 2.17 1.01 -1.22 -4.67 121.20 118.77 3ho8 s ILE 699 Ca 0.44 0.99 0.02 0.00 0.00 0.00 0.00 60.65 62.10 3ho8 s ILE 699 Cb -0.00 -3.60 0.05 0.00 0.01 0.00 0.00 42.46 38.91 3ho8 s ILE 699 CO 0.25 0.18 -0.13 -0.55 0.00 0.00 0.00 174.94 174.69 3ho8 s SER 700 N -0.86 3.94 -0.54 3.58 0.15 -1.26 -3.42 113.70 115.29 3ho8 s SER 700 Ca 0.52 -1.13 -0.21 0.00 0.70 0.00 0.00 55.95 55.83 3ho8 s SER 700 Cb -0.34 -1.47 0.06 0.00 -1.71 0.00 0.00 66.02 62.56 3ho8 s SER 700 CO 0.44 -0.14 0.74 -0.70 1.20 0.00 0.00 173.24 174.78 3ho8 s GLU 701 N 1.21 3.16 -0.08 5.44 2.12 -0.80 -2.39 118.70 127.37 3ho8 s GLU 701 Ca -0.04 -0.78 -0.30 0.00 0.36 0.00 0.00 54.97 54.21 3ho8 s GLU 701 Cb -0.18 -4.12 -0.03 0.00 0.26 0.00 0.00 34.13 30.07 3ho8 s GLU 701 CO -0.07 -1.37 1.18 0.20 -0.54 0.00 0.00 175.26 174.65 3ho8 s GLY 702 N 2.92 2.08 0.02 -1.50 0.00 0.12 -0.65 107.32 110.32 3ho8 s GLY 702 Ca 0.19 0.57 0.08 0.00 0.00 0.00 0.00 44.72 45.55 3ho8 s GLY 702 CO 0.13 2.20 -0.23 -1.59 0.00 0.00 0.00 173.10 173.61 3ho8 s THR 703 N 2.33 1.81 -0.13 0.90 2.01 -1.03 -0.15 115.64 121.38 3ho8 s THR 703 Ca 0.55 -1.16 -0.02 0.00 0.31 0.00 0.00 61.69 61.36 3ho8 s THR 703 Cb -0.23 -1.55 -0.03 0.00 0.01 0.00 0.00 72.50 70.71 3ho8 s THR 703 CO 0.20 0.34 -0.06 -0.63 -0.69 0.00 0.00 174.62 173.79 3ho8 s ILE 704 N -0.71 3.75 0.14 1.82 1.01 -0.90 -4.73 121.20 121.59 3ho8 s ILE 704 Ca 0.09 -0.42 -0.28 0.00 0.00 0.00 0.00 60.65 60.04 3ho8 s ILE 704 Cb -0.09 -2.61 -0.07 0.00 0.01 0.00 0.00 42.46 39.70 3ho8 s ILE 704 CO 0.01 0.52 0.86 0.00 0.00 0.00 0.00 174.94 176.34 3ho8 s TYR 706 N -0.62 3.19 0.14 0.00 5.04 0.27 -4.93 117.35 120.43 3ho8 s TYR 706 Ca 0.41 0.02 0.07 0.00 -2.44 0.00 0.00 57.07 55.13 3ho8 s TYR 706 Cb -0.23 -2.80 -0.04 0.00 0.35 0.00 0.00 41.96 39.23 3ho8 s TYR 706 CO 0.28 -0.51 -0.17 0.99 -1.34 0.00 0.00 175.55 174.80 3ho8 s THR 707 N 2.19 1.61 0.00 4.34 2.01 -1.26 -4.67 115.64 119.85 3ho8 s THR 707 Ca 0.15 -1.76 0.00 0.00 0.31 0.00 0.00 61.69 60.39 3ho8 s THR 707 Cb -0.16 -1.66 0.00 0.00 0.01 0.00 0.00 72.50 70.69 3ho8 s THR 707 CO 0.13 -0.30 0.00 0.61 -0.69 0.00 0.00 174.62 174.37 3ho8 n GLY 708 N 0.56 0.36 3.46 4.40 0.00 -1.26 -4.89 105.19 107.81 3ho8 n GLY 708 Ca -0.15 -1.37 0.01 0.00 0.00 0.00 0.00 46.02 44.51 3ho8 n GLY 708 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3ho8 s ASP 709 N -4.00 -0.95 0.41 1.61 3.68 -1.26 -4.93 116.67 111.23 3ho8 s ASP 709 Ca 0.00 1.13 0.22 0.00 2.13 0.00 0.00 52.55 56.03 3ho8 s ASP 709 Cb 0.00 2.01 0.29 0.00 -1.45 0.00 0.00 42.92 43.77 3ho8 s ASP 709 CO 0.00 -0.18 1.57 0.16 0.13 0.00 0.00 175.17 176.85 3ho8 h ILE 710 N 5.79 0.14 -0.13 4.11 3.07 -1.90 -3.26 117.51 125.33 3ho8 h ILE 710 Ca -0.18 -1.19 -0.16 0.00 1.55 0.00 0.00 64.86 64.89 3ho8 h ILE 710 Cb 1.12 2.06 -0.01 0.00 -0.27 0.00 0.00 36.82 39.72 3ho8 h ILE 710 CO 0.10 0.08 -0.58 -0.07 -1.05 0.00 0.00 178.15 176.63 3ho8 h LEU 711 N 0.00 0.45 -8.39 0.16 3.38 -1.96 -3.41 115.31 105.54 3ho8 h LEU 711 Ca -0.00 -0.25 -0.66 0.00 0.09 0.00 0.00 57.88 57.06 3ho8 h LEU 711 Cb 1.06 -0.13 -0.16 0.00 0.09 0.00 0.00 40.66 41.52 3ho8 h LEU 711 CO 0.01 0.94 0.24 0.21 0.09 0.00 0.00 178.44 179.92 3ho8 s ASN 712 N -6.92 6.25 0.66 -0.43 3.04 -1.23 -4.94 114.94 111.37 3ho8 s ASN 712 Ca -0.06 -0.80 0.32 0.00 0.04 0.00 0.00 52.86 52.37 3ho8 s ASN 712 Cb 0.12 -2.34 1.76 0.00 -1.54 0.00 0.00 41.25 39.25 3ho8 s ASN 712 CO 0.82 -1.04 1.99 -0.65 -3.04 0.00 0.00 177.10 175.18 3ho8 h PRO 713 N 9.14 0.00 -1.03 0.43 0.11 -1.85 -2.54 132.00 136.26 3ho8 h PRO 713 Ca -0.27 0.00 -0.38 0.00 0.11 0.00 0.00 66.00 65.45 3ho8 h PRO 713 Cb 1.09 0.00 -0.40 0.00 0.11 0.00 0.00 31.00 31.79 3ho8 h PRO 713 CO 1.03 0.00 -1.14 -0.85 -0.21 0.00 0.00 178.00 176.83 3ho8 n GLU 714 N -2.91 1.47 0.06 1.05 -0.00 -1.26 -4.78 120.64 114.27 3ho8 n GLU 714 Ca -0.02 -3.42 -0.10 0.00 -0.00 0.00 0.00 57.16 53.61 3ho8 n GLU 714 Cb 0.32 -1.39 -0.07 0.00 -0.00 0.00 0.00 31.44 30.30 3ho8 n GLU 714 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.13 177.04 3ho8 h ARG 715 N 2.92 -0.23 -5.09 3.44 1.12 -1.72 -3.46 114.38 111.35 3ho8 h ARG 715 Ca -0.05 0.02 -0.34 0.00 -1.11 0.00 0.00 59.98 58.49 3ho8 h ARG 715 Cb 1.16 0.05 -0.17 0.00 -0.01 0.00 0.00 29.97 31.00 3ho8 h ARG 715 CO 0.53 0.18 -0.73 0.45 -3.11 0.00 0.00 179.97 177.29 3ho8 s SER 716 N -5.44 1.68 -0.21 -3.80 0.15 -1.26 -5.03 113.70 99.79 3ho8 s SER 716 Ca -0.12 -0.88 0.11 0.00 0.70 0.00 0.00 55.95 55.76 3ho8 s SER 716 Cb 0.00 -0.01 0.66 0.00 -1.71 0.00 0.00 66.02 64.96 3ho8 s SER 716 CO 0.45 -0.26 1.55 0.59 1.20 0.00 0.00 173.24 176.78 3ho8 n ASN 717 N 0.31 4.76 0.00 5.45 4.13 -1.26 -4.49 115.26 124.16 3ho8 n ASN 717 Ca -0.14 -2.83 0.00 0.00 1.68 0.00 0.00 54.58 53.29 3ho8 n ASN 717 Cb 0.58 -0.67 0.00 0.00 -1.54 0.00 0.00 39.78 38.16 3ho8 n ASN 717 CO 0.00 0.00 0.00 -0.38 0.28 0.00 0.00 177.26 177.16 3ho8 n ILE 717 N 0.36 0.00 -2.38 2.41 2.08 -1.26 -4.92 119.36 115.65 3ho8 n ILE 717 Ca 0.26 0.00 -0.41 0.00 0.56 0.00 0.00 62.75 63.16 3ho8 n ILE 717 Cb 1.08 -0.96 0.01 0.00 -0.75 0.00 0.00 39.64 39.02 3ho8 n ILE 717 CO 0.00 0.00 0.00 -1.22 0.56 0.00 0.00 176.55 175.89 3ho8 n TYR 718 N -2.69 2.67 -2.44 1.39 4.02 -1.26 -4.75 117.16 114.10 3ho8 n TYR 718 Ca 0.00 -2.68 -0.10 0.00 -0.01 0.00 0.00 57.90 55.11 3ho8 n TYR 718 Cb 0.27 -1.50 0.05 0.00 -0.02 0.00 0.00 39.34 38.15 3ho8 n TYR 718 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 176.86 176.10 3ho8 n THR 719 N 0.89 0.00 0.04 -0.72 -2.24 -1.26 -4.53 114.28 106.46 3ho8 n THR 719 Ca 0.52 -0.68 -0.13 0.00 -2.27 0.00 0.00 64.05 61.49 3ho8 n THR 719 Cb 0.26 -1.14 -0.02 0.00 -2.10 0.00 0.00 70.33 67.33 3ho8 n THR 719 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 3ho8 h LEU 720 N 0.00 0.60 -2.04 3.22 5.85 -1.94 -2.84 115.31 118.16 3ho8 h LEU 720 Ca -0.14 -0.42 -0.01 0.00 0.84 0.00 0.00 57.88 58.15 3ho8 h LEU 720 Cb 0.52 -0.18 -0.00 0.00 0.37 0.00 0.00 40.66 41.37 3ho8 h LEU 720 CO 0.15 1.19 -0.07 -0.08 -0.34 0.00 0.00 178.44 179.29 3ho8 h GLU 721 N 0.32 0.00 -0.03 1.25 4.81 -1.96 -3.17 114.58 115.80 3ho8 h GLU 721 Ca -0.05 0.00 -0.14 0.00 -0.13 0.00 0.00 59.36 59.04 3ho8 h GLU 721 Cb 1.41 0.00 0.01 0.00 0.63 0.00 0.00 28.75 30.80 3ho8 h GLU 721 CO 0.15 0.07 -0.53 -0.92 -0.73 0.00 0.00 179.01 177.05 3ho8 h TYR 722 N 0.00 0.59 -0.25 0.92 3.20 -1.80 -3.29 116.97 116.34 3ho8 h TYR 722 Ca -0.00 -0.30 -0.19 0.00 3.14 0.00 0.00 58.73 61.38 3ho8 h TYR 722 Cb 0.30 -0.07 0.00 0.00 1.54 0.00 0.00 36.73 38.50 3ho8 h TYR 722 CO 0.00 1.10 -0.59 1.88 -1.64 0.00 0.00 178.16 178.91 3ho8 h TYR 723 N -0.09 1.03 -0.53 -3.82 -1.99 -1.50 -3.02 116.97 107.04 3ho8 h TYR 723 Ca -0.06 -0.38 0.07 0.00 2.00 0.00 0.00 58.73 60.35 3ho8 h TYR 723 Cb 1.22 -0.19 -0.06 0.00 2.00 0.00 0.00 36.73 39.71 3ho8 h TYR 723 CO 0.14 1.20 0.22 0.28 -0.00 0.00 0.00 178.16 180.01 3ho8 h VAL 724 N 0.61 0.86 -0.75 -2.88 2.07 -1.71 -0.20 116.25 114.26 3ho8 h VAL 724 Ca 0.00 -0.15 -0.04 0.00 0.82 0.00 0.00 66.70 67.34 3ho8 h VAL 724 Cb 1.20 0.40 -0.03 0.00 -1.52 0.00 0.00 31.29 31.33 3ho8 h VAL 724 CO 0.13 0.08 0.33 0.50 0.02 0.00 0.00 177.57 178.62 3ho8 h LYS 725 N 0.43 1.09 -0.31 1.57 3.11 -1.62 0.18 116.57 121.02 3ho8 h LYS 725 Ca 0.25 -0.17 -0.07 0.00 -2.81 0.00 0.00 60.65 57.85 3ho8 h LYS 725 Cb 0.24 -0.19 -0.02 0.00 -1.00 0.00 0.00 32.23 31.26 3ho8 h LYS 725 CO -0.23 0.86 -0.10 -0.07 -2.81 0.00 0.00 179.45 177.11 3ho8 h LEU 726 N 1.08 0.50 -0.10 5.20 4.07 -1.31 -3.01 115.31 121.74 3ho8 h LEU 726 Ca 0.26 -0.12 -0.11 0.00 0.08 0.00 0.00 57.88 57.98 3ho8 h LEU 726 Cb 0.16 -0.13 0.00 0.00 1.08 0.00 0.00 40.66 41.77 3ho8 h LEU 726 CO -0.03 0.64 -0.37 0.00 -1.08 0.00 0.00 178.44 177.61 3ho8 h ALA 727 N 1.41 0.18 -0.01 1.53 0.00 -0.13 -2.92 119.26 119.32 3ho8 h ALA 727 Ca 0.09 -0.45 0.00 0.00 0.00 0.00 0.00 54.91 54.55 3ho8 h ALA 727 Cb 0.46 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.24 3ho8 h ALA 727 CO 0.03 0.26 0.01 0.87 0.00 0.00 0.00 179.25 180.42 3ho8 h LYS 728 N -0.01 0.00 0.05 0.00 1.57 -0.70 -2.74 116.57 114.73 3ho8 h LYS 728 Ca -0.02 0.00 -0.15 0.00 -1.87 0.00 0.00 60.65 58.62 3ho8 h LYS 728 Cb 1.00 0.00 0.01 0.00 0.08 0.00 0.00 32.23 33.32 3ho8 h LYS 728 CO 0.08 0.00 -0.60 1.49 -0.57 0.00 0.00 179.45 179.85 3ho8 h GLU 729 N 0.00 0.32 -0.00 3.15 4.81 -1.48 -3.15 114.58 118.24 3ho8 h GLU 729 Ca 0.01 -0.41 -0.02 0.00 -0.13 0.00 0.00 59.36 58.81 3ho8 h GLU 729 Cb 0.04 0.13 -0.00 0.00 0.63 0.00 0.00 28.75 29.54 3ho8 h GLU 729 CO -0.00 1.12 -0.08 -0.07 -0.73 0.00 0.00 179.01 179.25 3ho8 h LEU 730 N -0.28 0.00 -0.23 1.64 3.38 -1.29 0.12 115.31 118.65 3ho8 h LEU 730 Ca -0.09 -0.00 -0.11 0.00 0.09 0.00 0.00 57.88 57.77 3ho8 h LEU 730 Cb 1.37 -0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.12 3ho8 h LEU 730 CO 0.12 0.09 -0.30 -0.08 0.09 0.00 0.00 178.44 178.35 3ho8 h GLU 731 N 0.00 0.61 -0.07 1.13 4.81 -1.63 0.14 114.58 119.57 3ho8 h GLU 731 Ca -0.00 -0.35 -0.08 0.00 -0.13 0.00 0.00 59.36 58.80 3ho8 h GLU 731 Cb 0.15 0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.54 3ho8 h GLU 731 CO 0.01 0.96 -0.30 0.00 -0.73 0.00 0.00 179.01 178.95 3ho8 h ARG 732 N 0.31 0.13 -0.18 1.92 2.47 -1.25 0.16 114.38 117.94 3ho8 h ARG 732 Ca 0.03 -0.05 0.00 0.00 -1.26 0.00 0.00 59.98 58.70 3ho8 h ARG 732 Cb 0.88 -0.01 0.00 0.00 -1.65 0.00 0.00 29.97 29.19 3ho8 h ARG 732 CO 0.07 0.43 0.00 0.39 0.56 0.00 0.00 179.97 181.42 3ho8 n GLU 733 N -4.14 1.45 -2.16 0.04 -0.58 0.34 -4.93 120.64 110.65 3ho8 n GLU 733 Ca -0.01 -0.70 -0.01 0.00 -0.42 0.00 0.00 57.16 56.02 3ho8 n GLU 733 Cb 0.38 -1.19 0.00 0.00 -0.57 0.00 0.00 31.44 30.05 3ho8 n GLU 733 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3ho8 n GLY 734 N 0.85 0.49 3.81 0.62 0.00 0.55 -5.02 105.19 106.49 3ho8 n GLY 734 Ca 0.08 -0.80 -0.36 0.00 0.00 0.00 0.00 46.02 44.95 3ho8 n GLY 734 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3ho8 s PHE 735 N -2.30 3.58 0.02 1.61 0.40 0.41 -4.99 117.98 116.71 3ho8 s PHE 735 Ca 0.01 1.54 -0.16 0.00 -0.60 0.00 0.00 56.93 57.72 3ho8 s PHE 735 Cb -0.00 -2.75 -0.35 0.00 0.51 0.00 0.00 43.02 40.42 3ho8 s PHE 735 CO 0.01 0.20 0.98 0.45 0.70 0.00 0.00 175.22 177.56 3ho8 h HIS 736 N 2.98 0.96 -3.46 0.36 3.86 -1.80 -3.43 115.15 114.61 3ho8 h HIS 736 Ca -0.48 -0.70 -0.35 0.00 -1.16 0.00 0.00 60.37 57.68 3ho8 h HIS 736 Cb 1.19 -0.04 -0.35 0.00 1.06 0.00 0.00 27.41 29.27 3ho8 h HIS 736 CO 0.62 1.56 -0.75 0.42 0.86 0.00 0.00 177.93 180.64 3ho8 s ILE 737 N -2.59 0.16 -0.13 2.45 1.01 -1.18 -4.60 121.20 116.33 3ho8 s ILE 737 Ca -0.10 0.13 -0.26 0.00 0.00 0.00 0.00 60.65 60.42 3ho8 s ILE 737 Cb 0.04 -0.28 -0.02 0.00 0.01 0.00 0.00 42.46 42.21 3ho8 s ILE 737 CO 0.94 0.16 0.83 -0.22 0.00 0.00 0.00 174.94 176.64 3ho8 s LEU 738 N 1.22 4.22 0.16 2.97 2.96 -1.02 0.16 118.68 129.36 3ho8 s LEU 738 Ca -0.07 1.24 0.11 0.00 -0.22 0.00 0.00 54.13 55.19 3ho8 s LEU 738 Cb -0.13 -3.25 -0.04 0.00 0.50 0.00 0.00 46.19 43.26 3ho8 s LEU 738 CO -0.02 -0.33 -0.22 0.00 -1.32 0.00 0.00 176.35 174.45 3ho8 s ALA 739 N 1.77 2.55 -0.23 5.97 0.00 0.79 -0.92 121.76 131.69 3ho8 s ALA 739 Ca 0.40 -1.51 0.00 0.00 0.00 0.00 0.00 51.96 50.85 3ho8 s ALA 739 Cb -0.17 -0.45 0.03 0.00 0.00 0.00 0.00 23.12 22.53 3ho8 s ALA 739 CO 0.15 0.50 -0.11 0.42 0.00 0.00 0.00 175.76 176.73 3ho8 s ILE 740 N -1.37 2.51 -0.17 0.00 -1.09 -0.15 -2.11 121.20 118.83 3ho8 s ILE 740 Ca 0.18 -1.12 -0.16 0.00 -2.23 0.00 0.00 60.65 57.32 3ho8 s ILE 740 Cb -0.09 -2.26 -0.04 0.00 -1.58 0.00 0.00 42.46 38.48 3ho8 s ILE 740 CO 0.09 0.24 0.41 -0.75 -1.23 0.00 0.00 174.94 173.70 3ho8 s LYS 741 N 1.27 4.25 -0.57 2.79 2.20 -0.45 -1.44 119.74 127.79 3ho8 s LYS 741 Ca -0.00 0.27 0.04 0.00 -0.36 0.00 0.00 55.97 55.92 3ho8 s LYS 741 Cb -0.16 -3.48 0.16 0.00 -1.51 0.00 0.00 37.83 32.83 3ho8 s LYS 741 CO -0.07 0.08 0.38 0.34 -0.36 0.00 0.00 175.35 175.72 3ho8 s ASP 742 N 0.79 3.95 0.49 1.43 2.15 0.49 -0.57 116.67 125.40 3ho8 s ASP 742 Ca 0.21 -3.34 0.25 0.00 0.43 0.00 0.00 52.55 50.10 3ho8 s ASP 742 Cb -0.14 -1.32 1.24 0.00 -0.30 0.00 0.00 42.92 42.39 3ho8 s ASP 742 CO 0.08 -0.16 1.98 0.00 -0.17 0.00 0.00 175.17 176.90 3ho8 h MET 743 N 5.89 0.00 -0.23 4.34 -0.00 -1.83 -2.76 114.93 120.34 3ho8 h MET 743 Ca 0.10 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.80 3ho8 h MET 743 Cb 0.84 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 32.44 3ho8 h MET 743 CO 0.61 0.17 0.00 0.00 -0.00 0.00 0.00 176.91 177.69 3ho8 n ALA 744 N -2.28 2.14 -3.52 -3.00 0.00 -1.26 -1.34 120.51 111.25 3ho8 n ALA 744 Ca -0.01 -1.07 -0.20 0.00 0.00 0.00 0.00 53.44 52.16 3ho8 n ALA 744 Cb 0.31 -0.30 0.08 0.00 0.00 0.00 0.00 19.45 19.54 3ho8 n ALA 744 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3ho8 n GLY 745 N 0.21 -0.42 0.02 0.00 0.00 -1.06 -4.78 105.19 99.15 3ho8 n GLY 745 Ca 0.08 0.15 0.11 0.00 0.00 0.00 0.00 46.02 46.36 3ho8 n GLY 745 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3ho8 n LEU 746 N -4.43 0.65 -4.56 0.99 4.77 -1.26 -4.65 117.00 108.51 3ho8 n LEU 746 Ca -0.19 -0.18 -0.37 0.00 -0.03 0.00 0.00 56.01 55.25 3ho8 n LEU 746 Cb 0.63 -0.07 -0.04 0.00 -2.33 0.00 0.00 43.42 41.62 3ho8 n LEU 746 CO 0.63 0.12 1.40 -0.22 -1.33 0.00 0.00 177.39 177.99 3ho8 s LEU 747 N -3.60 3.33 0.56 2.23 2.96 -1.26 -4.94 118.68 117.96 3ho8 s LEU 747 Ca 0.04 -0.88 -0.20 0.00 -0.22 0.00 0.00 54.13 52.87 3ho8 s LEU 747 Cb 0.15 -2.56 -0.05 0.00 0.50 0.00 0.00 46.19 44.23 3ho8 s LEU 747 CO 0.83 -2.01 1.21 -0.54 -1.32 0.00 0.00 176.35 174.52 3ho8 s LYS 748 N 5.91 3.16 0.11 