#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hb9 s ILE 37 N 0.00 5.17 -0.15 -0.39 1.01 -1.26 -4.99 121.20 120.59 3hb9 s ILE 37 Ca 0.00 0.76 -0.18 0.00 0.00 0.00 0.00 60.65 61.23 3hb9 s ILE 37 Cb 0.00 -3.76 -0.15 0.00 0.01 0.00 0.00 42.46 38.56 3hb9 s ILE 37 CO 0.00 0.23 0.31 0.11 0.00 0.00 0.00 174.94 175.59 3hb9 h LYS 38 N 7.43 0.00 -4.20 2.79 1.57 -1.95 -3.46 116.57 118.75 3hb9 h LYS 38 Ca -0.35 0.00 -0.16 0.00 -1.87 0.00 0.00 60.65 58.26 3hb9 h LYS 38 Cb 1.16 0.00 -0.18 0.00 0.08 0.00 0.00 32.23 33.29 3hb9 h LYS 38 CO 0.72 0.65 -0.70 -1.59 -0.57 0.00 0.00 179.45 177.96 3hb9 s LYS 39 N -2.13 0.50 -0.00 3.15 -2.85 -1.26 -2.29 119.74 114.86 3hb9 s LYS 39 Ca -0.17 -0.93 0.05 0.00 -1.00 0.00 0.00 55.97 53.91 3hb9 s LYS 39 Cb 0.01 0.08 -0.01 0.00 -2.06 0.00 0.00 37.83 35.85 3hb9 s LYS 39 CO 0.45 -0.06 -0.15 -1.17 0.10 0.00 0.00 175.35 174.52 3hb9 s LEU 40 N -2.20 2.05 -0.03 2.77 0.20 0.38 -3.11 118.68 118.74 3hb9 s LEU 40 Ca -0.04 -0.30 0.04 0.00 0.69 0.00 0.00 54.13 54.53 3hb9 s LEU 40 Cb -0.01 -0.76 -0.03 0.00 -0.43 0.00 0.00 46.19 44.96 3hb9 s LEU 40 CO -0.05 0.17 -0.14 -0.22 -0.29 0.00 0.00 176.35 175.82 3hb9 s LEU 41 N -0.46 2.77 -0.30 -0.68 0.20 0.52 0.43 118.68 121.16 3hb9 s LEU 41 Ca 0.05 -0.23 -0.08 0.00 0.69 0.00 0.00 54.13 54.57 3hb9 s LEU 41 Cb -0.06 -1.58 -0.00 0.00 -0.43 0.00 0.00 46.19 44.12 3hb9 s LEU 41 CO -0.00 0.32 0.11 -0.69 -0.29 0.00 0.00 176.35 175.80 3hb9 s VAL 42 N -0.80 4.24 -0.90 1.68 1.01 -0.65 -0.19 120.40 124.80 3hb9 s VAL 42 Ca 0.13 -0.54 0.00 0.00 0.00 0.00 0.00 61.98 61.57 3hb9 s VAL 42 Cb -0.11 -3.16 0.00 0.00 0.00 0.00 0.00 36.38 33.11 3hb9 s VAL 42 CO 0.02 0.10 0.55 0.00 0.00 0.00 0.00 175.10 175.77 3hb9 n ALA 43 N 4.92 2.49 -3.61 5.51 0.00 -0.37 -4.10 120.51 125.35 3hb9 n ALA 43 Ca -0.14 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.30 3hb9 n ALA 43 Cb 0.49 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.94 3hb9 n ALA 43 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 3hb9 n ASN 44 N 0.05 1.30 -4.02 0.00 5.15 -1.26 -4.85 115.26 111.64 3hb9 n ASN 44 Ca 0.00 -0.94 -0.12 0.00 -0.60 0.00 0.00 54.58 52.92 3hb9 n ASN 44 Cb 0.27 0.00 -0.08 0.00 -0.53 0.00 0.00 39.78 39.45 3hb9 n ASN 44 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3hb9 s ARG 45 N -1.82 1.40 3.73 1.20 1.70 -1.26 -4.66 118.95 119.23 3hb9 s ARG 45 Ca 0.00 -1.53 0.00 0.00 -0.47 0.00 0.00 55.73 53.73 3hb9 s ARG 45 Cb 0.00 0.35 0.00 0.00 -0.57 0.00 0.00 34.95 34.73 3hb9 s ARG 45 CO 0.00 -0.52 0.00 0.41 -1.08 0.00 0.00 175.30 174.11 3hb9 n GLY 46 N -0.35 0.44 0.33 3.88 0.00 -1.26 -3.92 105.19 104.32 3hb9 n GLY 46 Ca 0.01 -0.87 0.04 0.00 0.00 0.00 0.00 46.02 45.20 3hb9 n GLY 46 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 3hb9 h GLU 47 N 0.00 0.72 -0.36 1.61 -0.00 -1.73 -2.68 114.58 112.14 3hb9 h GLU 47 Ca 0.00 -0.04 -0.17 0.00 -0.00 0.00 0.00 59.36 59.15 3hb9 h GLU 47 Cb 0.00 -0.16 -0.00 0.00 -0.00 0.00 0.00 28.75 28.58 3hb9 h GLU 47 CO 0.00 0.48 -0.44 0.97 -0.00 0.00 0.00 179.01 180.02 3hb9 h ILE 48 N 0.74 1.27 -0.00 -1.06 6.09 -1.87 -2.29 117.51 120.39 3hb9 h ILE 48 Ca 0.23 -1.61 0.00 0.00 -1.37 0.00 0.00 64.86 62.11 3hb9 h ILE 48 Cb 0.00 1.46 -0.00 0.00 0.47 0.00 0.00 36.82 38.75 3hb9 h ILE 48 CO -0.06 0.54 -0.01 0.00 -3.07 0.00 0.00 178.15 175.55 3hb9 h ALA 49 N 0.74 -0.01 -0.93 0.18 0.00 -1.60 -1.25 119.26 116.40 3hb9 h ALA 49 Ca 0.05 0.00 0.05 0.00 0.00 0.00 0.00 54.91 55.01 3hb9 h ALA 49 Cb 1.04 0.02 -0.06 0.00 0.00 0.00 0.00 17.79 18.80 3hb9 h ALA 49 CO 0.10 -0.51 0.61 0.82 0.00 0.00 0.00 179.25 180.27 3hb9 h ILE 50 N -0.02 1.12 -0.81 0.00 2.04 -1.50 -0.02 117.51 118.31 3hb9 h ILE 50 Ca 0.01 -0.38 -0.02 0.00 1.00 0.00 0.00 64.86 65.46 3hb9 h ILE 50 Cb 0.03 -0.10 -0.04 0.00 -0.74 0.00 0.00 36.82 35.97 3hb9 h ILE 50 CO -0.02 0.20 0.43 -0.09 0.00 0.00 0.00 178.15 178.67 3hb9 h ARG 51 