1.98 1.02 -1.26 -4.69 119.74 125.96 3ho8 s LYS 748 Ca 0.54 1.85 -0.22 0.00 0.02 0.00 0.00 55.97 58.16 3ho8 s LYS 748 Cb -0.05 -2.06 -0.05 0.00 -0.52 0.00 0.00 37.83 35.16 3ho8 s LYS 748 CO -0.00 -1.06 1.32 -2.30 -0.92 0.00 0.00 175.35 172.39 3ho8 n PRO 749 N -1.31 -0.31 0.00 -1.68 -0.02 -1.26 -0.44 135.00 129.98 3ho8 n PRO 749 Ca 0.12 1.30 0.03 0.00 -2.02 0.00 0.00 63.50 62.93 3ho8 n PRO 749 Cb 0.49 -1.92 0.15 0.00 -0.02 0.00 0.00 33.50 32.20 3ho8 n PRO 749 CO 0.00 0.00 0.00 1.17 1.98 0.00 0.00 175.50 178.65 3ho8 n LYS 750 N -4.63 0.83 -0.10 -0.52 0.00 -1.26 -1.78 118.16 110.69 3ho8 n LYS 750 Ca 0.01 0.00 -0.13 0.00 0.00 0.00 0.00 58.31 58.19 3ho8 n LYS 750 Cb 0.19 -1.10 -0.11 0.00 0.00 0.00 0.00 35.03 34.01 3ho8 n LYS 750 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 3ho8 n ALA 751 N -0.60 1.55 -0.24 3.14 0.00 -0.33 -4.23 120.51 119.80 3ho8 n ALA 751 Ca 0.04 -0.99 -0.03 0.00 0.00 0.00 0.00 53.44 52.46 3ho8 n ALA 751 Cb 0.02 -0.04 0.15 0.00 0.00 0.00 0.00 19.45 19.58 3ho8 n ALA 751 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3ho8 h ALA 752 N 0.27 1.22 0.00 0.00 0.00 0.07 0.43 119.26 121.25 3ho8 h ALA 752 Ca -0.48 -0.15 -0.03 0.00 0.00 0.00 0.00 54.91 54.25 3ho8 h ALA 752 Cb 1.85 -0.30 -0.00 0.00 0.00 0.00 0.00 17.79 19.34 3ho8 h ALA 752 CO -0.04 0.59 -0.15 -0.92 0.00 0.00 0.00 179.25 178.73 3ho8 h TYR 753 N 1.05 0.00 -0.01 0.00 3.20 -1.60 -2.74 116.97 116.88 3ho8 h TYR 753 Ca 0.26 0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.13 3ho8 h TYR 753 Cb 0.11 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.38 3ho8 h TYR 753 CO 0.01 0.15 -0.56 0.39 -1.64 0.00 0.00 178.16 176.51 3ho8 n GLU 754 N -3.54 1.33 -0.09 1.82 1.02 -0.41 -3.74 120.64 117.03 3ho8 n GLU 754 Ca -0.01 -0.58 -0.17 0.00 -0.02 0.00 0.00 57.16 56.38 3ho8 n GLU 754 Cb 0.30 -1.36 -0.10 0.00 -0.02 0.00 0.00 31.44 30.26 3ho8 n GLU 754 CO 0.00 0.00 0.00 1.25 1.18 0.00 0.00 177.13 179.56 3ho8 h LEU 755 N 1.34 0.00 -1.10 -4.62 7.12 -0.15 -3.34 115.31 114.56 3ho8 h LEU 755 Ca 0.00 -0.52 0.03 0.00 0.13 0.00 0.00 57.88 57.52 3ho8 h LEU 755 Cb 0.57 0.00 -0.05 0.00 -0.53 0.00 0.00 40.66 40.64 3ho8 h LEU 755 CO 0.00 1.25 0.61 0.40 -0.13 0.00 0.00 178.44 180.56 3ho8 h ILE 756 N -1.00 1.16 -0.16 4.05 1.08 -1.68 -2.81 117.51 118.14 3ho8 h ILE 756 Ca -0.21 -0.40 -0.04 0.00 -0.39 0.00 0.00 64.86 63.81 3ho8 h ILE 756 Cb 1.07 -0.11 -0.00 0.00 -3.07 0.00 0.00 36.82 34.71 3ho8 h ILE 756 CO -0.13 0.21 -0.06 1.23 -0.69 0.00 0.00 178.15 178.71 3ho8 h GLY 757 N 1.17 0.35 1.99 5.37 0.00 -1.73 -1.53 103.07 108.68 3ho8 h GLY 757 Ca 0.37 -0.31 0.00 0.00 0.00 0.00 0.00 47.33 47.39 3ho8 h GLY 757 CO -0.11 0.28 0.00 1.18 0.00 0.00 0.00 176.54 177.89 3ho8 n GLU 758 N -4.65 0.01 -0.10 4.80 -0.58 -1.11 -2.31 120.64 116.70 3ho8 n GLU 758 Ca -0.05 0.28 -0.12 0.00 -0.42 0.00 0.00 57.16 56.85 3ho8 n GLU 758 Cb 0.28 -1.50 -0.13 0.00 -0.57 0.00 0.00 31.44 29.52 3ho8 n GLU 758 CO 0.00 0.00 0.00 1.28 -0.48 0.00 0.00 177.13 177.93 3ho8 n LEU 759 N -1.49 1.18 -1.98 -4.62 4.77 -1.08 -3.84 117.00 109.94 3ho8 n LEU 759 Ca 0.03 -0.05 -0.06 0.00 -0.03 0.00 0.00 56.01 55.90 3ho8 n LEU 759 Cb 0.15 -0.05 -0.08 0.00 -2.33 0.00 0.00 43.42 41.10 3ho8 n LEU 759 CO 0.12 0.63 1.10 0.29 -1.33 0.00 0.00 177.39 178.20 3ho8 n LYS 760 N -2.89 1.19 0.00 3.23 4.76 -0.58 -1.61 118.16 122.26 3ho8 n LYS 760 Ca -0.35 -0.48 0.00 0.00 -2.87 0.00 0.00 58.31 54.62 3ho8 n LYS 760 Cb 1.04 -1.62 0.00 0.00 -1.84 0.00 0.00 35.03 32.61 3ho8 n LYS 760 CO 0.00 0.00 0.00 -1.13 -1.37 0.00 0.00 177.40 174.90 3ho8 n SER 761 N 2.31 0.00 0.09 4.39 3.41 -1.25 -4.94 113.62 117.64 3ho8 n SER 761 Ca 0.21 0.00 -0.16 0.00 -0.26 0.00 0.00 58.87 58.66 3ho8 n SER 761 Cb 0.56 0.00 -0.14 0.00 -0.26 0.00 0.00 64.21 64.37 3ho8 n SER 761 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3ho8 h ALA 762 N 0.00 0.15 -3.79 7.33 0.00 -1.61 -3.46 119.26 117.88 3ho8 h ALA 762 Ca 0.00 -0.94 -0.52 0.00 0.00 0.00 0.00 54.91 53.46 3ho8 h ALA 762 Cb 0.00 0.06 -0.24 0.00 0.00 0.00 0.00 17.79 17.61 3ho8 h ALA 762 CO 0.00 1.02 -0.82 0.14 0.00 0.00 0.00 179.25 179.60 3ho8 s VAL 763 N -2.65 1.47 -0.53 0.00 -7.23 -0.63 -4.86 120.40 105.97 3ho8 s VAL 763 Ca -0.05 -1.26 0.24 0.00 -1.81 0.00 0.00 61.98 59.10 3ho8 s VAL 763 Cb 0.07 -1.32 0.24 0.00 0.56 0.00 0.00 36.38 35.93 3ho8 s VAL 763 CO 0.87 0.03 1.55 0.44 -0.31 0.00 0.00 175.10 177.68 3ho8 h ASP 765 N 4.58 0.00 -3.25 4.85 5.19 -1.89 -3.41 116.42 122.49 3ho8 h ASP 765 Ca -0.42 -0.03 -0.53 0.00 -0.62 0.00 0.00 57.03 55.43 3ho8 h ASP 765 Cb 1.17 0.00 0.02 0.00 0.18 0.00 0.00 39.33 40.70 3ho8 h ASP 765 CO 0.42 0.01 0.63 -0.76 -3.12 0.00 0.00 179.24 176.43 3ho8 s LEU 766 N -5.31 4.40 0.97 1.55 2.01 -1.26 -5.00 118.68 116.04 3ho8 s LEU 766 Ca 0.07 2.25 -0.14 0.00 0.01 0.00 0.00 54.13 56.32 3ho8 s LEU 766 Cb 0.09 -3.59 -0.02 0.00 0.01 0.00 0.00 46.19 42.68 3ho8 s LEU 766 CO 0.67 -0.52 0.04 -0.81 1.01 0.00 0.00 176.35 176.74 3ho8 n PRO 767 N 3.30 -0.23 -4.63 1.29 -0.04 -1.26 -4.61 135.00 128.82 3ho8 n PRO 767 Ca 0.08 -0.04 -0.33 0.00 -0.04 0.00 0.00 63.50 63.17 3ho8 n PRO 767 Cb 0.44 -1.60 -0.11 0.00 -0.04 0.00 0.00 33.50 32.18 3ho8 n PRO 767 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 3ho8 s ILE 768 N -2.28 3.47 -0.21 0.52 1.01 -1.26 -2.42 121.20 120.03 3ho8 s ILE 768 Ca 0.52 -0.70 -0.01 0.00 0.00 0.00 0.00 60.65 60.47 3ho8 s ILE 768 Cb -0.20 -2.44 0.06 0.00 0.01 0.00 0.00 42.46 39.89 3ho8 s ILE 768 CO 0.72 0.50 -0.03 -2.28 0.00 0.00 0.00 174.94 173.86 3ho8 s HIS 769 N -0.87 1.87 -0.06 3.97 2.46 -0.10 -1.99 115.29 120.57 3ho8 s HIS 769 Ca 0.14 -1.38 -0.05 0.00 0.47 0.00 0.00 55.06 54.24 3ho8 s HIS 769 Cb -0.11 -1.37 -0.04 0.00 -0.13 0.00 0.00 32.58 30.93 3ho8 s HIS 769 CO 0.04 -0.70 0.16 -1.17 -2.47 0.00 0.00 174.74 170.59 3ho8 s LEU 770 N 1.57 4.35 -0.26 8.88 2.96 -0.91 -0.98 118.68 134.29 3ho8 s LEU 770 Ca -0.03 0.40 -0.03 0.00 -0.22 0.00 0.00 54.13 54.24 3ho8 s LEU 770 Cb -0.18 -2.33 0.10 0.00 0.50 0.00 0.00 46.19 44.28 3ho8 s LEU 770 CO -0.07 0.34 0.18 -2.28 -1.32 0.00 0.00 176.35 173.20 3ho8 s HIS 771 N -1.17 0.02 0.27 5.38 5.65 -0.52 -0.70 115.29 124.21 3ho8 s HIS 771 Ca 0.21 -0.45 0.05 0.00 0.25 0.00 0.00 55.06 55.12 3ho8 s HIS 771 Cb -0.12 -0.68 -0.06 0.00 -1.18 0.00 0.00 32.58 30.54 3ho8 s HIS 771 CO 0.11 -0.77 -0.02 -0.08 -0.65 0.00 0.00 174.74 173.33 3ho8 s THR 772 N 2.20 1.37 0.05 0.89 -1.32 -1.26 -0.38 115.64 117.19 3ho8 s THR 772 Ca 0.08 -2.07 0.02 0.00 -1.21 0.00 0.00 61.69 58.51 3ho8 s THR 772 Cb -0.15 -2.48 -0.04 0.00 -1.51 0.00 0.00 72.50 68.31 3ho8 s THR 772 CO -0.28 -0.25 0.05 -1.00 -2.21 0.00 0.00 174.62 170.93 3ho8 s HIS 773 N -3.19 3.16 -1.25 9.09 3.76 -1.11 -4.25 115.29 121.49 3ho8 s HIS 773 Ca 0.30 0.09 0.09 0.00 -0.15 0.00 0.00 55.06 55.39 3ho8 s HIS 773 Cb 0.05 -1.65 0.36 0.00 1.11 0.00 0.00 32.58 32.46 3ho8 s HIS 773 CO 0.12 0.51 1.17 -3.47 -0.85 0.00 0.00 174.74 172.22 3ho8 n ASP 774 N 0.83 2.65 -0.01 1.40 4.64 -0.30 -4.07 116.55 121.69 3ho8 n ASP 774 Ca -0.11 -2.24 0.22 0.00 -1.38 0.00 0.00 54.79 51.28 3ho8 n ASP 774 Cb 0.52 -0.43 0.72 0.00 -1.04 0.00 0.00 41.12 40.89 3ho8 n ASP 774 CO 0.00 0.00 0.00 0.71 -0.82 0.00 0.00 177.20 177.09 3ho8 h THR 775 N 1.99 0.54 -0.00 5.18 1.35 -1.24 0.29 112.91 121.01 3ho8 h THR 775 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.86 3ho8 h THR 775 Cb 0.88 0.66 0.00 0.00 -1.73 0.00 0.00 68.15 67.95 3ho8 h THR 775 CO 0.13 0.00 -0.63 -1.54 -0.25 0.00 0.00 175.52 173.23 3ho8 n SER 776 N -4.08 0.91 -0.09 5.36 3.41 -1.24 0.21 113.62 118.10 3ho8 n SER 776 Ca 0.11 -0.74 -0.01 0.00 -0.26 0.00 0.00 58.87 57.97 3ho8 n SER 776 Cb 0.70 0.51 -0.00 0.00 -0.26 0.00 0.00 64.21 65.16 3ho8 n SER 776 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3ho8 n GLY 777 N 1.47 0.40 0.00 5.00 0.00 0.10 -4.66 105.19 107.50 3ho8 n GLY 777 Ca 0.06 -0.97 0.00 0.00 0.00 0.00 0.00 46.02 45.12 3ho8 n GLY 777 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3ho8 n ASN 778 N 1.83 1.02 -0.07 1.61 5.03 -1.26 -4.78 115.26 118.64 3ho8 n ASN 778 Ca -0.01 -1.21 0.20 0.00 0.87 0.00 0.00 54.58 54.43 3ho8 n ASN 778 Cb 0.23 0.00 0.64 0.00 -1.02 0.00 0.00 39.78 39.63 3ho8 n ASN 778 CO 0.00 0.00 0.00 1.23 -1.83 0.00 0.00 177.26 176.66 3ho8 h GLY 779 N 0.00 0.21 0.20 7.41 0.00 -1.82 -1.49 103.07 107.59 3ho8 h GLY 779 Ca 0.00 -0.05 -0.01 0.00 0.00 0.00 0.00 47.33 47.27 3ho8 h GLY 779 CO 0.00 0.02 -0.10 1.41 0.00 0.00 0.00 176.54 177.87 3ho8 h LEU 780 N 0.12 -0.23 -1.87 3.11 3.38 -1.96 -3.07 115.31 114.79 3ho8 h LEU 780 Ca 0.30 0.01 0.36 0.00 0.09 0.00 0.00 57.88 58.64 3ho8 h LEU 780 Cb 1.03 0.06 -0.05 0.00 0.09 0.00 0.00 40.66 41.79 3ho8 h LEU 780 CO -0.04 -0.12 0.97 -0.07 0.09 0.00 0.00 178.44 179.27 3ho8 h LEU 781 N -0.36 0.00 -0.02 1.67 3.38 -1.79 0.25 115.31 118.43 3ho8 h LEU 781 Ca -0.03 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.94 3ho8 h LEU 781 Cb 0.21 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.96 3ho8 h LEU 781 CO 0.05 0.00 -0.01 0.74 0.09 0.00 0.00 178.44 179.31 3ho8 h THR 782 N 0.00 1.33 -0.64 0.22 2.02 -1.35 -2.91 112.91 111.58 3ho8 h THR 782 Ca 0.59 -0.99 -0.06 0.00 0.77 0.00 0.00 66.41 66.72 3ho8 h THR 782 Cb 2.51 1.95 -0.03 0.00 -1.74 0.00 0.00 68.15 70.85 3ho8 h THR 782 CO -0.01 0.26 0.17 1.88 0.37 0.00 0.00 175.52 178.20 3ho8 h TYR 783 N -0.35 1.02 -0.74 3.16 0.99 -0.42 0.14 116.97 120.77 3ho8 h TYR 783 Ca 0.01 -0.10 0.05 0.00 2.00 0.00 0.00 58.73 60.69 3ho8 h TYR 783 Cb 0.43 -0.30 -0.05 0.00 1.00 0.00 0.00 36.73 37.81 3ho8 h TYR 783 CO 0.07 0.83 0.44 -0.22 -0.00 0.00 0.00 178.16 179.28 3ho8 h LYS 784 N 0.95 0.80 -0.22 4.88 3.11 -1.47 0.39 116.57 125.01 3ho8 h LYS 784 Ca 0.21 -0.05 -0.15 0.00 -2.81 0.00 0.00 60.65 57.85 3ho8 h LYS 784 Cb 0.31 -0.18 0.00 0.00 -1.00 0.00 0.00 32.23 31.36 3ho8 h LYS 784 CO -0.00 0.53 -0.44 1.96 -2.81 0.00 0.00 179.45 178.68 3ho8 h GLN 785 N 0.82 0.68 -0.45 1.90 1.08 -1.26 0.44 115.11 118.33 3ho8 h GLN 785 Ca 0.32 -0.44 0.07 0.00 -1.45 0.00 0.00 58.65 57.15 3ho8 h GLN 785 Cb 0.15 0.06 -0.06 0.00 -0.05 0.00 0.00 27.48 27.57 3ho8 h GLN 785 CO -0.16 1.06 0.12 0.00 -0.95 0.00 0.00 178.83 178.90 3ho8 h ALA 786 N 0.61 0.52 -0.68 3.87 0.00 -0.42 -1.38 119.26 121.78 3ho8 h ALA 786 Ca 0.01 0.08 -0.03 0.00 0.00 0.00 0.00 54.91 54.97 3ho8 h ALA 786 Cb 1.04 0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.89 3ho8 h ALA 786 CO 0.10 -0.28 0.31 0.82 0.00 0.00 0.00 179.25 180.19 3ho8 h ILE 787 N 0.27 1.22 0.00 0.00 2.04 -0.07 -0.97 117.51 119.99 3ho8 h ILE 787 Ca 0.22 -0.65 0.00 0.00 1.00 0.00 0.00 64.86 65.43 3ho8 h ILE 787 Cb 0.26 0.38 0.00 0.00 -0.74 0.00 0.00 36.82 36.71 3ho8 h ILE 787 CO -0.26 0.27 0.00 0.47 0.00 0.00 0.00 178.15 178.63 3ho8 n ASP 788 N -4.33 0.24 -0.75 1.72 10.43 0.13 -2.05 116.55 121.95 3ho8 n ASP 788 Ca 0.06 0.54 0.07 0.00 2.57 0.00 0.00 54.79 58.03 3ho8 n ASP 788 Cb 0.15 -0.60 0.20 0.00 1.84 0.00 0.00 41.12 42.71 3ho8 n ASP 788 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 3ho8 n ALA 789 N -1.59 2.57 -0.43 2.24 0.00 -0.48 -5.00 120.51 117.82 3ho8 n ALA 789 Ca 0.04 -1.71 0.00 0.00 0.00 0.00 0.00 53.44 51.78 3ho8 n ALA 789 Cb 0.26 -0.56 0.00 0.00 0.00 0.00 0.00 19.45 19.15 3ho8 n ALA 789 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3ho8 n GLY 790 N -0.00 0.78 3.61 0.00 0.00 -0.57 -4.23 105.19 104.78 3ho8 n GLY 790 Ca 0.16 -0.08 -0.40 0.00 0.00 0.00 0.00 46.02 45.70 3ho8 n GLY 790 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 3ho8 n VAL 791 N -2.43 2.82 0.00 1.61 3.14 -0.76 -4.95 118.33 117.76 3ho8 n VAL 791 Ca 0.00 -0.50 0.00 0.00 -2.96 0.00 0.00 64.34 60.88 3ho8 n VAL 791 Cb 0.00 -1.16 0.00 0.00 -1.06 0.00 0.00 33.84 31.62 3ho8 n VAL 791 CO 0.00 0.00 0.00 0.47 -6.46 0.00 0.00 176.83 170.84 3ho8 n ASP 792 N 0.10 0.00 -4.63 6.55 8.00 -1.13 -4.84 116.55 120.60 3ho8 n ASP 792 Ca 0.11 0.33 -0.27 0.00 0.71 0.00 0.00 54.79 55.66 3ho8 n ASP 792 Cb 0.42 -0.45 -0.08 0.00 -0.02 0.00 0.00 41.12 40.99 3ho8 n ASP 792 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 3ho8 s ILE 793 N -0.89 3.52 0.06 0.53 1.01 -0.84 -1.27 121.20 123.31 3ho8 s ILE 793 Ca 0.00 -1.49 0.02 0.00 0.00 0.00 0.00 60.65 59.19 3ho8 s ILE 793 Cb 0.00 -2.75 -0.03 0.00 0.01 0.00 0.00 42.46 39.69 3ho8 s ILE 793 CO 0.00 -0.09 -0.08 0.27 0.00 0.00 0.00 174.94 175.04 3ho8 s ILE 794 N -1.68 0.60 -0.21 2.92 -4.36 -1.25 -2.15 121.20 115.06 3ho8 s ILE 794 Ca 0.26 -1.27 -0.18 0.00 -0.26 0.00 0.00 60.65 59.20 3ho8 s ILE 794 Cb -0.09 -0.85 -0.03 0.00 1.25 0.00 0.00 42.46 42.74 3ho8 s ILE 794 CO 0.17 -0.47 0.53 -1.81 0.24 0.00 0.00 174.94 173.60 3ho8 s ASP 795 N -1.88 6.54 0.29 4.36 1.11 0.12 -0.91 116.67 126.30 3ho8 s ASP 795 Ca -0.05 0.65 0.04 0.00 0.18 0.00 0.00 52.55 53.38 3ho8 s ASP 795 Cb -0.07 -2.29 -0.02 0.00 1.07 0.00 0.00 42.92 41.61 3ho8 s ASP 795 CO -0.01 -0.21 0.15 0.35 1.18 0.00 0.00 175.17 176.64 3ho8 n THR 796 N 4.69 0.00 -3.92 -1.27 -2.24 0.02 -4.43 114.28 107.13 3ho8 n THR 796 Ca -0.04 -1.83 -0.09 0.00 -2.27 0.00 0.00 64.05 59.82 3ho8 n THR 796 Cb 0.50 0.77 -0.07 0.00 -2.10 0.00 0.00 70.33 69.42 3ho8 n THR 796 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3ho8 s ALA 797 N -2.92 -0.04 0.90 6.98 0.00 -1.07 -0.17 121.76 125.43 3ho8 s ALA 797 Ca 0.22 -0.79 -0.14 0.00 0.00 0.00 0.00 51.96 51.25 3ho8 s ALA 797 Cb 0.01 0.61 -0.02 0.00 0.00 0.00 0.00 23.12 23.72 3ho8 s ALA 797 CO 0.15 -0.54 0.21 0.28 0.00 0.00 0.00 175.76 175.86 3ho8 n VAL 798 N -0.10 0.41 -0.05 0.00 0.31 -1.26 0.01 118.33 117.65 3ho8 n VAL 798 Ca -0.12 -0.30 -0.08 0.00 -0.01 0.00 0.00 64.34 63.83 3ho8 n VAL 798 Cb 0.63 -0.52 -0.02 0.00 -0.91 0.00 0.00 33.84 33.01 3ho8 n VAL 798 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3ho8 h ALA 799 N -1.15 0.18 0.00 3.52 0.00 -1.91 -2.12 119.26 117.77 3ho8 h ALA 799 Ca -0.44 0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.54 3ho8 h ALA 799 Cb 1.30 0.13 0.00 0.00 0.00 0.00 0.00 17.79 19.22 3ho8 h ALA 799 CO 0.34 -0.44 0.00 0.66 0.00 0.00 0.00 179.25 179.81 3ho8 h SER 800 N 0.05 0.00 -0.04 0.00 4.64 -1.91 -2.63 113.55 113.66 3ho8 h SER 800 Ca 0.11 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.42 3ho8 h SER 800 Cb 0.15 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.23 3ho8 h SER 800 CO -0.20 0.00 -0.13 0.23 -0.87 0.00 0.00 176.83 175.86 3ho8 n MET 801 N -2.33 1.52 0.00 4.77 2.00 -1.05 -4.88 117.12 117.15 3ho8 n MET 801 Ca 0.02 -2.81 0.00 0.00 0.00 0.00 0.00 57.70 54.90 3ho8 n MET 801 Cb 0.22 -1.57 0.00 0.00 0.00 0.00 0.00 33.22 31.86 3ho8 n MET 801 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 175.97 174.84 3ho8 n SER 802 N -1.27 0.54 -0.99 7.83 3.41 -0.82 -4.58 113.62 117.74 3ho8 n SER 802 Ca 0.18 0.00 0.13 0.00 -0.26 0.00 0.00 58.87 58.92 3ho8 n SER 802 Cb 0.69 0.00 -0.04 0.00 -0.26 0.00 0.00 64.21 64.60 3ho8 n SER 802 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3ho8 n GLY 803 N 5.00 -2.02 7.00 5.00 0.00 -1.17 -4.61 105.19 114.40 3ho8 n GLY 803 Ca 0.00 -1.26 0.00 0.00 0.00 0.00 0.00 46.02 44.76 3ho8 n GLY 803 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3ho8 n LEU 804 N -3.44 0.00 0.33 0.99 4.77 -1.26 -0.67 117.00 117.72 3ho8 n LEU 804 Ca -0.01 0.00 0.22 0.00 -0.03 0.00 0.00 56.01 56.19 3ho8 n LEU 804 Cb 0.45 0.00 1.14 0.00 -2.33 0.00 0.00 43.42 42.68 3ho8 n LEU 804 CO 0.01 0.00 1.15 0.00 -1.33 0.00 0.00 177.39 177.23 3ho8 h THR 805 N 0.00 0.00 -2.26 -5.08 1.03 -1.88 0.02 112.91 104.74 3ho8 h THR 805 Ca 0.00 -0.07 -0.10 0.00 -0.01 0.00 0.00 66.41 66.23 3ho8 h THR 805 Cb 0.00 1.06 0.04 0.00 -1.07 0.00 0.00 68.15 68.18 3ho8 h THR 805 CO 0.00 0.00 0.07 -0.24 -0.01 0.00 0.00 175.52 175.34 3ho8 n SER 806 N -3.06 -0.40 -4.76 0.00 2.88 0.16 -4.40 113.62 104.04 3ho8 n SER 806 Ca -0.02 -0.96 -0.31 0.00 -1.33 0.00 0.00 58.87 56.24 3ho8 n SER 806 Cb 0.10 -0.23 0.10 0.00 -0.75 0.00 0.00 64.21 63.42 3ho8 n SER 806 CO 0.00 0.00 0.00 -1.10 -1.23 0.00 0.00 175.04 172.71 3ho8 s GLN 807 N -3.64 2.16 0.53 -1.46 1.11 -1.26 -1.15 119.66 115.94 3ho8 s GLN 807 Ca 0.17 1.23 -0.20 0.00 0.01 0.00 0.00 55.36 56.57 3ho8 s GLN 807 Cb -0.01 -1.88 -0.06 0.00 -1.01 0.00 0.00 33.01 30.05 3ho8 s GLN 807 CO 0.12 -1.73 1.16 -2.14 0.01 0.00 0.00 175.29 172.72 3ho8 s PRO 808 N -4.81 3.40 -0.46 2.91 0.02 -1.26 -3.04 135.00 131.76 3ho8 s PRO 808 Ca 0.62 1.72 -0.27 0.00 0.02 0.00 0.00 61.00 63.09 3ho8 s PRO 808 Cb -0.18 -2.12 -0.02 0.00 0.02 0.00 0.00 34.50 32.20 3ho8 s PRO 808 CO 0.55 -0.83 1.86 0.45 -0.33 0.00 0.00 177.00 178.70 3ho8 s SER 809 N -1.59 5.54 0.19 2.53 0.15 -1.26 -2.60 113.70 116.66 3ho8 s SER 809 Ca 0.71 0.88 -0.13 0.00 0.70 0.00 0.00 55.95 58.11 3ho8 s SER 809 Cb -0.27 -2.53 0.19 0.00 -1.71 0.00 0.00 66.02 61.71 3ho8 s SER 809 CO 0.31 -2.06 1.71 0.00 1.20 0.00 0.00 173.24 174.39 3ho8 h ALA 810 N 14.18 0.54 0.24 5.45 0.00 -0.68 -1.36 119.26 137.64 3ho8 h ALA 810 Ca -0.30 0.11 0.01 0.00 0.00 0.00 0.00 54.91 54.73 3ho8 h ALA 810 Cb 1.17 0.16 -0.04 0.00 0.00 0.00 0.00 17.79 19.09 3ho8 h ALA 810 CO 1.12 -0.33 -0.51 -0.91 0.00 0.00 0.00 179.25 178.63 3ho8 h ASN 811 N 0.21 -1.47 -1.01 0.00 2.35 -1.90 -2.77 115.58 110.99 3ho8 h ASN 811 Ca 0.25 0.15 0.03 0.00 -0.55 0.00 0.00 56.30 56.18 3ho8 h ASN 811 Cb 0.35 0.53 -0.06 0.00 0.05 0.00 0.00 38.32 39.19 3ho8 h ASN 811 CO -0.35 -0.59 0.66 0.28 -1.65 0.00 0.00 177.43 175.79 3ho8 h SER 812 N -0.82 1.12 0.42 5.81 0.02 -1.85 -1.24 113.55 117.01 3ho8 h SER 812 Ca -0.02 -0.02 -0.03 0.00 -0.84 0.00 0.00 61.79 60.89 3ho8 h SER 812 Cb 0.79 -0.26 -0.00 0.00 0.14 0.00 0.00 62.40 63.06 3ho8 h SER 812 CO -0.21 0.78 -0.12 0.25 -1.14 0.00 0.00 176.83 176.38 3ho8 h LEU 813 N 1.30 0.00 0.67 5.07 6.46 -1.20 -1.88 115.31 125.73 3ho8 h LEU 813 Ca 0.39 0.00 -0.03 0.00 -0.12 0.00 0.00 57.88 58.12 3ho8 h LEU 813 Cb -0.04 0.00 0.01 0.00 -0.73 0.00 0.00 40.66 39.90 3ho8 h LEU 813 CO -0.11 0.12 -0.32 0.22 -0.62 0.00 0.00 178.44 177.73 3ho8 h TYR 814 N 0.00 -0.83 0.00 1.25 3.20 -0.93 -2.75 116.97 116.91 3ho8 h TYR 814 Ca -0.00 -0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.85 3ho8 h TYR 814 Cb 0.37 0.28 0.00 0.00 1.54 0.00 0.00 36.73 38.91 3ho8 h TYR 814 CO 0.00 -0.52 0.00 1.88 -1.64 0.00 0.00 178.16 177.88 3ho8 h TYR 815 N -1.08 0.00 -0.12 -3.82 -1.99 -1.51 -2.63 116.97 105.82 3ho8 h TYR 815 Ca -0.09 0.00 -0.20 0.00 2.00 0.00 0.00 58.73 60.44 3ho8 h TYR 815 Cb 0.69 0.00 0.01 0.00 2.00 0.00 0.00 36.73 39.43 3ho8 h TYR 815 CO 0.03 0.00 -0.71 0.00 -0.00 0.00 0.00 178.16 177.48 3ho8 h ALA 816 N 2.07 0.24 0.00 3.88 0.00 -1.32 -3.14 119.26 120.99 3ho8 h ALA 816 Ca 0.00 -0.58 0.00 0.00 0.00 0.00 0.00 54.91 54.33 3ho8 h ALA 816 Cb 0.26 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.04 3ho8 h ALA 816 CO 0.00 0.57 0.00 1.28 0.00 0.00 0.00 179.25 181.10 3ho8 n LEU 817 N -4.04 0.00 -4.67 0.00 4.77 -0.99 -4.82 117.00 107.26 3ho8 n LEU 817 Ca -0.08 0.00 -0.42 0.00 -0.03 0.00 0.00 56.01 55.48 3ho8 n LEU 817 Cb 0.71 -0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.77 3ho8 n LEU 817 CO 0.51 -0.00 1.54 0.20 -1.33 0.00 0.00 177.39 178.31 3ho8 s ASN 818 N -2.01 6.47 0.00 -1.43 0.02 -1.19 -1.30 114.94 115.50 3ho8 s ASN 818 Ca 0.27 2.64 0.00 0.00 -1.02 0.00 0.00 52.86 54.75 3ho8 s ASN 818 Cb 0.12 -2.54 0.00 0.00 0.02 0.00 0.00 41.25 38.85 3ho8 s ASN 818 CO 0.21 -1.02 0.00 0.61 0.02 0.00 0.00 177.10 176.91 3ho8 n GLY 819 N 4.41 1.57 3.85 0.66 0.00 -1.26 -5.04 105.19 109.38 3ho8 n GLY 819 Ca 0.19 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.86 3ho8 n GLY 819 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3ho8 s PHE 820 N -3.11 3.57 -0.64 1.61 0.40 -0.42 -4.97 117.98 114.42 3ho8 s PHE 820 Ca 0.00 1.05 0.13 0.00 -0.60 0.00 0.00 56.93 57.51 3ho8 s PHE 820 Cb 0.00 -2.37 0.64 0.00 0.51 0.00 0.00 43.02 41.80 3ho8 s PHE 820 CO 0.00 0.39 1.39 -2.30 0.70 0.00 0.00 175.22 175.40 3ho8 n PRO 821 N 0.60 0.08 -4.86 0.24 -0.02 -1.26 -4.37 135.00 125.40 3ho8 n PRO 821 Ca -0.04 0.51 -0.31 0.00 -2.02 0.00 0.00 63.50 61.65 3ho8 n PRO 821 Cb 0.52 -1.72 -0.17 0.00 -0.02 0.00 0.00 33.50 32.11 3ho8 n PRO 821 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 3ho8 s ARG 822 N -3.25 2.75 0.16 -0.52 0.52 -1.26 -5.05 118.95 112.30 3ho8 s ARG 822 Ca 0.00 -0.76 0.08 0.00 -0.52 0.00 0.00 55.73 54.53 3ho8 s ARG 822 Cb 0.05 -2.17 -0.04 0.00 0.52 0.00 0.00 34.95 33.31 3ho8 s ARG 822 CO 0.15 0.06 -0.08 -1.58 0.02 0.00 0.00 175.30 173.88 3ho8 s HIS 823 N 0.63 2.70 -0.14 -0.53 2.46 -1.26 -4.88 115.29 114.27 3ho8 s HIS 823 Ca -0.13 -0.19 -0.20 0.00 0.47 0.00 0.00 55.06 55.01 3ho8 s HIS 823 Cb -0.16 -1.34 -0.03 0.00 -0.13 0.00 0.00 32.58 30.91 3ho8 s HIS 823 CO 0.03 0.49 0.59 -1.17 -2.47 0.00 0.00 174.74 172.22 3ho8 s LEU 824 N -2.69 4.23 -0.42 8.88 2.96 -1.26 -0.52 118.68 129.87 3ho8 s LEU 824 Ca 0.24 0.91 -0.14 0.00 -0.22 0.00 0.00 54.13 54.92 3ho8 s LEU 824 Cb -0.09 -2.86 0.04 0.00 0.50 0.00 0.00 46.19 43.77 3ho8 s LEU 824 CO 0.15 -0.14 0.30 -0.60 -1.32 0.00 0.00 176.35 174.75 3ho8 s ARG 825 N 1.19 2.92 0.00 1.98 3.52 -0.74 -4.93 118.95 122.90 3ho8 s ARG 825 Ca 0.30 -1.13 0.00 0.00 -0.13 0.00 0.00 55.73 54.77 3ho8 s ARG 825 Cb -0.16 -3.96 0.00 0.00 -1.56 0.00 0.00 34.95 29.27 3ho8 s ARG 825 CO 0.12 -0.81 0.00 -2.37 -0.81 0.00 0.00 175.30 171.43 3ho8 n THR 826 N 5.12 0.00 -3.74 4.11 5.66 -1.26 -4.57 114.28 119.61 3ho8 n THR 826 Ca -0.11 0.00 -0.38 0.00 -3.05 0.00 0.00 64.05 60.51 3ho8 n THR 826 Cb 0.46 0.00 -0.12 0.00 -1.55 0.00 0.00 70.33 69.11 3ho8 n THR 826 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 175.07 171.40 3ho8 s ASP 827 N -1.70 5.28 0.01 1.09 3.68 -1.21 -4.99 116.67 118.83 3ho8 s ASP 827 Ca 0.00 -0.96 -0.26 0.00 2.13 0.00 0.00 52.55 53.47 3ho8 s ASP 827 Cb 0.00 -1.89 -0.15 0.00 -1.45 0.00 0.00 42.92 39.43 3ho8 s ASP 827 CO 0.00 -0.28 1.13 0.16 0.13 0.00 0.00 175.17 176.31 3ho8 h ILE 828 N 6.02 0.20 -0.90 4.11 3.07 -1.97 -1.43 117.51 126.62 3ho8 h ILE 828 Ca -0.27 -0.39 0.17 0.00 1.55 0.00 0.00 64.86 65.93 3ho8 h ILE 828 Cb 1.10 0.28 -0.17 0.00 -0.27 0.00 0.00 36.82 37.77 3ho8 h ILE 828 CO 0.61 0.03 -0.24 1.21 -1.05 0.00 0.00 178.15 178.71 3ho8 n GLU 829 N -5.32 -0.10 -0.01 0.16 4.07 -1.26 0.08 120.64 118.26 3ho8 n GLU 829 Ca -0.11 1.40 -0.11 0.00 -0.06 0.00 0.00 57.16 58.27 3ho8 n GLU 829 Cb 0.34 -2.08 0.02 0.00 -0.06 0.00 0.00 31.44 29.66 3ho8 n GLU 829 CO 0.00 0.00 0.00 0.78 -0.06 0.00 0.00 177.13 177.85 3ho8 h GLY 830 N 0.00 0.69 2.00 8.31 0.00 -1.97 -2.91 103.07 109.19 3ho8 h GLY 830 Ca 0.42 -0.83 -0.06 0.00 0.00 0.00 0.00 47.33 46.85 3ho8 h GLY 830 CO -0.92 0.75 -0.29 -0.33 0.00 0.00 0.00 176.54 175.75 3ho8 h MET 831 N 0.48 0.00 -0.11 4.80 2.86 0.61 0.33 114.93 123.89 3ho8 h MET 831 Ca 0.00 0.00 -0.17 0.00 -2.06 0.00 0.00 59.70 57.47 3ho8 h MET 831 Cb 1.15 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.81 3ho8 h MET 831 CO 0.11 0.29 -0.66 0.93 1.06 0.00 0.00 176.91 178.64 3ho8 h GLU 832 N 0.00 0.44 -0.26 1.72 4.39 -0.27 0.43 114.58 121.04 3ho8 h GLU 832 Ca -0.00 -0.32 -0.09 0.00 0.34 0.00 0.00 59.36 59.29 3ho8 h GLU 832 Cb 0.57 0.06 -0.01 0.00 -0.10 0.00 0.00 28.75 29.27 3ho8 h GLU 832 CO 0.04 0.95 -0.18 0.77 -1.16 0.00 0.00 179.01 179.43 3ho8 h SER 833 N 0.31 0.60 0.05 1.42 0.02 -1.25 -0.44 113.55 114.27 3ho8 h SER 833 Ca -0.02 -0.44 -0.02 0.00 -0.84 0.00 0.00 61.79 60.48 3ho8 h SER 833 Cb 1.22 -0.17 -0.00 0.00 0.14 0.00 0.00 62.40 63.59 3ho8 h SER 833 CO 0.12 0.91 -0.07 -0.07 -1.14 0.00 0.00 176.83 176.58 3ho8 h LEU 834 N 0.29 0.04 -0.42 5.07 -0.00 -0.28 0.13 115.31 120.14 3ho8 h LEU 834 Ca 0.05 -0.00 -0.18 0.00 -0.00 0.00 0.00 57.88 57.75 3ho8 h LEU 834 Cb 0.71 -0.01 -0.01 0.00 -0.00 0.00 0.00 40.66 41.36 3ho8 h LEU 834 CO 0.05 0.11 -0.71 -1.28 -0.00 0.00 0.00 178.44 176.61 3ho8 h SER 835 N 0.04 0.47 0.95 -0.43 0.87 0.09 -2.97 113.55 112.58 3ho8 h SER 835 Ca 0.01 -0.30 -0.21 0.00 -1.23 0.00 0.00 61.79 60.06 3ho8 h SER 835 Cb 0.15 -0.14 -0.03 0.00 -0.44 0.00 0.00 62.40 61.94 3ho8 h SER 835 CO 0.01 1.03 -1.10 0.45 -0.53 0.00 0.00 176.83 176.70 3ho8 h HIS 836 N 0.27 0.00 0.40 2.24 3.86 -0.36 -1.66 115.15 119.90 3ho8 h HIS 836 Ca -0.03 0.00 -0.02 0.00 -1.16 0.00 0.00 60.37 59.16 3ho8 h HIS 836 Cb 1.28 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.76 3ho8 h HIS 836 CO 0.04 0.88 -0.19 -0.92 0.86 0.00 0.00 177.93 178.60 3ho8 h TYR 837 N 0.00 -0.50 0.00 2.45 3.20 -0.85 -3.08 116.97 118.19 3ho8 h TYR 837 Ca -0.08 -0.01 -0.02 0.00 3.14 0.00 0.00 58.73 61.76 3ho8 h TYR 837 Cb 1.74 0.16 -0.00 0.00 1.54 0.00 0.00 36.73 40.17 3ho8 h TYR 837 CO 0.00 -0.19 -0.10 -1.49 -1.64 0.00 0.00 178.16 174.73 3ho8 h TRP 838 N -0.78 0.00 -0.24 -3.82 4.06 -1.63 -0.58 115.95 112.96 3ho8 h TRP 838 Ca -0.05 0.00 0.06 0.00 2.06 0.00 0.00 58.89 60.95 3ho8 h TRP 838 Cb 0.53 0.00 -0.06 0.00 -1.00 0.00 0.00 29.16 28.62 3ho8 h TRP 838 CO 0.00 0.10 -0.19 1.03 -3.56 0.00 0.00 178.44 175.82 3ho8 h SER 839 N 0.00 -0.62 0.47 -3.49 0.87 -1.26 -0.03 113.55 109.49 3ho8 h SER 839 Ca -0.00 0.12 -0.30 0.00 -1.23 0.00 0.00 61.79 60.38 3ho8 h SER 839 Cb 0.63 0.31 0.02 0.00 -0.44 0.00 0.00 62.40 62.91 3ho8 h SER 839 CO 0.01 -0.23 -1.38 0.74 -0.53 0.00 0.00 176.83 175.44 3ho8 h THR 840 N -0.19 1.36 0.00 2.23 2.02 -1.41 -3.33 112.91 113.59 3ho8 h THR 840 Ca 0.14 -2.89 -0.03 0.00 0.77 0.00 0.00 66.41 64.40 3ho8 h THR 840 Cb 0.40 2.95 -0.00 0.00 -1.74 0.00 0.00 68.15 69.75 3ho8 h THR 840 CO -0.35 0.86 -0.14 0.58 0.37 0.00 0.00 175.52 176.83 3ho8 h VAL 841 N 0.10 0.67 0.00 3.16 2.07 -0.95 -2.33 116.25 118.97 3ho8 h VAL 841 Ca -0.20 -0.60 -0.07 0.00 0.82 0.00 0.00 66.70 66.66 3ho8 h VAL 841 Cb 2.05 1.37 -0.01 0.00 -1.52 0.00 0.00 31.29 33.19 3ho8 h VAL 841 CO 0.22 0.14 -0.32 -0.09 0.02 0.00 0.00 177.57 177.55 3ho8 h ARG 842 N 0.00 0.00 0.00 1.57 2.43 -1.11 -3.01 114.38 114.26 3ho8 h ARG 842 Ca -0.00 0.00 -0.03 0.00 -0.81 0.00 0.00 59.98 59.14 3ho8 h ARG 842 Cb 0.36 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 29.91 3ho8 h ARG 842 CO 0.02 0.32 -0.15 1.15 -1.51 0.00 0.00 179.97 179.79 3ho8 h THR 843 N 0.00 0.68 0.00 0.20 2.02 -1.58 -1.31 112.91 112.92 3ho8 h THR 843 Ca -0.00 -0.64 -0.00 0.00 0.77 0.00 0.00 66.41 66.54 3ho8 h THR 843 Cb 0.66 1.40 -0.00 0.00 -1.74 0.00 0.00 68.15 68.47 3ho8 h THR 843 CO 0.04 0.15 -0.02 1.88 0.37 0.00 0.00 175.52 177.94 3ho8 h TYR 844 N 0.00 0.00 -0.36 3.16 0.99 -1.67 -3.19 116.97 115.90 3ho8 h TYR 844 Ca -0.00 0.00 -0.19 0.00 2.00 0.00 0.00 58.73 60.54 3ho8 h TYR 844 Cb 0.38 0.00 -0.12 0.00 1.00 0.00 0.00 36.73 38.00 3ho8 h TYR 844 CO 0.00 0.02 -0.11 0.66 -0.00 0.00 0.00 178.16 178.72 3ho8 n TYR 845 N -3.61 1.12 0.21 4.88 4.02 -0.49 -4.80 117.16 118.49 3ho8 n TYR 845 Ca -0.03 -1.65 0.08 0.00 -0.01 0.00 0.00 57.90 56.29 3ho8 n TYR 845 Cb 0.10 -0.50 0.46 0.00 -0.02 0.00 0.00 39.34 39.39 3ho8 n TYR 845 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 176.86 176.51 3ho8 h SER 846 N 1.04 0.00 0.34 7.72 4.64 -1.67 -2.13 113.55 123.49 3ho8 h SER 846 Ca 0.23 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.55 3ho8 h SER 846 Cb 1.62 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.71 3ho8 h SER 846 CO 0.40 0.28 0.00 0.47 -0.87 0.00 0.00 176.83 177.12 3ho8 n ASP 847 N -3.62 0.00 -0.00 4.97 8.00 -1.26 -2.56 116.55 122.08 3ho8 n ASP 847 Ca -0.01 0.14 0.07 0.00 0.71 0.00 0.00 54.79 55.70 3ho8 n ASP 847 Cb 0.41 -0.32 -0.09 0.00 -0.02 0.00 0.00 41.12 41.10 3ho8 n ASP 847 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 3ho8 n PHE 848 N -1.32 0.00 -1.68 1.24 3.01 -0.80 -4.98 117.46 112.93 3ho8 n PHE 848 Ca 0.07 0.00 -0.51 0.00 1.01 0.00 0.00 57.45 58.02 3ho8 n PHE 848 Cb 0.14 -0.06 -0.06 0.00 -0.01 0.00 0.00 39.48 39.49 3ho8 n PHE 848 CO 0.00 0.00 0.00 0.39 1.01 0.00 0.00 176.76 178.16 3ho8 n GLU 849 N -1.45 1.71 -1.32 -1.08 -0.58 -1.06 -3.98 120.64 112.89 3ho8 n GLU 849 Ca 0.02 0.63 -0.31 0.00 -0.42 0.00 0.00 57.16 57.08 3ho8 n GLU 849 Cb 0.25 -2.38 0.10 0.00 -0.57 0.00 0.00 31.44 28.84 3ho8 n GLU 849 CO 0.00 0.00 0.00 -1.54 -0.48 0.00 0.00 177.13 175.11 3ho8 s SER 852 N 2.86 4.36 0.25 1.62 1.04 -1.23 -5.00 113.70 117.61 3ho8 s SER 852 Ca 0.91 1.65 0.21 0.00 0.48 0.00 0.00 55.95 59.21 3ho8 s SER 852 Cb -0.84 -2.38 0.07 0.00 0.10 0.00 0.00 66.02 62.97 3ho8 s SER 852 CO 0.53 -2.10 1.19 -2.24 0.98 0.00 0.00 173.24 171.60 3ho8 h ASP 853 N -1.17 0.00 -0.40 7.02 -0.00 -1.94 -3.44 116.42 116.49 3ho8 h ASP 853 Ca -0.45 0.00 -0.59 0.00 -0.00 0.00 0.00 57.03 55.99 3ho8 h ASP 853 Cb 1.25 0.00 -0.05 0.00 -0.00 0.00 0.00 39.33 40.52 3ho8 h ASP 853 CO 0.54 0.10 1.58 -0.38 -0.00 0.00 0.00 179.24 181.08 3ho8 n ILE 854 N -2.85 0.02 0.16 4.15 5.41 -1.26 -4.75 119.36 120.25 3ho8 n ILE 854 Ca 0.00 -0.15 0.09 0.00 1.00 0.00 0.00 62.75 63.68 3ho8 n ILE 854 Cb 0.59 -1.00 0.16 0.00 -0.71 0.00 0.00 39.64 38.68 3ho8 n ILE 854 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 176.55 177.72 3ho8 n LYS 855 N 8.28 2.17 -4.00 0.38 4.81 -1.26 -4.92 118.16 123.61 3ho8 n LYS 855 Ca 0.55 -1.98 -0.10 0.00 -0.87 0.00 0.00 58.31 55.92 3ho8 n LYS 855 Cb 0.12 -1.37 -0.07 0.00 0.02 0.00 0.00 35.03 33.72 3ho8 n LYS 855 CO 0.00 0.00 0.00 -1.12 1.17 0.00 0.00 177.40 177.45 3ho8 s SER 856 N -1.18 0.07 0.15 3.14 0.01 -1.26 -5.10 113.70 109.53 3ho8 s SER 856 Ca 0.29 -0.96 -0.30 0.00 1.31 0.00 0.00 55.95 56.29 3ho8 s SER 856 Cb 0.17 0.43 -0.07 0.00 0.21 0.00 0.00 66.02 66.75 3ho8 s SER 856 CO 0.23 -0.89 1.09 -2.84 0.41 0.00 0.00 173.24 171.24 3ho8 s PRO 857 N -4.00 4.59 -0.15 12.44 0.02 -1.26 -4.85 135.00 141.79 3ho8 s PRO 857 Ca 0.20 1.68 -0.01 0.00 0.02 0.00 0.00 61.00 62.89 3ho8 s PRO 857 Cb 0.04 -3.30 -0.01 0.00 0.02 0.00 0.00 34.50 31.24 3ho8 s PRO 857 CO 0.02 0.06 -0.12 1.21 -0.33 0.00 0.00 177.00 177.83 3ho8 s ASN 858 N 0.05 3.95 -0.02 2.53 3.84 0.13 -4.93 114.94 120.49 3ho8 s ASN 858 Ca 0.50 -0.38 0.18 0.00 0.21 0.00 0.00 52.86 53.37 3ho8 s ASN 858 Cb -0.28 -1.61 -0.26 0.00 -0.55 0.00 0.00 41.25 38.55 3ho8 s ASN 858 CO 0.33 0.12 0.50 0.35 -2.79 0.00 0.00 177.10 175.61 3ho8 n THR 859 N 3.86 0.00 0.80 -5.21 -2.24 -1.26 -3.70 114.28 106.53 3ho8 n THR 859 Ca -0.18 -0.32 0.00 0.00 -2.27 0.00 0.00 64.05 61.27 3ho8 n THR 859 Cb 0.52 0.35 0.00 0.00 -2.10 0.00 0.00 70.33 69.10 3ho8 n THR 859 CO 0.00 0.00 0.00 -1.84 -0.57 0.00 0.00 175.07 172.66 3ho8 n GLU 860 N -1.93 0.80 0.04 -0.78 0.28 -1.26 -2.82 120.64 114.98 3ho8 n GLU 860 Ca -0.01 0.00 0.01 0.00 -0.16 0.00 0.00 57.16 57.00 3ho8 n GLU 860 Cb 0.42 -1.35 0.35 0.00 1.43 0.00 0.00 31.44 32.29 3ho8 n GLU 860 CO 0.00 0.00 0.00 0.97 -0.16 0.00 0.00 177.13 177.94 3ho8 h ILE 861 N 0.03 1.17 0.00 3.84 6.09 -1.94 -3.18 117.51 123.53 3ho8 h ILE 861 Ca 0.00 -0.67 0.00 0.00 -1.37 0.00 0.00 64.86 62.82 3ho8 h ILE 861 Cb 0.47 0.95 0.00 0.00 0.47 0.00 0.00 36.82 38.70 3ho8 h ILE 861 CO 0.00 0.23 0.00 -1.22 -3.07 0.00 0.00 178.15 174.09 3ho8 n TYR 862 N -4.32 0.00 -0.04 2.19 4.02 -1.13 -1.03 117.16 116.86 3ho8 n TYR 862 Ca 0.01 0.00 -0.05 0.00 -0.01 0.00 0.00 57.90 57.85 3ho8 n TYR 862 Cb 0.22 -0.04 -0.02 0.00 -0.02 0.00 0.00 39.34 39.48 3ho8 n TYR 862 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 176.86 176.89 3ho8 n GLN 863 N -1.04 0.30 0.08 -0.72 1.13 -1.20 -4.78 117.38 111.15 3ho8 n GLN 863 Ca 0.07 0.12 0.12 0.00 -1.94 0.00 0.00 57.00 55.36 3ho8 n GLN 863 Cb 0.04 -1.00 0.12 0.00 0.11 0.00 0.00 30.24 29.51 3ho8 n GLN 863 CO 0.00 0.00 0.00 1.12 -1.44 0.00 0.00 177.06 176.74 3ho8 h HIS 864 N -0.57 0.00 -5.77 1.08 2.07 -1.66 -3.46 115.15 106.84 3ho8 h HIS 864 Ca 0.00 0.00 -0.35 0.00 -2.85 0.00 0.00 60.37 57.17 3ho8 h HIS 864 Cb 0.57 0.00 0.14 0.00 2.57 0.00 0.00 27.41 30.69 3ho8 h HIS 864 CO -0.24 0.00 -0.78 0.39 -3.07 0.00 0.00 177.93 174.22 3ho8 n GLU 865 N -2.34 -6.19 -3.24 5.12 1.02 -0.20 -4.63 120.64 110.19 3ho8 n GLU 865 Ca 0.02 0.79 -0.39 0.00 -0.02 0.00 0.00 57.16 57.56 3ho8 n GLU 865 Cb 0.48 -5.69 -0.07 0.00 -0.02 0.00 0.00 31.44 26.14 3ho8 n GLU 865 CO 0.00 0.00 0.00 -1.64 1.18 0.00 0.00 177.13 176.67 3ho8 s MET 866 N -5.53 4.19 0.49 3.49 -1.94 -1.26 -4.91 119.30 113.83 3ho8 s MET 866 Ca 0.01 0.43 -0.08 0.00 -1.71 0.00 0.00 55.69 54.33 3ho8 s MET 866 Cb -0.00 -3.56 0.11 0.00 2.01 0.00 0.00 34.83 33.39 3ho8 s MET 866 CO 0.75 -0.16 0.67 -0.35 -0.01 0.00 0.00 175.02 175.93 3ho8 n PRO 867 N 4.81 -0.62 0.00 2.03 -0.04 -1.26 -4.63 135.00 135.29 3ho8 n PRO 867 Ca -0.04 -1.07 0.00 0.00 -0.04 0.00 0.00 63.50 62.35 3ho8 n PRO 867 Cb 0.50 -0.68 0.00 0.00 -0.04 0.00 0.00 33.50 33.28 3ho8 n PRO 867 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3ho8 n GLY 868 N 0.58 0.00 3.11 0.55 0.00 -0.45 -3.25 105.19 105.73 3ho8 n GLY 868 Ca 0.09 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.12 3ho8 n GLY 868 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3ho8 s GLY 869 N 0.00 -1.04 0.00 -0.02 0.00 -1.26 -4.93 107.32 100.07 3ho8 s GLY 869 Ca 0.00 1.25 0.00 0.00 0.00 0.00 0.00 44.72 45.97 3ho8 s GLY 869 CO 0.00 3.44 0.00 -1.06 0.00 0.00 0.00 173.10 175.48 3ho8 n GLN 870 N 5.41 0.00 0.00 2.90 1.13 -1.20 -4.53 117.38 121.09 3ho8 n GLN 870 Ca 0.02 0.00 0.09 0.00 -1.94 0.00 0.00 57.00 55.17 3ho8 n GLN 870 Cb 0.52 -0.07 0.02 0.00 0.11 0.00 0.00 30.24 30.83 3ho8 n GLN 870 CO 0.00 0.00 0.00 2.48 -1.44 0.00 0.00 177.06 178.10 3ho8 n TYR 871 N 0.00 0.00 -0.03 1.08 0.18 -1.26 -3.30 117.16 113.83 3ho8 n TYR 871 Ca 0.00 0.00 -0.03 0.00 1.88 0.00 0.00 57.90 59.75 3ho8 n TYR 871 Cb 0.11 0.00 -0.04 0.00 -0.38 0.00 0.00 39.34 39.02 3ho8 n TYR 871 CO 0.00 0.00 0.00 -1.13 -2.08 0.00 0.00 176.86 173.65 3ho8 n SER 872 N 0.28 3.65 0.04 9.48 3.41 -1.26 -4.39 113.62 124.82 3ho8 n SER 872 Ca 0.09 -0.00 -0.12 0.00 -0.26 0.00 0.00 58.87 58.58 3ho8 n SER 872 Cb 0.41 0.54 -0.13 0.00 -0.26 0.00 0.00 64.21 64.77 3ho8 n SER 872 CO 0.00 0.00 0.00 -1.13 -0.16 0.00 0.00 175.04 173.75 3ho8 h ASN 873 N 0.00 0.16 -0.25 4.04 -1.24 -1.80 -3.15 115.58 113.35 3ho8 h ASN 873 Ca -0.15 -0.23 0.00 0.00 0.71 0.00 0.00 56.30 56.63 3ho8 h ASN 873 Cb 1.32 -0.05 0.00 0.00 0.73 0.00 0.00 38.32 40.32 3ho8 h ASN 873 CO 0.00 1.19 0.00 -0.11 -1.29 0.00 0.00 177.43 177.23 3ho8 n LEU 874 N -3.31 1.62 -1.12 0.34 0.00 -1.21 -3.07 117.00 110.26 3ho8 n LEU 874 Ca -0.12 -0.76 0.12 0.00 0.00 0.00 0.00 56.01 55.25 3ho8 n LEU 874 Cb 1.01 -0.16 0.22 0.00 0.00 0.00 0.00 43.42 44.49 3ho8 n LEU 874 CO 0.48 0.38 0.71 -0.24 0.00 0.00 0.00 177.39 178.71 3ho8 n SER 875 N 0.34 3.35 -0.08 1.96 2.88 -1.19 -3.98 113.62 116.89 3ho8 n SER 875 Ca 0.13 -1.98 -0.11 0.00 -1.33 0.00 0.00 58.87 55.57 3ho8 n SER 875 Cb 0.28 -0.23 -0.08 0.00 -0.75 0.00 0.00 64.21 63.43 3ho8 n SER 875 CO 0.00 0.00 0.00 1.67 -1.23 0.00 0.00 175.04 175.48 3ho8 n GLN 876 N 1.43 0.53 0.00 -1.46 7.27 -1.17 -4.13 117.38 119.84 3ho8 n GLN 876 Ca 0.19 0.09 0.09 0.00 0.07 0.00 0.00 57.00 57.44 3ho8 n GLN 876 Cb 0.59 -1.34 0.50 0.00 2.41 0.00 0.00 30.24 32.41 3ho8 n GLN 876 CO 0.00 0.00 0.00 0.94 0.07 0.00 0.00 177.06 178.07 3ho8 n GLN 877 N -2.96 0.41 -0.08 3.69 7.27 -1.23 -3.14 117.38 121.32 3ho8 n GLN 877 Ca -0.30 0.06 -0.14 0.00 0.07 0.00 0.00 57.00 56.70 3ho8 n GLN 877 Cb 0.83 -1.50 -0.07 0.00 2.41 0.00 0.00 30.24 31.91 3ho8 n GLN 877 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 3ho8 n ALA 878 N -1.16 1.71 -0.21 1.69 0.00 -1.26 -4.37 120.51 116.92 3ho8 n ALA 878 Ca 0.11 -0.70 -0.02 0.00 0.00 0.00 0.00 53.44 52.84 3ho8 n ALA 878 Cb 0.11 0.17 0.19 0.00 0.00 0.00 0.00 19.45 19.92 3ho8 n ALA 878 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 3ho8 h LYS 879 N -0.20 0.99 0.00 0.00 1.57 -1.71 -1.02 116.57 116.21 3ho8 h LYS 879 Ca -0.39 -0.12 -0.01 0.00 -1.87 0.00 0.00 60.65 58.26 3ho8 h LYS 879 Cb 1.51 -0.19 -0.00 0.00 0.08 0.00 0.00 32.23 33.63 3ho8 h LYS 879 CO -0.12 0.74 -0.05 0.77 -0.57 0.00 0.00 179.45 180.22 3ho8 h SER 880 N 1.00 0.00 0.18 0.86 0.02 -1.80 -0.78 113.55 113.02 3ho8 h SER 880 Ca 0.25 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.20 3ho8 h SER 880 Cb 0.05 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.59 3ho8 h SER 880 CO -0.04 0.05 -0.11 0.18 -1.14 0.00 0.00 176.83 175.77 3ho8 n LEU 881 N -4.14 0.92 -0.09 5.07 4.77 -0.43 -4.95 117.00 118.16 3ho8 n LEU 881 Ca -0.03 -0.23 0.00 0.00 -0.03 0.00 0.00 56.01 55.72 3ho8 n LEU 881 Cb 0.14 -0.09 0.00 0.00 -2.33 0.00 0.00 43.42 41.13 3ho8 n LEU 881 CO 0.32 0.16 0.00 0.61 -1.33 0.00 0.00 177.39 177.15 3ho8 n GLY 882 N 1.24 0.80 0.61 -0.72 0.00 -0.30 -4.98 105.19 101.84 3ho8 n GLY 882 Ca 0.16 -0.64 0.03 0.00 0.00 0.00 0.00 46.02 45.57 3ho8 n GLY 882 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3ho8 n LEU 883 N -0.09 0.90 0.24 0.99 4.77 -0.97 -4.79 117.00 118.05 3ho8 n LEU 883 Ca 0.00 -1.86 0.11 0.00 -0.03 0.00 0.00 56.01 54.23 3ho8 n LEU 883 Cb 0.38 -0.13 0.62 0.00 -2.33 0.00 0.00 43.42 41.96 3ho8 n LEU 883 CO 0.00 0.49 0.90 1.23 -1.33 0.00 0.00 177.39 178.68 3ho8 h GLY 884 N 0.27 0.00 1.25 -0.72 0.00 -1.81 -1.67 103.07 100.40 3ho8 h GLY 884 Ca -0.04 0.00 -0.21 0.00 0.00 0.00 0.00 47.33 47.08 3ho8 h GLY 884 CO 0.02 0.00 -0.71 0.83 0.00 0.00 0.00 176.54 176.68 3ho8 h GLU 885 N 0.00 0.75 -1.12 4.80 4.39 -1.95 -3.30 114.58 118.14 3ho8 h GLU 885 Ca -0.00 -0.57 -0.26 0.00 0.34 0.00 0.00 59.36 58.87 3ho8 h GLU 885 Cb 0.48 0.11 -0.14 0.00 -0.10 0.00 0.00 28.75 29.09 3ho8 h GLU 885 CO 0.02 1.19 0.33 0.54 -1.16 0.00 0.00 179.01 179.93 3ho8 n ARG 886 N -3.94 1.63 0.23 2.33 1.74 -0.64 -4.58 116.66 113.43 3ho8 n ARG 886 Ca -0.06 -1.44 0.16 0.00 -0.77 0.00 0.00 57.85 55.74 3ho8 n ARG 886 Cb 0.71 -1.56 0.77 0.00 -1.02 0.00 0.00 32.46 31.35 3ho8 n ARG 886 CO 0.00 0.00 0.00 0.35 -1.52 0.00 0.00 177.63 176.46 3ho8 h PHE 887 N 0.69 0.00 -0.00 -1.55 3.57 -1.61 -2.85 116.94 115.19 3ho8 h PHE 887 Ca 0.30 0.00 -0.03 0.00 3.53 0.00 0.00 57.97 61.77 3ho8 h PHE 887 Cb 1.66 0.00 -0.00 0.00 2.79 0.00 0.00 35.95 40.39 3ho8 h PHE 887 CO 0.76 0.00 -0.13 0.38 -2.23 0.00 0.00 178.31 177.09 3ho8 h ASP 888 N 0.00 0.01 -0.54 0.41 -0.00 -1.90 -2.46 116.42 111.93 3ho8 h ASP 888 Ca 0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 57.03 57.03 3ho8 h ASP 888 Cb 0.22 -0.00 0.00 0.00 -0.00 0.00 0.00 39.33 39.55 3ho8 h ASP 888 CO 0.00 0.14 0.00 1.21 -0.00 0.00 0.00 179.24 180.59 3ho8 n GLU 889 N -4.38 2.61 -0.01 4.15 2.13 -1.08 -3.23 120.64 120.83 3ho8 n GLU 889 Ca -0.03 -2.47 0.09 0.00 0.66 0.00 0.00 57.16 55.41 3ho8 n GLU 889 Cb 0.20 -1.54 -0.15 0.00 0.27 0.00 0.00 31.44 30.22 3ho8 n GLU 889 CO 0.00 0.00 0.00 0.28 -0.41 0.00 0.00 177.13 177.00 3ho8 n VAL 890 N 1.58 0.06 0.06 6.31 0.31 -0.93 -2.34 118.33 123.38 3ho8 n VAL 890 Ca 0.22 -0.45 -0.23 0.00 -0.01 0.00 0.00 64.34 63.87 3ho8 n VAL 890 Cb 0.62 0.04 -0.15 0.00 -0.91 0.00 0.00 33.84 33.44 3ho8 n VAL 890 CO 0.00 0.00 0.00 0.11 -1.32 0.00 0.00 176.83 175.62 3ho8 h LYS 891 N 0.00 0.38 -0.24 5.55 1.57 -1.68 -3.34 116.57 118.80 3ho8 h LYS 891 Ca -0.02 -0.64 -0.05 0.00 -1.87 0.00 0.00 60.65 58.06 3ho8 h LYS 891 Cb 0.93 0.24 -0.01 0.00 0.08 0.00 0.00 32.23 33.47 3ho8 h LYS 891 CO 0.00 1.31 -0.06 0.22 -0.57 0.00 0.00 179.45 180.35 3ho8 h ASP 892 N 0.03 0.47 0.50 0.86 3.58 -1.70 -3.08 116.42 117.08 3ho8 h ASP 892 Ca -0.33 -0.36 -0.02 0.00 0.42 0.00 0.00 57.03 56.73 3ho8 h ASP 892 Cb 2.04 -0.13 0.00 0.00 1.72 0.00 0.00 39.33 42.97 3ho8 h ASP 892 CO 0.16 0.72 -0.24 -0.03 -2.88 0.00 0.00 179.24 176.98 3ho8 h MET 893 N 0.21 -0.65 -0.65 0.28 4.05 -1.67 -1.13 114.93 115.37 3ho8 h MET 893 Ca 0.06 0.04 0.12 0.00 -0.28 0.00 0.00 59.70 59.64 3ho8 h MET 893 Cb 0.52 0.15 -0.12 0.00 -0.80 0.00 0.00 31.60 31.35 3ho8 h MET 893 CO 0.02 -0.41 -0.20 0.98 0.23 0.00 0.00 176.91 177.53 3ho8 n TYR 894 N -5.36 0.15 -0.11 1.39 9.36 -1.23 0.14 117.16 121.49 3ho8 n TYR 894 Ca -0.12 0.80 -0.11 0.00 3.32 0.00 0.00 57.90 61.79 3ho8 n TYR 894 Cb 0.29 -0.82 -0.03 0.00 -0.63 0.00 0.00 39.34 38.14 3ho8 n TYR 894 CO 0.00 0.00 0.00 -0.09 0.22 0.00 0.00 176.86 176.99 3ho8 h ARG 895 N 0.00 0.57 0.00 2.98 2.43 -1.37 -1.93 114.38 117.05 3ho8 h ARG 895 Ca 0.28 -0.19 -0.05 0.00 -0.81 0.00 0.00 59.98 59.21 3ho8 h ARG 895 Cb 0.44 -0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 29.94 3ho8 h ARG 895 CO -0.66 0.71 -0.26 0.00 -1.51 0.00 0.00 179.97 178.25 3ho8 h ARG 896 N 0.36 0.00 0.00 0.20 3.08 0.97 -2.86 114.38 116.14 3ho8 h ARG 896 Ca 0.09 0.00 -0.12 0.00 0.07 0.00 0.00 59.98 60.01 3ho8 h ARG 896 Cb 0.46 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.49 3ho8 h ARG 896 CO 0.02 0.26 -0.59 0.28 -1.07 0.00 0.00 179.97 178.87 3ho8 h VAL 897 N 0.00 1.06 -0.18 2.04 2.07 0.14 -2.44 116.25 118.93 3ho8 h VAL 897 Ca -0.00 -2.36 -0.15 0.00 0.82 0.00 0.00 66.70 65.01 3ho8 h VAL 897 Cb 0.50 2.43 -0.01 0.00 -1.52 0.00 0.00 31.29 32.69 3ho8 h VAL 897 CO 0.03 0.58 -0.50 -1.13 0.02 0.00 0.00 177.57 176.58 3ho8 h ASN 898 N 0.00 0.54 -0.25 0.57 -0.73 -1.12 -1.28 115.58 113.30 3ho8 h ASN 898 Ca -0.01 -0.27 0.00 0.00 1.87 0.00 0.00 56.30 57.90 3ho8 h ASN 898 Cb 1.38 -0.15 0.00 0.00 0.27 0.00 0.00 38.32 39.82 3ho8 h ASN 898 CO 0.08 0.94 0.00 0.49 -0.37 0.00 0.00 177.43 178.57 3ho8 n PHE 899 N -3.98 0.33 -0.11 0.67 3.01 -1.17 0.29 117.46 116.52 3ho8 n PHE 899 Ca -0.02 -0.17 -0.12 0.00 1.01 0.00 0.00 57.45 58.15 3ho8 n PHE 899 Cb 0.57 0.00 -0.15 0.00 -0.01 0.00 0.00 39.48 39.88 3ho8 n PHE 899 CO 0.00 0.00 0.00 -0.11 1.01 0.00 0.00 176.76 177.66 3ho8 n LEU 900 N 0.28 0.59 -1.16 4.37 7.94 -0.92 -4.43 117.00 123.67 3ho8 n LEU 900 Ca 0.11 -0.03 0.04 0.00 -1.11 0.00 0.00 56.01 55.03 3ho8 n LEU 900 Cb 0.25 0.22 0.21 0.00 0.53 0.00 0.00 43.42 44.63 3ho8 n LEU 900 CO 0.08 0.59 0.60 0.49 -1.11 0.00 0.00 177.39 178.03 3ho8 n PHE 901 N -2.85 1.02 -1.72 1.96 3.72 -0.52 -4.91 117.46 114.15 3ho8 n PHE 901 Ca -0.35 -0.37 -0.10 0.00 -0.05 0.00 0.00 57.45 56.58 3ho8 n PHE 901 Cb 1.13 -0.26 -0.03 0.00 -0.94 0.00 0.00 39.48 39.38 3ho8 n PHE 901 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3ho8 n GLY 902 N 0.49 0.60 1.85 1.37 0.00 -1.13 -4.53 105.19 103.83 3ho8 n GLY 902 Ca 0.15 -0.51 -0.01 0.00 0.00 0.00 0.00 46.02 45.64 3ho8 n GLY 902 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 3ho8 n ASP 903 N 0.19 -3.67 -4.22 1.61 -0.08 0.15 -4.59 116.55 105.93 3ho8 n ASP 903 Ca -0.11 0.83 -0.16 0.00 -1.51 0.00 0.00 54.79 53.83 3ho8 n ASP 903 Cb 0.46 -3.15 -0.11 0.00 2.34 0.00 0.00 41.12 40.66 3ho8 n ASP 903 CO 0.00 0.00 0.00 0.27 0.12 0.00 0.00 177.20 177.59 3ho8 s ILE 904 N -0.32 1.20 0.56 5.18 -4.36 -1.26 -4.72 121.20 117.47 3ho8 s ILE 904 Ca -0.07 -1.75 -0.21 0.00 -0.26 0.00 0.00 60.65 58.36 3ho8 s ILE 904 Cb 0.00 -1.53 -0.04 0.00 1.25 0.00 0.00 42.46 42.14 3ho8 s ILE 904 CO 0.19 -0.51 1.31 -0.69 0.24 0.00 0.00 174.94 175.48 3ho8 s VAL 905 N -2.42 2.24 -0.49 8.37 1.01 -1.26 -5.01 120.40 122.84 3ho8 s VAL 905 Ca 0.09 0.17 0.03 0.00 0.00 0.00 0.00 61.98 62.27 3ho8 s VAL 905 Cb -0.03 -3.08 0.15 0.00 0.00 0.00 0.00 36.38 33.41 3ho8 s VAL 905 CO 0.02 -0.01 0.31 -0.54 0.00 0.00 0.00 175.10 174.88 3ho8 s LYS 906 N -2.99 1.51 0.07 2.72 1.02 -1.26 -4.73 119.74 116.09 3ho8 s LYS 906 Ca 0.73 -2.34 0.02 0.00 0.02 0.00 0.00 55.97 54.40 3ho8 s LYS 906 Cb -0.38 -2.48 -0.03 0.00 -0.52 0.00 0.00 37.83 34.42 3ho8 s LYS 906 CO 0.44 -1.22 -0.07 0.14 -0.92 0.00 0.00 175.35 173.72 3ho8 s VAL 907 N -0.11 0.62 0.37 3.17 -7.23 -1.26 -4.57 120.40 111.38 3ho8 s VAL 907 Ca 0.21 -1.57 -0.28 0.00 -1.81 0.00 0.00 61.98 58.54 3ho8 s VAL 907 Cb -0.16 -1.23 -0.11 0.00 0.56 0.00 0.00 36.38 35.44 3ho8 s VAL 907 CO -0.06 -0.67 1.35 0.35 -0.31 0.00 0.00 175.10 175.75 3ho8 n THR 908 N 0.59 2.11 0.06 5.32 -2.24 -1.26 -0.05 114.28 118.81 3ho8 n THR 908 Ca -0.17 -0.50 0.03 0.00 -2.27 0.00 0.00 64.05 61.15 3ho8 n THR 908 Cb 0.58 -1.69 0.20 0.00 -2.10 0.00 0.00 70.33 67.32 3ho8 n THR 908 CO 0.00 0.00 0.00 -0.81 -0.57 0.00 0.00 175.07 173.69 3ho8 n PRO 909 N 0.42 2.92 -0.01 -0.78 -0.05 -1.26 -4.78 135.00 131.45 3ho8 n PRO 909 Ca 0.04 -1.56 -0.06 0.00 -0.05 0.00 0.00 63.50 61.86 3ho8 n PRO 909 Cb 0.38 -1.88 -0.13 0.00 -0.05 0.00 0.00 33.50 31.82 3ho8 n PRO 909 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 175.50 174.32 3ho8 n SER 910 N 0.30 0.87 0.20 3.54 3.41 0.93 -3.69 113.62 119.17 3ho8 n SER 910 Ca 0.14 0.41 0.07 0.00 -0.26 0.00 0.00 58.87 59.22 3ho8 n SER 910 Cb 0.73 -0.00 0.38 0.00 -0.26 0.00 0.00 64.21 65.06 3ho8 n SER 910 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 3ho8 h SER 911 N 0.00 0.00 1.37 4.04 4.64 -1.73 -2.21 113.55 119.66 3ho8 h SER 911 Ca -0.26 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.06 3ho8 h SER 911 Cb 1.91 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 64.00 3ho8 h SER 911 CO 0.07 0.33 0.00 0.50 -0.87 0.00 0.00 176.83 176.87 3ho8 h LYS 912 N 0.00 0.00 0.18 4.77 1.63 -1.86 -3.18 116.57 118.11 3ho8 h LYS 912 Ca -0.00 0.00 -0.35 0.00 -0.85 0.00 0.00 60.65 59.45 3ho8 h LYS 912 Cb 0.82 0.00 0.01 0.00 -0.60 0.00 0.00 32.23 32.46 3ho8 h LYS 912 CO 0.04 0.00 -1.73 0.28 -3.45 0.00 0.00 179.45 174.59 3ho8 h VAL 913 N 0.00 0.96 -0.30 2.00 2.07 -1.48 -3.21 116.25 116.29 3ho8 h VAL 913 Ca 0.00 -2.54 -0.08 0.00 0.82 0.00 0.00 66.70 64.90 3ho8 h VAL 913 Cb 0.68 2.77 -0.02 0.00 -1.52 0.00 0.00 31.29 33.20 3ho8 h VAL 913 CO 0.00 0.85 -0.16 0.58 0.02 0.00 0.00 177.57 178.86 3ho8 h VAL 914 N 0.10 1.24 -0.89 2.57 2.07 -1.56 -2.86 116.25 116.93 3ho8 h VAL 914 Ca -0.34 -1.11 -0.41 0.00 0.82 0.00 0.00 66.70 65.66 3ho8 h VAL 914 Cb 2.10 1.19 -0.25 0.00 -1.52 0.00 0.00 31.29 32.81 3ho8 h VAL 914 CO 0.18 0.36 0.52 0.61 0.02 0.00 0.00 177.57 179.27 3ho8 n GLY 915 N -0.53 4.14 0.00 2.17 0.00 -1.20 -2.61 105.19 107.16 3ho8 n GLY 915 Ca 0.00 -1.01 0.00 0.00 0.00 0.00 0.00 46.02 45.01 3ho8 n GLY 915 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3ho8 n ASP 916 N -0.79 3.83 0.07 1.61 10.43 -1.09 -4.38 116.55 126.22 3ho8 n ASP 916 Ca 0.52 -0.05 0.05 0.00 2.57 0.00 0.00 54.79 57.88 3ho8 n ASP 916 Cb 1.55 0.87 -0.04 0.00 1.84 0.00 0.00 41.12 45.34 3ho8 n ASP 916 CO 0.00 0.00 0.00 0.24 -1.07 0.00 0.00 177.20 176.37 3ho8 h MET 917 N 0.00 0.00 -0.23 -1.24 2.86 -1.63 -3.33 114.93 111.36 3ho8 h MET 917 Ca 0.00 0.00 -0.09 0.00 -2.06 0.00 0.00 59.70 57.55 3ho8 h MET 917 Cb 0.00 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.65 3ho8 h MET 917 CO 0.00 0.17 -0.25 0.00 1.06 0.00 0.00 176.91 177.89 3ho8 h ALA 918 N 1.68 1.15 -0.29 6.32 0.00 -1.74 -2.04 119.26 124.33 3ho8 h ALA 918 Ca -0.09 -0.34 0.00 0.00 0.00 0.00 0.00 54.91 54.49 3ho8 h ALA 918 Cb 1.32 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 19.00 3ho8 h ALA 918 CO 0.03 0.54 0.00 1.28 0.00 0.00 0.00 179.25 181.10 3ho8 n LEU 919 N -4.13 1.94 -0.05 0.00 7.99 -1.26 -3.92 117.00 117.58 3ho8 n LEU 919 Ca -0.00 -0.90 -0.06 0.00 -0.01 0.00 0.00 56.01 55.03 3ho8 n LEU 919 Cb 0.40 -0.19 -0.06 0.00 -0.11 0.00 0.00 43.42 43.45 3ho8 n LEU 919 CO 0.41 0.45 -0.83 0.00 -1.51 0.00 0.00 177.39 175.92 3ho8 n TYR 920 N 0.53 0.00 0.67 -1.77 9.36 -0.86 -3.59 117.16 121.50 3ho8 n TYR 920 Ca 0.15 0.00 0.13 0.00 3.32 0.00 0.00 57.90 61.49 3ho8 n TYR 920 Cb 0.34 -0.44 0.30 0.00 -0.63 0.00 0.00 39.34 38.91 3ho8 n TYR 920 CO 0.00 0.00 0.00 -1.33 0.22 0.00 0.00 176.86 175.75 3ho8 n MET 921 N -2.56 0.23 -0.10 2.98 2.81 -0.83 -3.42 117.12 116.23 3ho8 n MET 921 Ca -0.17 0.12 -0.19 0.00 -1.81 0.00 0.00 57.70 55.64 3ho8 n MET 921 Cb 0.76 -1.69 -0.08 0.00 -0.71 0.00 0.00 33.22 31.49 3ho8 n MET 921 CO 0.00 0.00 0.00 0.28 1.51 0.00 0.00 175.97 177.76 3ho8 n VAL 922 N -2.05 1.51 0.33 2.03 0.31 -1.25 -0.51 118.33 118.69 3ho8 n VAL 922 Ca 0.05 -0.04 0.21 0.00 -0.01 0.00 0.00 64.34 64.55 3ho8 n VAL 922 Cb 0.42 -2.11 1.12 0.00 -0.91 0.00 0.00 33.84 32.36 3ho8 n VAL 922 CO 0.00 0.00 0.00 -0.61 -1.32 0.00 0.00 176.83 174.90 3ho8 h GLN 923 N -1.00 0.00 0.00 5.55 4.15 -1.72 -3.11 115.11 118.99 3ho8 h GLN 923 Ca -0.32 0.00 -0.15 0.00 0.77 0.00 0.00 58.65 58.94 3ho8 h GLN 923 Cb 1.18 0.00 -0.30 0.00 0.21 0.00 0.00 27.48 28.57 3ho8 h GLN 923 CO -0.20 0.00 -0.82 0.27 -1.93 0.00 0.00 178.83 176.16 3ho8 n ASN 924 N -3.15 0.48 -2.70 -0.69 6.94 -1.22 -5.08 115.26 109.84 3ho8 n ASN 924 Ca -0.02 -1.98 -0.03 0.00 -0.02 0.00 0.00 54.58 52.52 3ho8 n ASN 924 Cb 0.11 -0.16 -0.03 0.00 -2.36 0.00 0.00 39.78 37.34 3ho8 n ASN 924 CO 0.00 0.00 0.00 0.47 -1.03 0.00 0.00 177.26 176.70 3ho8 n ASP 925 N 0.35 -3.39 -3.22 0.53 8.00 -0.92 -4.93 116.55 112.96 3ho8 n ASP 925 Ca -0.02 1.26 -0.15 0.00 0.71 0.00 0.00 54.79 56.60 3ho8 n ASP 925 Cb 1.01 -3.92 -0.04 0.00 -0.02 0.00 0.00 41.12 38.15 3ho8 n ASP 925 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 3ho8 s LEU 926 N -0.42 1.01 0.00 0.64 2.01 0.34 -4.97 118.68 117.29 3ho8 s LEU 926 Ca -0.16 -1.49 -0.02 0.00 0.01 0.00 0.00 54.13 52.47 3ho8 s LEU 926 Cb 0.01 1.50 0.01 0.00 0.01 0.00 0.00 46.19 47.72 3ho8 s LEU 926 CO 0.44 -1.31 0.12 -0.90 1.01 0.00 0.00 176.35 175.71 3ho8 n ASP 927 N -1.44 -0.36 0.00 2.29 5.68 -1.26 -4.82 116.55 116.64 3ho8 n ASP 927 Ca 0.01 -1.32 0.03 0.00 -0.50 0.00 0.00 54.79 53.00 3ho8 n ASP 927 Cb 0.61 0.61 0.17 0.00 -1.14 0.00 0.00 41.12 41.38 3ho8 n ASP 927 CO 0.00 0.00 0.00 -0.62 -1.33 0.00 0.00 177.20 175.25 3ho8 n GLU 928 N -0.10 0.20 0.00 0.11 -0.58 -1.26 -2.11 120.64 116.90 3ho8 n GLU 928 Ca -0.01 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.73 3ho8 n GLU 928 Cb 0.11 -1.47 0.00 0.00 -0.57 0.00 0.00 31.44 29.52 3ho8 n GLU 928 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 3ho8 n GLN 929 N -0.97 0.00 0.04 3.49 10.64 -1.26 -4.94 117.38 124.38 3ho8 n GLN 929 Ca 0.04 0.00 -0.02 0.00 -1.83 0.00 0.00 57.00 55.19 3ho8 n GLN 929 Cb 0.02 -0.28 -0.08 0.00 -0.86 0.00 0.00 30.24 29.04 3ho8 n GLN 929 CO 0.00 0.00 0.00 0.66 -1.83 0.00 0.00 177.06 175.89 3ho8 h SER 930 N 0.00 0.00 1.01 2.61 4.64 -1.82 -3.25 113.55 116.73 3ho8 h SER 930 Ca 0.00 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.30 3ho8 h SER 930 Cb 0.43 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.52 3ho8 h SER 930 CO 0.00 0.70 -0.09 1.62 -0.87 0.00 0.00 176.83 178.20 3ho8 h VAL 931 N 0.00 0.22 0.10 0.95 3.04 -1.85 -2.73 116.25 115.98 3ho8 h VAL 931 Ca -0.14 -0.76 -0.27 0.00 -1.01 0.00 0.00 66.70 64.53 3ho8 h VAL 931 Cb 1.66 1.62 -0.00 0.00 -2.01 0.00 0.00 31.29 32.56 3ho8 h VAL 931 CO 0.07 0.08 -1.22 0.40 -1.01 0.00 0.00 177.57 175.89 3ho8 h ILE 932 N 0.00 1.51 0.00 3.17 2.04 -1.90 -3.28 117.51 119.05 3ho8 h ILE 932 Ca -0.00 -3.11 0.00 0.00 1.00 0.00 0.00 64.86 62.75 3ho8 h ILE 932 Cb 0.61 2.91 0.00 0.00 -0.74 0.00 0.00 36.82 39.61 3ho8 h ILE 932 CO 0.01 0.90 0.00 0.41 0.00 0.00 0.00 178.15 179.47 3ho8 n THR 933 N -3.49 0.00 -3.02 -0.27 -1.04 -1.06 -4.35 114.28 101.05 3ho8 n THR 933 Ca -0.08 0.29 -0.44 0.00 -2.04 0.00 0.00 64.05 61.78 3ho8 n THR 933 Cb 1.01 -0.61 0.00 0.00 -1.82 0.00 0.00 70.33 68.91 3ho8 n THR 933 CO 0.00 0.00 0.00 0.47 -0.64 0.00 0.00 175.07 174.90 3ho8 n ASP 934 N -0.72 5.42 0.00 8.00 9.92 -1.07 -4.66 116.55 133.44 3ho8 n ASP 934 Ca 0.00 -3.05 0.00 0.00 -0.53 0.00 0.00 54.79 51.21 3ho8 n ASP 934 Cb 0.00 -1.47 0.00 0.00 -0.64 0.00 0.00 41.12 39.01 3ho8 n ASP 934 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 3ho8 n GLY 935 N 3.22 0.00 0.14 0.44 0.00 -1.24 -4.74 105.19 103.02 3ho8 n GLY 935 Ca 0.32 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.34 3ho8 n GLY 935 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 173.32 174.90 3ho8 n TYR 936 N -2.19 0.00 0.00 1.61 0.18 -1.26 -4.47 117.16 111.03 3ho8 n TYR 936 Ca 0.00 0.00 0.00 0.00 1.88 0.00 0.00 57.90 59.78 3ho8 n TYR 936 Cb 0.41 -0.02 0.00 0.00 -0.38 0.00 0.00 39.34 39.35 3ho8 n TYR 936 CO 0.00 0.00 0.00 1.17 -2.08 0.00 0.00 176.86 175.95 3ho8 n LYS 937 N -0.34 0.00 -1.84 -3.48 4.81 -1.26 -5.05 118.16 111.01 3ho8 n LYS 937 Ca 0.00 0.00 -0.38 0.00 -0.87 0.00 0.00 58.31 57.06 3ho8 n LYS 937 Cb 0.06 0.00 0.03 0.00 0.02 0.00 0.00 35.03 35.14 3ho8 n LYS 937 CO 0.00 0.00 0.00 -0.51 1.17 0.00 0.00 177.40 178.06 3ho8 s LEU 938 N 0.00 3.88 0.00 3.14 1.43 -1.26 -4.92 118.68 120.95 3ho8 s LEU 938 Ca 0.00 2.72 0.00 0.00 -1.03 0.00 0.00 54.13 55.82 3ho8 s LEU 938 Cb 0.00 -4.26 0.00 0.00 0.03 0.00 0.00 46.19 41.96 3ho8 s LEU 938 CO 0.00 -1.48 0.00 -0.67 0.23 0.00 0.00 176.35 174.43 3ho8 n ASP 939 N -0.93 0.00 -3.82 2.29 4.64 -1.26 -5.05 116.55 112.42 3ho8 n ASP 939 Ca 0.10 0.00 -0.13 0.00 -1.38 0.00 0.00 54.79 53.38 3ho8 n ASP 939 Cb 0.45 -0.74 -0.13 0.00 -1.04 0.00 0.00 41.12 39.66 3ho8 n ASP 939 CO 0.00 0.00 0.00 -0.36 -0.82 0.00 0.00 177.20 176.02 3ho8 s PHE 940 N -1.74 -0.11 0.30 -0.67 0.40 -1.26 -5.12 117.98 109.78 3ho8 s PHE 940 Ca 0.00 0.29 -0.28 0.00 -0.60 0.00 0.00 56.93 56.34 3ho8 s PHE 940 Cb 0.00 0.01 -0.09 0.00 0.51 0.00 0.00 43.02 43.44 3ho8 s PHE 940 CO 0.00 -0.07 1.00 -2.14 0.70 0.00 0.00 175.22 174.71 3ho8 s PRO 941 N 0.26 4.63 0.12 0.24 0.02 -1.26 -4.99 135.00 134.02 3ho8 s PRO 941 Ca -0.02 1.53 -0.30 0.00 0.02 0.00 0.00 61.00 62.23 3ho8 s PRO 941 Cb -0.03 -3.02 -0.09 0.00 0.02 0.00 0.00 34.50 31.38 3ho8 s PRO 941 CO -0.01 0.28 1.59 0.93 -0.33 0.00 0.00 177.00 179.46 3ho8 h GLU 942 N 3.56 -0.59 0.00 5.54 4.39 -2.01 -3.01 114.58 122.45 3ho8 h GLU 942 Ca -0.46 0.04 -0.08 0.00 0.34 0.00 0.00 59.36 59.19 3ho8 h GLU 942 Cb 1.20 0.13 -0.01 0.00 -0.10 0.00 0.00 28.75 29.97 3ho8 h GLU 942 CO 0.66 -0.39 -0.40 0.66 -1.16 0.00 0.00 179.01 178.37 3ho8 h SER 943 N -0.61 0.00 0.11 1.42 4.64 -1.94 -2.81 113.55 114.35 3ho8 h SER 943 Ca 0.03 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.35 3ho8 h SER 943 Cb 0.66 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.75 3ho8 h SER 943 CO -0.28 0.40 -0.05 0.58 -0.87 0.00 0.00 176.83 176.62 3ho8 h VAL 944 N 0.00 1.11 0.00 0.95 2.07 -1.86 0.80 116.25 119.32 3ho8 h VAL 944 Ca -0.00 -1.09 -0.02 0.00 0.82 0.00 0.00 66.70 66.41 3ho8 h VAL 944 Cb 0.83 1.77 -0.00 0.00 -1.52 0.00 0.00 31.29 32.37 3ho8 h VAL 944 CO 0.05 0.25 -0.08 -0.37 0.02 0.00 0.00 177.57 177.45 3ho8 h VAL 945 N -0.67 0.97 -0.35 2.57 -1.51 -1.60 0.02 116.25 115.68 3ho8 h VAL 945 Ca -0.01 -0.26 -0.09 0.00 -1.23 0.00 0.00 66.70 65.10 3ho8 h VAL 945 Cb 0.52 1.15 -0.01 0.00 -2.13 0.00 0.00 31.29 30.82 3ho8 h VAL 945 CO 0.02 0.07 -0.14 -1.28 -1.23 0.00 0.00 177.57 175.02 3ho8 h SER 946 N 0.00 0.72 -0.34 4.19 0.87 -1.37 -1.86 113.55 115.76 3ho8 h SER 946 Ca -0.00 -0.39 -0.07 0.00 -1.23 0.00 0.00 61.79 60.10 3ho8 h SER 946 Cb 0.14 -0.20 -0.01 0.00 -0.44 0.00 0.00 62.40 61.89 3ho8 h SER 946 CO 0.01 0.95 -0.06 0.15 -0.53 0.00 0.00 176.83 177.35 3ho8 h PHE 947 N 0.49 0.72 0.00 2.24 3.04 -0.21 -2.16 116.94 121.06 3ho8 h PHE 947 Ca 0.08 -0.15 0.00 0.00 3.98 0.00 0.00 57.97 61.88 3ho8 h PHE 947 Cb 0.67 -0.18 0.00 0.00 2.56 0.00 0.00 35.95 39.00 3ho8 h PHE 947 CO 0.06 0.80 0.00 1.19 -2.02 0.00 0.00 178.31 178.33 3ho8 n PHE 948 N -4.45 0.39 0.23 0.41 3.01 -0.06 -1.29 117.46 115.71 3ho8 n PHE 948 Ca -0.02 0.13 0.12 0.00 1.01 0.00 0.00 57.45 58.69 3ho8 n PHE 948 Cb 0.32 -0.71 0.12 0.00 -0.01 0.00 0.00 39.48 39.19 3ho8 n PHE 948 CO 0.00 0.00 0.00 -0.22 1.01 0.00 0.00 176.76 177.55 3ho8 h LYS 949 N 0.00 0.00 0.00 -1.08 3.64 -1.33 -3.46 116.57 114.33 3ho8 h LYS 949 Ca 0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 3ho8 h LYS 949 Cb 0.46 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.28 3ho8 h LYS 949 CO 0.00 0.00 0.00 0.41 -2.27 0.00 0.00 179.45 177.59 3ho8 n GLY 950 N 1.17 1.03 0.90 5.01 0.00 -0.41 -1.25 105.19 111.64 3ho8 n GLY 950 Ca 0.02 -0.16 0.00 0.00 0.00 0.00 0.00 46.02 45.88 3ho8 n GLY 950 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3ho8 n GLU 951 N -1.98 1.81 0.00 1.61 1.02 -0.82 -2.98 120.64 119.30 3ho8 n GLU 951 Ca 0.00 -0.72 0.00 0.00 -0.02 0.00 0.00 57.16 56.42 3ho8 n GLU 951 Cb 0.01 -1.62 0.00 0.00 -0.02 0.00 0.00 31.44 29.82 3ho8 n GLU 951 CO 0.00 0.00 0.00 1.51 1.18 0.00 0.00 177.13 179.82 3ho8 n ILE 952 N 0.14 0.00 0.00 -3.67 3.06 -1.26 -4.88 119.36 112.75 3ho8 n ILE 952 Ca 0.08 0.00 0.00 0.00 -2.50 0.00 0.00 62.75 60.33 3ho8 n ILE 952 Cb 0.52 1.35 0.00 0.00 0.54 0.00 0.00 39.64 42.05 3ho8 n ILE 952 CO 0.00 0.00 0.00 0.61 -2.50 0.00 0.00 176.55 174.66 3ho8 n GLY 953 N 0.00 2.43 3.75 4.50 0.00 -1.16 -4.89 105.19 109.82 3ho8 n GLY 953 Ca 0.00 -1.47 -0.38 0.00 0.00 0.00 0.00 46.02 44.17 3ho8 n GLY 953 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3ho8 s GLN 954 N -5.12 3.16 0.40 1.61 -1.52 -1.26 -4.96 119.66 111.96 3ho8 s GLN 954 Ca 0.00 2.11 0.03 0.00 -1.95 0.00 0.00 55.36 55.55 3ho8 s GLN 954 Cb 0.00 -2.20 0.07 0.00 -0.22 0.00 0.00 33.01 30.66 3ho8 s GLN 954 CO 0.00 -1.14 0.55 -0.35 -0.25 0.00 0.00 175.29 174.10 3ho8 n PRO 955 N -1.09 0.50 -0.05 2.91 -0.04 -1.26 -4.69 135.00 131.28 3ho8 n PRO 955 Ca 0.11 -1.81 -0.16 0.00 -0.04 0.00 0.00 63.50 61.60 3ho8 n PRO 955 Cb 0.46 -0.26 -0.07 0.00 -0.04 0.00 0.00 33.50 33.59 3ho8 n PRO 955 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 3ho8 h VAL 956 N -0.20 1.32 0.00 0.52 2.07 -1.86 -3.32 116.25 114.78 3ho8 h VAL 956 Ca -0.18 -1.77 0.00 0.00 0.82 0.00 0.00 66.70 65.57 3ho8 h VAL 956 Cb 0.76 1.96 0.00 0.00 -1.52 0.00 0.00 31.29 32.49 3ho8 h VAL 956 CO 0.23 0.55 -0.62 0.59 0.02 0.00 0.00 177.57 178.34 3ho8 n ASN 957 N -4.15 0.61 0.00 0.57 4.13 -1.26 -5.06 115.26 110.09 3ho8 n ASN 957 Ca -0.07 -0.40 0.00 0.00 1.68 0.00 0.00 54.58 55.80 3ho8 n ASN 957 Cb 0.61 0.42 0.00 0.00 -1.54 0.00 0.00 39.78 39.27 3ho8 n ASN 957 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 3ho8 n GLY 958 N 1.49 0.45 3.24 7.41 0.00 -1.25 -4.95 105.19 111.58 3ho8 n GLY 958 Ca 0.05 -0.96 -0.15 0.00 0.00 0.00 0.00 46.02 44.96 3ho8 n GLY 958 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3ho8 s PHE 959 N 0.00 1.41 -0.22 1.61 0.40 -1.26 -4.80 117.98 115.12 3ho8 s PHE 959 Ca 0.00 -1.49 -0.14 0.00 -0.60 0.00 0.00 56.93 54.71 3ho8 s PHE 959 Cb 0.00 -0.64 -0.04 0.00 0.51 0.00 0.00 43.02 42.85 3ho8 s PHE 959 CO 0.00 -0.72 0.31 1.21 0.70 0.00 0.00 175.22 176.72 3ho8 s ASN 960 N -3.25 6.31 0.17 1.36 3.04 -1.26 -5.02 114.94 116.29 3ho8 s ASN 960 Ca 0.39 0.36 -0.27 0.00 0.04 0.00 0.00 52.86 53.38 3ho8 s ASN 960 Cb 0.05 -2.19 0.02 0.00 -1.54 0.00 0.00 41.25 37.59 3ho8 s ASN 960 CO 0.18 -0.03 1.56 0.50 -3.04 0.00 0.00 177.10 176.27 3ho8 h LYS 961 N 7.48 -0.18 -0.37 0.43 3.11 -2.00 0.25 116.57 125.28 3ho8 h LYS 961 Ca -0.36 0.01 -0.07 0.00 -2.81 0.00 0.00 60.65 57.42 3ho8 h LYS 961 Cb 1.16 0.04 -0.02 0.00 -1.00 0.00 0.00 32.23 32.42 3ho8 h LYS 961 CO 0.69 -0.12 -0.06 -0.44 -2.81 0.00 0.00 179.45 176.70 3ho8 h ASP 962 N -0.19 0.60 -0.26 4.20 3.32 -1.99 -2.05 116.42 120.05 3ho8 h ASP 962 Ca 0.18 -0.15 -0.10 0.00 0.02 0.00 0.00 57.03 56.99 3ho8 h ASP 962 Cb 0.55 -0.16 -0.00 0.00 0.22 0.00 0.00 39.33 39.93 3ho8 h ASP 962 CO -0.75 0.71 -0.21 0.25 -1.72 0.00 0.00 179.24 177.51 3ho8 h LEU 963 N 0.58 0.63 -0.27 1.55 5.85 -1.63 -2.89 115.31 119.13 3ho8 h LEU 963 Ca 0.11 -0.46 -0.14 0.00 0.84 0.00 0.00 57.88 58.24 3ho8 h LEU 963 Cb 0.46 -0.18 -0.00 0.00 0.37 0.00 0.00 40.66 41.31 3ho8 h LEU 963 CO 0.02 0.96 -0.37 -0.61 -0.34 0.00 0.00 178.44 178.10 3ho8 h GLN 964 N 0.32 0.73 -0.04 1.25 4.15 -0.44 -3.08 115.11 118.00 3ho8 h GLN 964 Ca 0.05 -0.42 -0.13 0.00 0.77 0.00 0.00 58.65 58.91 3ho8 h GLN 964 Cb 0.76 0.03 -0.01 0.00 0.21 0.00 0.00 27.48 28.47 3ho8 h GLN 964 CO 0.06 1.04 -0.57 0.00 -1.93 0.00 0.00 178.83 177.43 3ho8 h ALA 965 N 0.68 0.97 -0.17 3.38 0.00 -1.46 -2.13 119.26 120.54 3ho8 h ALA 965 Ca 0.03 -0.52 -0.21 0.00 0.00 0.00 0.00 54.91 54.21 3ho8 h ALA 965 Cb 0.96 -0.09 0.01 0.00 0.00 0.00 0.00 17.79 18.66 3ho8 h ALA 965 CO 0.09 0.71 -0.72 0.28 0.00 0.00 0.00 179.25 179.61 3ho8 h VAL 966 N 0.09 1.29 -0.01 0.00 2.07 -1.58 -3.28 116.25 114.84 3ho8 h VAL 966 Ca -0.00 -1.94 -0.19 0.00 0.82 0.00 0.00 66.70 65.38 3ho8 h VAL 966 Cb 1.04 1.92 -0.01 0.00 -1.52 0.00 0.00 31.29 32.72 3ho8 h VAL 966 CO 0.08 0.61 -0.85 0.40 0.02 0.00 0.00 177.57 177.84 3ho8 h ILE 967 N 0.53 1.47 0.00 4.57 2.04 -1.49 -3.34 117.51 121.30 3ho8 h ILE 967 Ca -0.03 -2.53 0.00 0.00 1.00 0.00 0.00 64.86 63.29 3ho8 h ILE 967 Cb 1.33 2.41 0.00 0.00 -0.74 0.00 0.00 36.82 39.82 3ho8 h ILE 967 CO 0.15 0.74 0.00 0.18 0.00 0.00 0.00 178.15 179.22 3ho8 n LEU 968 N -3.69 0.10 0.00 1.44 4.77 -0.81 -4.86 117.00 113.96 3ho8 n LEU 968 Ca -0.04 0.51 0.00 0.00 -0.03 0.00 0.00 56.01 56.45 3ho8 n LEU 968 Cb 0.79 -0.48 0.00 0.00 -2.33 0.00 0.00 43.42 41.40 3ho8 n LEU 968 CO 0.48 -0.03 0.00 1.17 -1.33 0.00 0.00 177.39 177.68 3ho8 n LYS 969 N -1.59 0.00 -0.23 3.23 0.00 -1.24 -2.58 118.16 115.74 3ho8 n LYS 969 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 58.31 58.38 3ho8 n LYS 969 Cb 0.35 -3.92 0.00 0.00 0.00 0.00 0.00 35.03 31.46 3ho8 n LYS 969 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 3ho8 n GLY 970 N -1.65 0.87 3.94 3.14 0.00 -1.26 -5.11 105.19 105.13 3ho8 n GLY 970 Ca 0.00 -0.06 -0.24 0.00 0.00 0.00 0.00 46.02 45.71 3ho8 n GLY 970 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3ho8 s GLN 971 N -0.25 3.50 -0.49 1.61 -0.21 -1.07 -4.99 119.66 117.76 3ho8 s GLN 971 Ca 0.00 -0.26 -0.26 0.00 0.02 0.00 0.00 55.36 54.86 3ho8 s GLN 971 Cb 0.00 -2.63 -0.06 0.00 1.00 0.00 0.00 33.01 31.32 3ho8 s GLN 971 CO 0.00 0.11 2.34 -1.21 -2.12 0.00 0.00 175.29 174.40 3ho8 s GLU 972 N -4.35 2.20 -0.67 2.91 0.41 -1.26 -4.90 118.70 113.04 3ho8 s GLU 972 Ca 0.41 1.35 -0.27 0.00 -0.41 0.00 0.00 54.97 56.04 3ho8 s GLU 972 Cb -0.10 -4.55 0.02 0.00 -1.78 0.00 0.00 34.13 27.72 3ho8 s GLU 972 CO 0.37 -3.17 1.31 0.00 -0.49 0.00 0.00 175.26 173.29 3ho8 s ALA 973 N 11.69 2.78 0.00 5.21 0.00 -1.26 -4.93 121.76 135.25 3ho8 s ALA 973 Ca 0.94 -1.11 -0.30 0.00 0.00 0.00 0.00 51.96 51.49 3ho8 s ALA 973 Cb -0.17 -4.19 -0.07 0.00 0.00 0.00 0.00 23.12 18.69 3ho8 s ALA 973 CO 0.26 -3.14 1.68 -0.51 0.00 0.00 0.00 175.76 174.05 3ho8 s LEU 974 N 5.82 4.35 0.05 0.00 1.43 -0.38 -4.91 118.68 125.04 3ho8 s LEU 974 Ca 0.41 2.37 -0.22 0.00 -1.03 0.00 0.00 54.13 55.67 3ho8 s LEU 974 Cb -0.08 -3.54 -0.13 0.00 0.03 0.00 0.00 46.19 42.46 3ho8 s LEU 974 CO 0.19 -0.92 1.48 0.71 0.23 0.00 0.00 176.35 178.04 3ho8 h THR 975 N 5.29 1.25 -4.24 5.49 1.35 -1.93 -3.43 112.91 116.68 3ho8 h THR 975 Ca -0.42 -0.82 -0.48 0.00 -0.55 0.00 0.00 66.41 64.14 3ho8 h THR 975 Cb 1.19 1.54 0.12 0.00 -1.73 0.00 0.00 68.15 69.28 3ho8 h THR 975 CO 0.94 0.24 0.31 0.00 -0.25 0.00 0.00 175.52 176.76 3ho8 s ALA 976 N -4.98 2.04 -0.24 6.62 0.00 -1.26 -4.95 121.76 119.00 3ho8 s ALA 976 Ca -0.14 -0.24 -0.35 0.00 0.00 0.00 0.00 51.96 51.24 3ho8 s ALA 976 Cb 0.05 -3.11 -0.11 0.00 0.00 0.00 0.00 23.12 19.95 3ho8 s ALA 976 CO 0.71 -1.93 2.04 -2.13 0.00 0.00 0.00 175.76 174.45 3ho8 n ARG 977 N -3.57 1.57 -0.30 0.00 0.63 -1.26 -4.87 116.66 108.86 3ho8 n ARG 977 Ca 0.07 0.51 0.26 0.00 -0.92 0.00 0.00 57.85 57.77 3ho8 n ARG 977 Cb 0.57 -2.58 0.49 0.00 0.45 0.00 0.00 32.46 31.38 3ho8 n ARG 977 CO 0.00 0.00 0.00 -2.30 -2.51 0.00 0.00 177.63 172.82 3ho8 n PRO 978 N 7.44 -0.06 -0.64 -0.14 -0.01 -1.26 -0.36 135.00 139.97 3ho8 n PRO 978 Ca 0.32 1.28 -0.12 0.00 -0.01 0.00 0.00 63.50 64.97 3ho8 n PRO 978 Cb 0.27 -2.25 0.10 0.00 -0.01 0.00 0.00 33.50 31.61 3ho8 n PRO 978 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 175.50 175.90 3ho8 n GLY 979 N -1.28 3.26 0.03 -1.23 0.00 -1.26 -3.53 105.19 101.17 3ho8 n GLY 979 Ca 0.32 -0.57 -0.03 0.00 0.00 0.00 0.00 46.02 45.74 3ho8 n GLY 979 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 3ho8 n GLU 980 N -0.33 1.77 0.19 1.61 2.13 0.52 -3.58 120.64 122.95 3ho8 n GLU 980 Ca 0.31 0.02 0.05 0.00 0.66 0.00 0.00 57.16 58.19 3ho8 n GLU 980 Cb 1.10 -1.12 0.38 0.00 0.27 0.00 0.00 31.44 32.07 3ho8 n GLU 980 CO 0.00 0.00 0.00 1.88 -0.41 0.00 0.00 177.13 178.60 3ho8 h TYR 981 N 0.00 0.00 -3.22 4.31 0.99 -1.64 -3.44 116.97 113.96 3ho8 h TYR 981 Ca -0.14 0.00 -0.53 0.00 2.00 0.00 0.00 58.73 60.07 3ho8 h TYR 981 Cb 1.26 0.00 0.01 0.00 1.00 0.00 0.00 36.73 39.00 3ho8 h TYR 981 CO 0.00 0.37 0.60 -0.51 -0.00 0.00 0.00 178.16 178.62 3ho8 s LEU 982 N -7.51 4.39 0.11 3.88 1.43 -1.23 -5.00 118.68 114.75 3ho8 s LEU 982 Ca -0.01 2.15 -0.22 0.00 -1.03 0.00 0.00 54.13 55.01 3ho8 s LEU 982 Cb 0.13 -3.59 -0.07 0.00 0.03 0.00 0.00 46.19 42.69 3ho8 s LEU 982 CO 0.69 -0.49 0.67 -0.70 0.23 0.00 0.00 176.35 176.75 3ho8 s GLU 983 N 0.72 4.37 0.17 1.70 -6.30 -1.26 -4.60 118.70 113.50 3ho8 s GLU 983 Ca 0.59 0.93 -0.30 0.00 -2.50 0.00 0.00 54.97 53.69 3ho8 s GLU 983 Cb -0.32 -3.26 -0.17 0.00 0.00 0.00 0.00 34.13 30.38 3ho8 s GLU 983 CO 0.31 0.59 0.63 -2.30 0.02 0.00 0.00 175.26 174.51 3ho8 n PRO 984 N 1.73 0.06 -3.05 4.30 -0.02 -1.26 -4.74 135.00 132.01 3ho8 n PRO 984 Ca -0.08 0.02 -0.40 0.00 -2.02 0.00 0.00 63.50 61.02 3ho8 n PRO 984 Cb 0.50 -1.11 -0.05 0.00 -0.02 0.00 0.00 33.50 32.81 3ho8 n PRO 984 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 3ho8 s VAL 985 N -0.84 4.74 -1.06 -1.45 1.01 -1.26 -4.99 120.40 116.56 3ho8 s VAL 985 Ca 0.68 1.52 -0.22 0.00 0.00 0.00 0.00 61.98 63.96 3ho8 s VAL 985 Cb -0.97 -4.06 0.01 0.00 0.00 0.00 0.00 36.38 31.35 3ho8 s VAL 985 CO 0.56 0.40 1.71 -0.62 0.00 0.00 0.00 175.10 177.15 3ho8 s ASP 986 N -0.22 5.98 0.24 3.32 -1.08 -1.26 -4.84 116.67 118.81 3ho8 s ASP 986 Ca 0.36 -1.45 -0.06 0.00 -0.52 0.00 0.00 52.55 50.88 3ho8 s ASP 986 Cb -0.20 -2.57 0.31 0.00 -1.46 0.00 0.00 42.92 38.99 3ho8 s ASP 986 CO 0.22 -2.01 1.87 -0.26 0.52 0.00 0.00 175.17 175.50 3ho8 h PHE 987 N 9.79 1.03 -0.36 -5.34 -1.00 -2.00 -2.27 116.94 116.79 3ho8 h PHE 987 Ca 0.22 0.03 -0.08 0.00 2.81 0.00 0.00 57.97 60.95 3ho8 h PHE 987 Cb 0.97 -0.34 -0.02 0.00 3.61 0.00 0.00 35.95 40.18 3ho8 h PHE 987 CO 1.28 0.56 -0.11 1.49 -1.61 0.00 0.00 178.31 179.91 3ho8 h GLU 988 N 1.04 0.63 -0.21 1.51 4.57 -1.98 -1.71 114.58 118.42 3ho8 h GLU 988 Ca 0.37 -0.19 -0.18 0.00 -1.18 0.00 0.00 59.36 58.17 3ho8 h GLU 988 Cb 0.09 -0.06 -0.00 0.00 -0.16 0.00 0.00 28.75 28.62 3ho8 h GLU 988 CO -0.15 0.73 -0.59 0.87 -1.18 0.00 0.00 179.01 178.70 3ho8 h LYS 989 N 0.58 0.68 0.18 1.92 1.79 -1.83 0.18 116.57 120.06 3ho8 h LYS 989 Ca 0.10 -0.45 -0.01 0.00 -2.18 0.00 0.00 60.65 58.11 3ho8 h LYS 989 Cb 0.53 0.06 0.00 0.00 -1.58 0.00 0.00 32.23 31.25 3ho8 h LYS 989 CO 0.03 1.07 -0.09 0.28 -1.08 0.00 0.00 179.45 179.67 3ho8 h VAL 990 N 0.51 0.83 -0.90 0.50 2.07 -1.37 0.31 116.25 118.20 3ho8 h VAL 990 Ca 0.00 -0.01 0.17 0.00 0.82 0.00 0.00 66.70 67.69 3ho8 h VAL 990 Cb 1.16 0.83 -0.07 0.00 -1.52 0.00 0.00 31.29 31.69 3ho8 h VAL 990 CO 0.12 0.00 0.58 -0.09 0.02 0.00 0.00 177.57 178.20 3ho8 h ARG 991 N -0.24 0.56 0.22 1.57 9.65 -1.15 0.15 114.38 125.14 3ho8 h ARG 991 Ca -0.02 -0.03 -0.32 0.00 -1.10 0.00 0.00 59.98 58.50 3ho8 h ARG 991 Cb 0.19 -0.13 0.03 0.00 -1.39 0.00 0.00 29.97 28.67 3ho8 h ARG 991 CO 0.04 0.37 -1.42 1.49 2.80 0.00 0.00 179.97 183.25 3ho8 h GLU 992 N 0.58 0.48 -0.01 0.20 4.22 -0.12 -3.21 114.58 116.72 3ho8 h GLU 992 Ca 0.47 -0.82 0.00 0.00 0.08 0.00 0.00 59.36 59.09 3ho8 h GLU 992 Cb 0.92 0.30 0.00 0.00 0.50 0.00 0.00 28.75 30.47 3ho8 h GLU 992 CO -0.21 1.39 -0.05 -0.11 -2.18 0.00 0.00 179.01 177.85 3ho8 n LEU 993 N -3.68 1.48 0.07 1.64 7.94 0.10 -3.14 117.00 121.42 3ho8 n LEU 993 Ca -0.15 -0.48 0.12 0.00 -1.11 0.00 0.00 56.01 54.39 3ho8 n LEU 993 Cb 1.08 -0.02 0.19 0.00 0.53 0.00 0.00 43.42 45.20 3ho8 n LEU 993 CO 0.59 0.25 0.40 -0.07 -1.11 0.00 0.00 177.39 177.45 3ho8 h LEU 994 N 2.24 0.00 0.00 -1.96 3.38 -0.75 -3.39 115.31 114.83 3ho8 h LEU 994 Ca 0.00 -0.18 -0.21 0.00 0.09 0.00 0.00 57.88 57.59 3ho8 h LEU 994 Cb 0.52 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.24 3ho8 h LEU 994 CO 0.00 0.09 -1.44 -0.33 0.09 0.00 0.00 178.44 176.85 3ho8 h GLU 995 N 0.00 0.00 0.00 1.13 5.08 -1.55 -3.18 114.58 116.06 3ho8 h GLU 995 Ca 0.00 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.32 3ho8 h GLU 995 Cb 0.76 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.00 3ho8 h GLU 995 CO 0.00 0.40 -0.18 0.93 -1.00 0.00 0.00 179.01 179.16 3ho8 h GLU 996 N 0.00 0.00 0.05 2.33 5.08 -1.75 -3.31 114.58 116.98 3ho8 h GLU 996 Ca -0.19 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.17 3ho8 h GLU 996 Cb 1.72 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.97 3ho8 h GLU 996 CO 0.06 0.18 -0.02 0.93 -1.00 0.00 0.00 179.01 179.16 3ho8 h GLU 997 N 0.00 -0.06 0.00 2.33 5.08 -1.74 -3.47 114.58 116.71 3ho8 h GLU 997 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3ho8 h GLU 997 Cb 0.92 0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.18 3ho8 h GLU 997 CO 0.02 0.56 0.00 1.04 -1.00 0.00 0.00 179.01 179.63 3ho8 n GLN 998 N -4.78 0.92 0.10 2.33 6.02 -1.20 -5.03 117.38 115.74 3ho8 n GLN 998 Ca -0.08 0.00 -0.21 0.00 -0.01 0.00 0.00 57.00 56.70 3ho8 n GLN 998 Cb 0.32 0.00 -0.13 0.00 1.02 0.00 0.00 30.24 31.46 3ho8 n GLN 998 CO 0.00 0.00 0.00 -0.56 -1.01 0.00 0.00 177.06 175.49 3ho8 h GLN 999 N 0.00 0.57 0.00 -1.09 -0.00 -1.90 -3.47 115.11 109.22 3ho8 h GLN 999 Ca 0.00 -0.78 0.00 0.00 -0.00 0.00 0.00 58.65 57.87 3ho8 h GLN 999 Cb 0.00 0.26 0.00 0.00 -0.00 0.00 0.00 27.48 27.74 3ho8 h GLN 999 CO 0.00 1.35 0.00 0.41 -0.00 0.00 0.00 178.83 180.59 3ho8 n GLY 1000N 1.39 -1.87 3.69 0.06 0.00 -1.26 -4.99 105.19 102.21 3ho8 n GLY 1000Ca -0.13 0.63 -0.42 0.00 0.00 0.00 0.00 46.02 46.10 3ho8 n GLY 1000CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3ho8 s PRO 1001N 0.00 4.21 -0.06 1.61 0.04 -1.26 -4.74 135.00 134.80 3ho8 s PRO 1001Ca 0.00 2.28 0.00 0.00 0.04 0.00 0.00 61.00 63.32 3ho8 s PRO 1001Cb 0.00 -3.57 0.02 0.00 0.04 0.00 0.00 34.50 30.99 3ho8 s PRO 1001CO 0.00 -0.71 -0.03 0.08 0.04 0.00 0.00 177.00 176.38 3ho8 s VAL 1002N 2.54 0.51 0.53 -0.36 1.01 -1.26 -5.11 120.40 118.26 3ho8 s VAL 1002Ca 0.72 -0.04 -0.05 0.00 0.00 0.00 0.00 61.98 62.61 3ho8 s VAL 1002Cb -0.39 -0.59 -0.01 0.00 0.00 0.00 0.00 36.38 35.39 3ho8 s VAL 1002CO 0.31 0.25 0.83 0.42 0.00 0.00 0.00 175.10 176.91 3ho8 s THR 1003N 1.37 4.25 0.39 3.92 -4.23 -1.26 -4.96 115.64 115.12 3ho8 s THR 1003Ca -0.04 0.05 0.14 0.00 -1.18 0.00 0.00 61.69 60.67 3ho8 s THR 1003Cb -0.13 -3.64 0.36 0.00 1.34 0.00 0.00 72.50 70.42 3ho8 s THR 1003CO -0.03 -0.63 1.85 -0.33 -0.54 0.00 0.00 174.62 174.94 3ho8 h GLU 1004N 0.05 0.49 0.21 3.99 4.39 -2.01 -1.79 114.58 119.92 3ho8 h GLU 1004Ca -0.46 -0.03 -0.00 0.00 0.34 0.00 0.00 59.36 59.20 3ho8 h GLU 1004Cb 1.23 -0.11 -0.01 0.00 -0.10 0.00 0.00 28.75 29.77 3ho8 h GLU 1004CO 0.61 0.33 -0.14 1.96 -1.16 0.00 0.00 179.01 180.60 3ho8 h GLN 1005N 0.51 -0.34 -1.00 2.33 4.20 -1.98 -1.73 115.11 117.10 3ho8 h GLN 1005Ca 0.48 0.02 0.23 0.00 0.06 0.00 0.00 58.65 59.45 3ho8 h GLN 1005Cb 1.05 0.08 -0.10 0.00 0.30 0.00 0.00 27.48 28.81 3ho8 h GLN 1005CO -0.21 -0.22 0.63 -0.44 -0.67 0.00 0.00 178.83 177.91 3ho8 h ASP 1006N -0.35 0.57 0.03 1.46 3.32 -1.72 -2.36 116.42 117.37 3ho8 h ASP 1006Ca -0.02 0.09 -0.00 0.00 0.02 0.00 0.00 57.03 57.12 3ho8 h ASP 1006Cb 0.30 -0.01 0.00 0.00 0.22 0.00 0.00 39.33 39.84 3ho8 h ASP 1006CO 0.01 0.16 -0.01 0.40 -1.72 0.00 0.00 179.24 178.07 3ho8 h ILE 1007N 0.53 1.35 -0.33 0.35 2.04 -0.88 -2.82 117.51 117.75 3ho8 h ILE 1007Ca 0.58 -1.23 -0.12 0.00 1.00 0.00 0.00 64.86 65.08 3ho8 h ILE 1007Cb 1.23 2.17 -0.01 0.00 -0.74 0.00 0.00 36.82 39.47 3ho8 h ILE 1007CO -0.33 0.31 -0.26 0.16 0.00 0.00 0.00 178.15 178.04 3ho8 h ILE 1008N -0.58 1.29 -0.49 -0.67 3.07 -1.40 -3.07 117.51 115.66 3ho8 h ILE 1008Ca -0.00 -1.41 0.10 0.00 1.55 0.00 0.00 64.86 65.09 3ho8 h ILE 1008Cb 0.54 1.47 -0.09 0.00 -0.27 0.00 0.00 36.82 38.48 3ho8 h ILE 1008CO 0.01 0.46 -0.06 0.28 -1.05 0.00 0.00 178.15 177.78 3ho8 h SER 1009N 0.52 -0.34 0.46 2.16 0.02 -1.48 -0.01 113.55 114.90 3ho8 h SER 1009Ca 0.06 0.13 -0.01 0.00 -0.84 0.00 0.00 61.79 61.13 3ho8 h SER 1009Cb 0.82 0.26 -0.02 0.00 0.14 0.00 0.00 62.40 63.60 3ho8 h SER 1009CO 0.07 -0.12 -0.43 0.22 -1.14 0.00 0.00 176.83 175.43 3ho8 h TYR 1010N 0.05 -1.17 -0.53 3.45 3.20 -1.54 -0.89 116.97 119.54 3ho8 h TYR 1010Ca 0.24 0.01 0.11 0.00 3.14 0.00 0.00 58.73 62.22 3ho8 h TYR 1010Cb 0.37 0.45 -0.10 0.00 1.54 0.00 0.00 36.73 38.99 3ho8 h TYR 1010CO -0.36 -0.59 -0.14 0.28 -1.64 0.00 0.00 178.16 175.70 3ho8 h VAL 1011N -0.90 0.45 -0.93 1.81 2.07 -1.17 0.19 116.25 117.76 3ho8 h VAL 1011Ca -0.05 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.50 3ho8 h VAL 1011Cb 0.78 0.45 -0.05 0.00 -1.52 0.00 0.00 31.29 30.95 3ho8 h VAL 1011CO -0.04 0.00 0.61 -0.07 0.02 0.00 0.00 177.57 178.08 3ho8 h LEU 1012N -0.01 1.02 -6.02 2.57 3.38 -0.91 -3.35 115.31 111.99 3ho8 h LEU 1012Ca 0.26 -0.01 -0.56 0.00 0.09 0.00 0.00 57.88 57.65 3ho8 h LEU 1012Cb 0.40 -0.24 -0.40 0.00 0.09 0.00 0.00 40.66 40.52 3ho8 h LEU 1012CO -0.56 0.71 -1.01 -1.22 0.09 0.00 0.00 178.44 176.45 3ho8 n TYR 1013N -4.49 0.57 0.00 1.13 4.02 0.14 -4.34 117.16 114.19 3ho8 n TYR 1013Ca 0.12 -3.71 0.00 0.00 -0.01 0.00 0.00 57.90 54.30 3ho8 n TYR 1013Cb 0.08 -0.40 0.00 0.00 -0.02 0.00 0.00 39.34 38.99 3ho8 n TYR 1013CO 0.00 0.00 0.00 -2.30 -1.01 0.00 0.00 176.86 173.55 3ho8 n PRO 1014N 1.14 0.00 0.13 -0.72 -0.02 0.42 -0.74 135.00 135.20 3ho8 n PRO 1014Ca 0.23 0.81 -0.02 0.00 -2.02 0.00 0.00 63.50 62.51 3ho8 n PRO 1014Cb 0.52 -1.39 0.17 0.00 -0.02 0.00 0.00 33.50 32.78 3ho8 n PRO 1014CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 3ho8 h LYS 1015N 0.00 0.04 -0.61 -0.52 1.57 -1.97 -2.10 116.57 112.98 3ho8 h LYS 1015Ca 0.00 -0.03 -0.03 0.00 -1.87 0.00 0.00 60.65 58.72 3ho8 h LYS 1015Cb 0.00 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.29 3ho8 h LYS 1015CO 0.00 0.64 0.24 0.28 -0.57 0.00 0.00 179.45 180.04 3ho8 h VAL 1016N 0.03 1.22 -0.02 0.50 2.07 -1.90 -2.38 116.25 115.77 3ho8 h VAL 1016Ca -0.01 -0.68 -0.02 0.00 0.82 0.00 0.00 66.70 66.81 3ho8 h VAL 1016Cb 1.08 0.49 0.00 0.00 -1.52 0.00 0.00 31.29 31.34 3ho8 h VAL 1016CO 0.08 0.27 -0.07 0.22 0.02 0.00 0.00 177.57 178.09 3ho8 h TYR 1017N 0.88 0.10 -1.23 1.57 3.20 -0.58 -2.94 116.97 117.97 3ho8 h TYR 1017Ca 0.21 -0.04 0.35 0.00 3.14 0.00 0.00 58.73 62.39 3ho8 h TYR 1017Cb 0.18 -0.02 -0.08 0.00 1.54 0.00 0.00 36.73 38.35 3ho8 h TYR 1017CO 0.01 0.72 0.84 0.93 -1.64 0.00 0.00 178.16 179.02 3ho8 h GLU 1018N -0.55 0.14 0.04 1.82 5.08 -1.28 -1.34 114.58 118.49 3ho8 h GLU 1018Ca -0.00 -0.01 -0.25 0.00 -1.00 0.00 0.00 59.36 58.10 3ho8 h GLU 1018Cb 0.72 -0.03 0.02 0.00 0.50 0.00 0.00 28.75 29.97 3ho8 h GLU 1018CO 0.01 0.09 -1.00 1.96 -1.00 0.00 0.00 179.01 179.07 3ho8 h GLN 1019N 0.14 0.61 -0.53 2.33 4.20 -1.38 -3.11 115.11 117.37 3ho8 h GLN 1019Ca 0.65 -0.71 0.00 0.00 0.06 0.00 0.00 58.65 58.65 3ho8 h GLN 1019Cb 2.19 0.21 -0.03 0.00 0.30 0.00 0.00 27.48 30.16 3ho8 h GLN 1019CO -0.17 1.30 0.34 -0.92 -0.67 0.00 0.00 178.83 178.71 3ho8 h TYR 1020N 0.23 0.68 0.00 2.96 3.20 -1.07 -1.23 116.97 121.73 3ho8 h TYR 1020Ca -0.14 0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.74 3ho8 h TYR 1020Cb 1.68 -0.23 0.00 0.00 1.54 0.00 0.00 36.73 39.72 3ho8 h TYR 1020CO 0.12 0.44 0.00 -0.89 -1.64 0.00 0.00 178.16 176.19 3ho8 n ILE 1021N -4.44 0.48 0.10 1.81 2.08 -1.01 -1.51 119.36 116.86 3ho8 n ILE 1021Ca 0.05 0.03 -0.17 0.00 0.56 0.00 0.00 62.75 63.22 3ho8 n ILE 1021Cb 0.06 -0.73 -0.12 0.00 -0.75 0.00 0.00 39.64 38.10 3ho8 n ILE 1021CO 0.00 0.00 0.00 1.56 0.56 0.00 0.00 176.55 178.67 3ho8 h GLN 1022N 0.00 0.35 0.00 0.38 1.08 -1.16 -3.05 115.11 112.71 3ho8 h GLN 1022Ca 0.00 -0.54 -0.26 0.00 -1.45 0.00 0.00 58.65 56.40 3ho8 h GLN 1022Cb 0.47 0.19 -0.04 0.00 -0.05 0.00 0.00 27.48 28.05 3ho8 h GLN 1022CO 0.00 1.23 -1.49 1.15 -0.95 0.00 0.00 178.83 178.77 3ho8 h THR 1023N 0.13 1.03 0.00 -0.54 2.02 -1.19 -1.33 112.91 113.02 3ho8 h THR 1023Ca -0.14 -2.81 -0.15 0.00 0.77 0.00 0.00 66.41 64.08 3ho8 h THR 1023Cb 1.91 2.49 -0.02 0.00 -1.74 0.00 0.00 68.15 70.79 3ho8 h THR 1023CO 0.21 0.58 -0.70 -0.09 0.37 0.00 0.00 175.52 175.89 3ho8 h ARG 1024N 0.00 0.00 -0.45 6.66 2.43 -1.43 0.16 114.38 121.75 3ho8 h ARG 1024Ca -0.21 0.00 -0.03 0.00 -0.81 0.00 0.00 59.98 58.94 3ho8 h ARG 1024Cb 1.91 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 31.44 3ho8 h ARG 1024CO 0.09 0.70 0.18 -0.91 -1.51 0.00 0.00 179.97 178.52 3ho8 h ASN 1025N 0.00 0.63 0.00 -3.80 -0.26 -1.53 -3.08 115.58 107.54 3ho8 h ASN 1025Ca -0.01 -0.17 0.00 0.00 -0.56 0.00 0.00 56.30 55.56 3ho8 h ASN 1025Cb 1.51 -0.16 0.00 0.00 -1.06 0.00 0.00 38.32 38.60 3ho8 h ASN 1025CO 0.09 0.62 0.00 0.00 -1.06 0.00 0.00 177.43 177.08 3ho8 n GLN 1026N -4.60 0.00 0.00 0.81 6.02 -0.51 -4.69 117.38 114.42 3ho8 n GLN 1026Ca 0.01 0.00 0.08 0.00 -0.01 0.00 0.00 57.00 57.08 3ho8 n GLN 1026Cb 0.15 -0.07 0.48 0.00 1.02 0.00 0.00 30.24 31.82 3ho8 n GLN 1026CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.06 176.71 3ho8 n TYR 1027N 0.00 0.00 -4.05 1.08 0.53 0.56 -4.92 117.16 110.36 3ho8 n TYR 1027Ca 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 57.90 56.88 3ho8 n TYR 1027Cb 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 39.34 38.31 3ho8 n TYR 1027CO 0.00 0.00 0.00 0.41 -1.02 0.00 0.00 176.86 176.25 3ho8 n GLY 1028N 0.57 0.05 3.34 2.72 0.00 -1.16 -4.47 105.19 106.23 3ho8 n GLY 1028Ca 0.12 -1.01 -0.46 0.00 0.00 0.00 0.00 46.02 44.68 3ho8 n GLY 1028CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 3ho8 s ASN 1029N -4.00 6.47 0.55 1.61 3.84 -1.26 -4.15 114.94 118.01 3ho8 s ASN 1029Ca 0.00 -2.14 0.34 0.00 0.21 0.00 0.00 52.86 51.27 3ho8 s ASN 1029Cb 0.00 -2.24 1.40 0.00 -0.55 0.00 0.00 41.25 39.85 3ho8 s ASN 1029CO 0.00 -0.80 2.00 -0.07 -2.79 0.00 0.00 177.10 175.44 3ho8 h LEU 1030N 8.74 0.00 -2.11 3.21 3.38 -1.81 -3.04 115.31 123.67 3ho8 h LEU 1030Ca -0.08 0.00 0.08 0.00 0.09 0.00 0.00 57.88 57.97 3ho8 h LEU 1030Cb 1.07 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.80 3ho8 h LEU 1030CO 0.93 0.00 0.30 0.77 0.09 0.00 0.00 178.44 180.54 3ho8 h SER 1031N 0.00 0.00 1.27 -0.43 4.64 -1.88 -2.22 113.55 114.93 3ho8 h SER 1031Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3ho8 h SER 1031Cb 0.50 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.59 3ho8 h SER 1031CO 0.00 0.00 0.00 -0.07 -0.87 0.00 0.00 176.83 175.89 3ho8 h LEU 1032N 0.00 0.00 -9.98 5.97 3.38 -1.86 -3.36 115.31 109.46 3ho8 h LEU 1032Ca 0.14 0.00 -0.53 0.00 0.09 0.00 0.00 57.88 57.58 3ho8 h LEU 1032Cb 0.73 0.00 0.09 0.00 0.09 0.00 0.00 40.66 41.57 3ho8 h LEU 1032CO -0.00 0.00 0.60 -0.76 0.09 0.00 0.00 178.44 178.37 3ho8 s LEU 1033N -5.42 4.11 0.46 1.67 1.43 -0.84 -4.49 118.68 115.61 3ho8 s LEU 1033Ca 0.05 2.64 -0.23 0.00 -1.03 0.00 0.00 54.13 55.56 3ho8 s LEU 1033Cb 0.09 -4.03 -0.07 0.00 0.03 0.00 0.00 46.19 42.21 3ho8 s LEU 1033CO 0.55 -1.02 1.22 1.51 0.23 0.00 0.00 176.35 178.84 3ho8 s ASP 1034N -0.86 6.07 0.25 2.29 1.47 -1.26 -4.84 116.67 119.79 3ho8 s ASP 1034Ca 0.61 2.45 -0.04 0.00 1.18 0.00 0.00 52.55 56.74 3ho8 s ASP 1034Cb -0.37 -2.62 0.50 0.00 -0.34 0.00 0.00 42.92 40.09 3ho8 s ASP 1034CO 0.47 -1.00 1.67 0.74 0.68 0.00 0.00 175.17 177.73 3ho8 h THR 1035N 1.94 0.44 -0.88 2.11 2.02 -1.95 -1.43 112.91 115.16 3ho8 h THR 1035Ca -0.50 -0.08 0.03 0.00 0.77 0.00 0.00 66.41 66.64 3ho8 h THR 1035Cb 1.26 0.20 -0.05 0.00 -1.74 0.00 0.00 68.15 67.81 3ho8 h THR 1035CO 0.60 0.04 0.58 -0.65 0.37 0.00 0.00 175.52 176.46 3ho8 h PRO 1036N 0.22 1.09 -0.33 6.66 0.11 -1.92 -1.58 132.00 136.25 3ho8 h PRO 1036Ca 0.44 -0.07 -0.16 0.00 0.11 0.00 0.00 66.00 66.32 3ho8 h PRO 1036Cb 0.79 -0.25 -0.00 0.00 0.11 0.00 0.00 31.00 31.65 3ho8 h PRO 1036CO -0.57 0.72 -0.44 1.15 -0.21 0.00 0.00 178.00 178.65 3ho8 h THR 1037N 1.12 1.28 -0.88 -1.15 2.02 -1.46 0.67 112.91 114.50 3ho8 h THR 1037Ca 0.35 -1.62 0.02 0.00 0.77 0.00 0.00 66.41 65.93 3ho8 h THR 1037Cb -0.01 1.48 -0.05 0.00 -1.74 0.00 0.00 68.15 67.84 3ho8 h THR 1037CO -0.10 0.53 0.58 0.15 0.37 0.00 0.00 175.52 177.05 3ho8 h PHE 1038N 0.69 1.09 0.15 3.16 3.57 -1.13 -0.63 116.94 123.86 3ho8 h PHE 1038Ca 0.04 0.03 -0.34 0.00 3.53 0.00 0.00 57.97 61.23 3ho8 h PHE 1038Cb 1.03 -0.37 -0.00 0.00 2.79 0.00 0.00 35.95 39.40 3ho8 h PHE 1038CO 0.06 0.66 -1.74 0.74 -2.23 0.00 0.00 178.31 175.80 3ho8 h PHE 1039N 1.15 0.58 -0.00 0.41 0.05 -1.18 -3.42 116.94 114.53 3ho8 h PHE 1039Ca 0.34 -0.42 0.00 0.00 3.82 0.00 0.00 57.97 61.70 3ho8 h PHE 1039Cb -0.07 -0.02 0.00 0.00 2.00 0.00 0.00 35.95 37.86 3ho8 h PHE 1039CO -0.01 1.60 -0.06 1.19 -0.18 0.00 0.00 178.31 180.84 3ho8 n PHE 1040N -3.51 0.00 0.00 -0.55 3.01 0.22 -4.32 117.46 112.30 3ho8 n PHE 1040Ca -0.24 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.22 3ho8 n PHE 1040Cb 1.06 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 40.53 3ho8 n PHE 1040CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3ho8 n GLY 1041N 0.89 2.49 3.16 1.37 0.00 -0.24 -4.33 105.19 108.53 3ho8 n GLY 1041Ca 0.00 -0.30 -0.12 0.00 0.00 0.00 0.00 46.02 45.60 3ho8 n GLY 1041CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3ho8 s MET 1042N 0.00 0.45 0.50 1.61 -1.94 -1.26 -4.27 119.30 114.39 3ho8 s MET 1042Ca 0.00 0.01 -0.05 0.00 -1.71 0.00 0.00 55.69 53.94 3ho8 s MET 1042Cb 0.00 0.20 -0.02 0.00 2.01 0.00 0.00 34.83 37.02 3ho8 s MET 1042CO 0.00 -0.10 0.80 -0.98 -0.01 0.00 0.00 175.02 174.73 3ho8 s ARG 1043N -0.66 3.37 0.16 2.03 1.70 -1.26 -4.88 118.95 119.41 3ho8 s ARG 1043Ca -0.08 0.09 -0.32 0.00 -0.47 0.00 0.00 55.73 54.96 3ho8 s ARG 1043Cb -0.04 -2.37 -0.10 0.00 -0.57 0.00 0.00 34.95 31.87 3ho8 s ARG 1043CO 0.02 -0.31 1.58 -0.80 -1.08 0.00 0.00 175.30 174.70 3ho8 s ASN 1044N -4.16 6.58 -0.67 -2.89 0.02 -1.26 -2.70 114.94 109.86 3ho8 s ASN 1044Ca 0.49 2.62 -0.01 0.00 -1.02 0.00 0.00 52.86 54.94 3ho8 s ASN 1044Cb -0.10 -2.59 0.00 0.00 0.02 0.00 0.00 41.25 38.58 3ho8 s ASN 1044CO 0.44 -0.83 0.12 0.61 0.02 0.00 0.00 177.10 177.46 3ho8 n GLY 1045N 3.78 0.11 3.94 0.66 0.00 0.12 -5.01 105.19 108.79 3ho8 n GLY 1045Ca 0.14 -0.48 -0.25 0.00 0.00 0.00 0.00 46.02 45.44 3ho8 n GLY 1045CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3ho8 s GLU 1046N -4.70 3.48 -0.16 1.61 2.12 -1.10 -4.97 118.70 114.99 3ho8 s GLU 1046Ca 0.06 -0.49 0.02 0.00 0.36 0.00 0.00 54.97 54.92 3ho8 s GLU 1046Cb -0.03 -2.83 0.01 0.00 0.26 0.00 0.00 34.13 31.55 3ho8 s GLU 1046CO 0.07 0.36 -0.21 0.99 -0.54 0.00 0.00 175.26 175.94 3ho8 s THR 1047N -1.99 2.10 0.09 -1.70 2.01 -1.26 -3.29 115.64 111.60 3ho8 s THR 1047Ca 0.37 -0.95 0.08 0.00 0.31 0.00 0.00 61.69 61.51 3ho8 s THR 1047Cb -0.10 -1.86 -0.03 0.00 0.01 0.00 0.00 72.50 70.52 3ho8 s THR 1047CO 0.31 0.54 -0.22 -0.69 -0.69 0.00 0.00 174.62 173.87 3ho8 s VAL 1048N 1.01 1.78 -0.08 3.82 1.01 0.20 -4.99 120.40 123.15 3ho8 s VAL 1048Ca -0.02 -1.47 0.04 0.00 0.00 0.00 0.00 61.98 60.52 3ho8 s VAL 1048Cb -0.14 -1.59 0.00 0.00 0.00 0.00 0.00 36.38 34.64 3ho8 s VAL 1048CO -0.06 0.04 -0.21 -1.61 0.00 0.00 0.00 175.10 173.26 3ho8 s GLU 1049N -1.71 2.53 -0.09 2.72 2.02 -1.26 -0.59 118.70 122.32 3ho8 s GLU 1049Ca 0.08 -0.74 0.01 0.00 0.02 0.00 0.00 54.97 54.33 3ho8 s GLU 1049Cb -0.10 -1.99 0.02 0.00 0.10 0.00 0.00 34.13 32.16 3ho8 s GLU 1049CO 0.04 0.18 -0.10 0.42 0.02 0.00 0.00 175.26 175.81 3ho8 s ILE 1050N 0.32 1.13 -0.54 -1.63 -1.09 -0.75 -4.85 121.20 113.79 3ho8 s ILE 1050Ca -0.14 -0.41 -0.17 0.00 -2.23 0.00 0.00 60.65 57.69 3ho8 s ILE 1050Cb -0.16 -1.08 0.10 0.00 -1.58 0.00 0.00 42.46 39.73 3ho8 s ILE 1050CO 0.06 0.37 0.57 -0.70 -1.23 0.00 0.00 174.94 174.02 3ho8 s GLU 1051N 1.20 3.03 0.00 2.79 2.12 -1.26 -0.92 118.70 125.66 3ho8 s GLU 1051Ca -0.04 -1.39 0.29 0.00 0.36 0.00 0.00 54.97 54.19 3ho8 s GLU 1051Cb -0.14 -4.23 1.23 0.00 0.26 0.00 0.00 34.13 31.25 3ho8 s GLU 1051CO -0.03 -1.34 1.91 0.44 -0.54 0.00 0.00 175.26 175.70 3ho8 n ILE 1052N 5.40 0.00 0.00 -3.70 -6.64 -0.63 -4.87 119.36 108.93 3ho8 n ILE 1052Ca -0.11 -0.00 0.00 0.00 -1.77 0.00 0.00 62.75 60.87 3ho8 n ILE 1052Cb 0.42 -0.43 0.00 0.00 -1.44 0.00 0.00 39.64 38.19 3ho8 n ILE 1052CO 0.00 0.00 0.00 -0.67 -1.77 0.00 0.00 176.55 174.11 3ho8 n ASP 1053N -1.45 0.00 -4.66 7.28 2.03 -1.25 -5.04 116.55 113.45 3ho8 n ASP 1053Ca 0.08 0.00 -0.51 0.00 0.52 0.00 0.00 54.79 54.88 3ho8 n ASP 1053Cb 0.32 0.00 -0.06 0.00 -0.72 0.00 0.00 41.12 40.67 3ho8 n ASP 1053CO 0.00 0.00 0.00 0.29 -1.92 0.00 0.00 177.20 175.57 3ho8 n LYS 1054N -0.04 1.64 -0.94 -0.67 4.76 -1.26 -1.50 118.16 120.14 3ho8 n LYS 1054Ca 0.00 0.60 0.00 0.00 -2.87 0.00 0.00 58.31 56.04 3ho8 n LYS 1054Cb 0.00 -2.33 0.00 0.00 -1.84 0.00 0.00 35.03 30.86 3ho8 n LYS 1054CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3ho8 n GLY 1055N 3.67 0.76 2.89 0.72 0.00 -1.26 -4.93 105.19 107.04 3ho8 n GLY 1055Ca 0.21 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.92 3ho8 n GLY 1055CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3ho8 n LYS 1056N -2.08 2.36 -3.67 1.61 5.02 -0.56 -5.04 118.16 115.79 3ho8 n LYS 1056Ca 0.00 -4.53 -0.39 0.00 -2.02 0.00 0.00 58.31 51.37 3ho8 n LYS 1056Cb 0.02 -2.34 -0.12 0.00 -0.02 0.00 0.00 35.03 32.57 3ho8 n LYS 1056CO 0.00 0.00 0.00 -0.98 -0.52 0.00 0.00 177.40 175.90 3ho8 s ARG 1057N -1.70 3.04 0.06 1.97 1.70 -1.26 -1.60 118.95 121.16 3ho8 s ARG 1057Ca 0.29 -0.92 -0.23 0.00 -0.47 0.00 0.00 55.73 54.40 3ho8 s ARG 1057Cb -0.01 -3.57 -0.06 0.00 -0.57 0.00 0.00 34.95 30.74 3ho8 s ARG 1057CO -0.11 -0.54 0.70 -0.48 -1.08 0.00 0.00 175.30 173.78 3ho8 s LEU 1058N 1.55 4.48 -0.36 -1.89 2.34 -0.10 -4.88 118.68 119.83 3ho8 s LEU 1058Ca 0.03 1.39 -0.14 0.00 0.06 0.00 0.00 54.13 55.47 3ho8 s LEU 1058Cb -0.18 -3.12 -0.01 0.00 -0.56 0.00 0.00 46.19 42.33 3ho8 s LEU 1058CO 0.05 0.12 0.28 -0.63 -1.06 0.00 0.00 176.35 175.11 3ho8 s ILE 1059N -0.48 5.25 -0.20 1.48 -1.09 -1.26 -1.80 121.20 123.10 3ho8 s ILE 1059Ca 0.35 -0.26 -0.02 0.00 -2.23 0.00 0.00 60.65 58.49 3ho8 s ILE 1059Cb -0.20 -3.79 0.00 0.00 -1.58 0.00 0.00 42.46 36.89 3ho8 s ILE 1059CO 0.22 -0.10 -0.12 -0.63 -1.23 0.00 0.00 174.94 173.08 3ho8 s ILE 1060N 1.79 2.79 -0.19 2.92 1.01 0.25 -1.40 121.20 128.36 3ho8 s ILE 1060Ca 0.07 -0.69 0.01 0.00 0.00 0.00 0.00 60.65 60.04 3ho8 s ILE 1060Cb -0.18 -2.23 0.03 0.00 0.01 0.00 0.00 42.46 40.10 3ho8 s ILE 1060CO 0.11 0.48 -0.15 -0.75 0.00 0.00 0.00 174.94 174.63 3ho8 s LYS 1061N 1.32 2.47 -0.06 2.79 2.20 -0.95 -0.62 119.74 126.88 3ho8 s LYS 1061Ca 0.04 -0.88 -0.22 0.00 -0.36 0.00 0.00 55.97 54.55 3ho8 s LYS 1061Cb -0.14 -2.50 -0.04 0.00 -1.51 0.00 0.00 37.83 33.64 3ho8 s LYS 1061CO -0.07 -0.34 0.66 -1.17 -0.36 0.00 0.00 175.35 174.07 3ho8 s LEU 1062N 1.32 4.33 -0.27 5.43 0.20 -1.21 -0.00 118.68 128.48 3ho8 s LEU 1062Ca 0.01 1.15 -0.14 0.00 0.69 0.00 0.00 54.13 55.83 3ho8 s LEU 1062Cb -0.15 -3.02 -0.11 0.00 -0.43 0.00 0.00 46.19 42.48 3ho8 s LEU 1062CO -0.10 -0.06 -0.35 -0.62 -0.29 0.00 0.00 176.35 174.93 3ho8 n GLU 1063N 3.55 0.58 -3.50 1.98 1.02 0.14 0.10 120.64 124.52 3ho8 n GLU 1063Ca -0.03 0.26 -0.16 0.00 -0.02 0.00 0.00 57.16 57.21 3ho8 n GLU 1063Cb 0.51 -1.49 -0.05 0.00 -0.02 0.00 0.00 31.44 30.40 3ho8 n GLU 1063CO 0.00 0.00 0.00 0.95 1.18 0.00 0.00 177.13 179.26 3ho8 s THR 1064N -2.55 0.00 0.06 2.62 -4.23 -1.26 -3.78 115.64 106.51 3ho8 s THR 1064Ca -0.38 0.00 0.01 0.00 -1.18 0.00 0.00 61.69 60.14 3ho8 s THR 1064Cb 0.14 -1.00 -0.04 0.00 1.34 0.00 0.00 72.50 72.94 3ho8 s THR 1064CO 0.49 0.00 0.18 -0.63 -0.54 0.00 0.00 174.62 174.12 3ho8 s ILE 1065N -1.92 5.21 0.00 2.99 1.01 -1.26 -2.05 121.20 125.18 3ho8 s ILE 1065Ca -0.07 -0.47 0.00 0.00 0.00 0.00 0.00 60.65 60.11 3ho8 s ILE 1065Cb -0.00 -3.54 0.00 0.00 0.01 0.00 0.00 42.46 38.93 3ho8 s ILE 1065CO 0.03 0.14 0.00 -1.54 0.00 0.00 0.00 174.94 173.56 3ho8 n SER 1066N 0.32 0.40 -4.89 3.58 3.41 -0.63 -4.99 113.62 110.82 3ho8 n SER 1066Ca -0.06 0.00 -0.30 0.00 -0.26 0.00 0.00 58.87 58.26 3ho8 n SER 1066Cb 0.51 0.00 0.06 0.00 -0.26 0.00 0.00 64.21 64.52 3ho8 n SER 1066CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 3ho8 s GLU 1067N 2.73 2.65 0.00 4.33 0.41 -1.26 -4.67 118.70 122.89 3ho8 s GLU 1067Ca 0.00 0.34 -0.30 0.00 -0.41 0.00 0.00 54.97 54.60 3ho8 s GLU 1067Cb 0.00 -2.02 -0.04 0.00 -1.78 0.00 0.00 34.13 30.29 3ho8 s GLU 1067CO 0.00 -1.15 1.11 -2.14 -0.49 0.00 0.00 175.26 172.59 3ho8 s PRO 1068N -5.39 4.46 0.00 0.39 0.02 -1.26 -4.00 135.00 129.21 3ho8 s PRO 1068Ca 0.59 1.60 0.00 0.00 0.02 0.00 0.00 61.00 63.21 3ho8 s PRO 1068Cb -0.11 -3.44 0.00 0.00 0.02 0.00 0.00 34.50 30.97 3ho8 s PRO 1068CO 0.51 -0.23 0.00 -0.40 -0.33 0.00 0.00 177.00 176.54 3ho8 n ASP 1069N 4.27 0.00 0.18 2.53 3.85 0.61 -4.91 116.55 123.07 3ho8 n ASP 1069Ca 0.08 -0.76 0.12 0.00 -0.71 0.00 0.00 54.79 53.52 3ho8 n ASP 1069Cb 0.48 0.00 0.66 0.00 -1.35 0.00 0.00 41.12 40.91 3ho8 n ASP 1069CO 0.00 0.00 0.00 -0.08 -1.01 0.00 0.00 177.20 176.11 3ho8 h GLU 1070N 0.00 0.00 0.00 0.11 4.81 -1.96 -3.36 114.58 114.18 3ho8 h GLU 1070Ca 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 3ho8 h GLU 1070Cb 0.00 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.38 3ho8 h GLU 1070CO 0.00 0.00 0.00 0.09 -0.73 0.00 0.00 179.01 178.37 3ho8 n ASN 1071N -4.48 0.00 -0.22 1.04 4.13 -1.26 -5.02 115.26 109.45 3ho8 n ASN 1071Ca 0.01 0.00 -0.00 0.00 1.68 0.00 0.00 54.58 56.27 3ho8 n ASN 1071Cb 0.25 0.00 -0.00 0.00 -1.54 0.00 0.00 39.78 38.48 3ho8 n ASN 1071CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 3ho8 n GLY 1072N 2.59 0.12 3.70 7.41 0.00 -1.26 -5.13 105.19 112.62 3ho8 n GLY 1072Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 3ho8 n GLY 1072CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3ho8 s ASN 1073N -0.05 5.28 0.26 1.61 0.02 -1.26 -2.18 114.94 118.61 3ho8 s ASN 1073Ca 0.00 0.10 0.07 0.00 -1.02 0.00 0.00 52.86 52.01 3ho8 s ASN 1073Cb 0.00 -1.46 -0.04 0.00 0.02 0.00 0.00 41.25 39.78 3ho8 s ASN 1073CO 0.00 0.33 0.20 -0.13 0.02 0.00 0.00 177.10 177.52 3ho8 s ARG 1074N -1.23 2.90 -0.16 -0.60 0.52 -0.43 -0.29 118.95 119.66 3ho8 s ARG 1074Ca 0.17 -1.08 -0.02 0.00 -0.52 0.00 0.00 55.73 54.27 3ho8 s ARG 1074Cb -0.11 -2.55 -0.02 0.00 0.52 0.00 0.00 34.95 32.79 3ho8 s ARG 1074CO 0.07 0.37 -0.08 0.99 0.02 0.00 0.00 175.30 176.67 3ho8 s THR 1075N -2.15 3.40 -0.18 0.02 2.01 -1.26 -2.51 115.64 114.97 3ho8 s THR 1075Ca 0.34 -0.53 -0.08 0.00 0.31 0.00 0.00 61.69 61.73 3ho8 s THR 1075Cb -0.08 -2.47 -0.04 0.00 0.01 0.00 0.00 72.50 69.92 3ho8 s THR 1075CO 0.25 0.50 0.09 -0.63 -0.69 0.00 0.00 174.62 174.13 3ho8 s ILE 1076N 0.56 5.02 -0.43 1.82 1.09 -0.78 -1.60 121.20 126.88 3ho8 s ILE 1076Ca -0.06 0.05 -0.11 0.00 -1.10 0.00 0.00 60.65 59.43 3ho8 s ILE 1076Cb -0.15 -3.26 0.07 0.00 -1.06 0.00 0.00 42.46 38.06 3ho8 s ILE 1076CO 0.03 0.47 0.30 -0.31 -0.10 0.00 0.00 174.94 175.33 3ho8 s TYR 1077N 0.19 3.30 0.30 3.97 1.51 -0.87 -1.99 117.35 123.77 3ho8 s TYR 1077Ca 0.06 -1.29 0.07 0.00 -1.01 0.00 0.00 57.07 54.89 3ho8 s TYR 1077Cb -0.12 -2.97 -0.02 0.00 -0.11 0.00 0.00 41.96 38.74 3ho8 s TYR 1077CO -0.00 -0.81 0.35 0.71 -1.11 0.00 0.00 175.55 174.68 3ho8 s TYR 1078N 1.50 3.13 -0.49 2.71 4.12 0.49 0.23 117.35 129.04 3ho8 s TYR 1078Ca 0.03 -0.18 0.04 0.00 0.02 0.00 0.00 57.07 56.98 3ho8 s TYR 1078Cb -0.23 -1.74 0.16 0.00 -1.52 0.00 0.00 41.96 38.64 3ho8 s TYR 1078CO 0.04 0.24 0.36 0.00 0.02 0.00 0.00 175.55 176.21 3ho8 s ALA 1079N -2.16 2.07 -0.49 3.71 0.00 0.99 -2.80 121.76 123.09 3ho8 s ALA 1079Ca 0.39 -2.79 -0.20 0.00 0.00 0.00 0.00 51.96 49.36 3ho8 s ALA 1079Cb -0.08 -1.77 0.05 0.00 0.00 0.00 0.00 23.12 21.31 3ho8 s ALA 1079CO 0.28 -2.02 0.65 1.41 0.00 0.00 0.00 175.76 176.09 3ho8 s MET 1080N -0.25 3.18 -1.35 0.00 1.75 -0.24 -2.25 119.30 120.15 3ho8 s MET 1080Ca 0.29 -0.68 -0.01 0.00 -1.25 0.00 0.00 55.69 54.04 3ho8 s MET 1080Cb -0.02 -4.05 -0.00 0.00 2.84 0.00 0.00 34.83 33.60 3ho8 s MET 1080CO -0.16 -1.17 0.56 0.09 -0.65 0.00 0.00 175.02 173.69 3ho8 n ASN 1081N 6.31 -0.87 -0.17 1.11 5.03 -0.50 -2.34 115.26 123.82 3ho8 n ASN 1081Ca -0.04 -0.92 -0.02 0.00 0.87 0.00 0.00 54.58 54.47 3ho8 n ASN 1081Cb 0.46 -3.55 -0.01 0.00 -1.02 0.00 0.00 39.78 35.67 3ho8 n ASN 1081CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 3ho8 n GLY 1082N -1.78 0.49 3.20 7.41 0.00 -1.26 -5.01 105.19 108.24 3ho8 n GLY 1082Ca -0.30 -0.16 -0.24 0.00 0.00 0.00 0.00 46.02 45.32 3ho8 n GLY 1082CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3ho8 s GLN 1083N -1.32 1.26 -0.54 1.61 -0.21 -0.99 -5.08 119.66 114.39 3ho8 s GLN 1083Ca 0.00 -0.81 -0.24 0.00 0.02 0.00 0.00 55.36 54.32 3ho8 s GLN 1083Cb 0.00 -1.31 0.04 0.00 1.00 0.00 0.00 33.01 32.74 3ho8 s GLN 1083CO 0.00 0.34 0.93 0.00 -2.12 0.00 0.00 175.29 174.44 3ho8 s ALA 1084N -0.72 3.18 0.21 6.09 0.00 -1.26 -1.07 121.76 128.18 3ho8 s ALA 1084Ca 0.06 -1.20 0.05 0.00 0.00 0.00 0.00 51.96 50.87 3ho8 s ALA 1084Cb -0.08 -3.71 -0.03 0.00 0.00 0.00 0.00 23.12 19.29 3ho8 s ALA 1084CO 0.01 -2.33 0.27 1.03 0.00 0.00 0.00 175.76 174.74 3ho8 s ARG 1085N 3.89 3.23 -0.02 0.00 3.00 -1.12 -4.91 118.95 123.02 3ho8 s ARG 1085Ca 0.31 -0.81 0.02 0.00 0.00 0.00 0.00 55.73 55.25 3ho8 s ARG 1085Cb -0.12 -2.79 0.01 0.00 0.00 0.00 0.00 34.95 32.04 3ho8 s ARG 1085CO 0.20 0.45 -0.06 1.03 0.00 0.00 0.00 175.30 176.92 3ho8 s ARG 1086N -3.63 0.74 0.11 3.54 0.52 -1.26 -0.38 118.95 118.60 3ho8 s ARG 1086Ca 0.33 -0.20 0.08 0.00 -0.52 0.00 0.00 55.73 55.42 3ho8 s ARG 1086Cb -0.09 -0.72 -0.04 0.00 0.52 0.00 0.00 34.95 34.62 3ho8 s ARG 1086CO 0.27 0.05 -0.12 0.42 0.02 0.00 0.00 175.30 175.95 3ho8 s ILE 1087N 0.33 3.25 -0.32 1.52 -1.09 -0.84 -4.92 121.20 119.13 3ho8 s ILE 1087Ca -0.04 -1.35 -0.12 0.00 -2.23 0.00 0.00 60.65 56.90 3ho8 s ILE 1087Cb -0.09 -2.52 -0.03 0.00 -1.58 0.00 0.00 42.46 38.25 3ho8 s ILE 1087CO 0.00 0.09 0.22 -0.31 -1.23 0.00 0.00 174.94 173.70 3ho8 s TYR 1088N -1.25 3.22 -0.03 3.97 1.51 -1.26 -1.87 117.35 121.64 3ho8 s TYR 1088Ca 0.21 -0.16 0.03 0.00 -1.01 0.00 0.00 57.07 56.14 3ho8 s TYR 1088Cb -0.11 -2.44 -0.00 0.00 -0.11 0.00 0.00 41.96 39.31 3ho8 s TYR 1088CO 0.13 -0.32 -0.13 0.42 -1.11 0.00 0.00 175.55 174.54 3ho8 s ILE 1089N 1.72 1.12 0.14 2.71 1.01 -1.05 -4.98 121.20 121.88 3ho8 s ILE 1089Ca 0.06 -0.55 -0.30 0.00 0.00 0.00 0.00 60.65 59.86 3ho8 s ILE 1089Cb -0.17 -0.97 -0.07 0.00 0.01 0.00 0.00 42.46 41.26 3ho8 s ILE 1089CO 0.10 0.33 1.10 -0.75 0.00 0.00 0.00 174.94 175.73 3ho8 s LYS 1090N 0.10 4.56 -0.14 2.79 2.47 -1.26 -1.32 119.74 126.95 3ho8 s LYS 1090Ca -0.03 1.69 -0.06 0.00 -1.56 0.00 0.00 55.97 56.02 3ho8 s LYS 1090Cb -0.10 -3.31 -0.04 0.00 -1.46 0.00 0.00 37.83 32.92 3ho8 s LYS 1090CO 0.01 0.01 0.07 0.34 0.16 0.00 0.00 175.35 175.94 3ho8 s ASP 1091N 0.20 5.78 -0.91 1.43 2.15 -0.93 -4.88 116.67 119.51 3ho8 s ASP 1091Ca 0.51 0.22 -0.02 0.00 0.43 0.00 0.00 52.55 53.70 3ho8 s ASP 1091Cb -0.29 -1.86 0.24 0.00 -0.30 0.00 0.00 42.92 40.71 3ho8 s ASP 1091CO 0.33 0.30 0.87 -0.62 -0.17 0.00 0.00 175.17 175.88 3ho8 n GLU 1092N 2.67 2.86 0.00 4.34 4.71 -1.26 -4.99 120.64 128.96 3ho8 n GLU 1092Ca -0.18 -4.50 0.16 0.00 -0.01 0.00 0.00 57.16 52.62 3ho8 n GLU 1092Cb 0.53 -2.42 0.90 0.00 -1.01 0.00 0.00 31.44 29.45 3ho8 n GLU 1092CO 0.00 0.00 0.00 0.27 0.09 0.00 0.00 177.13 177.49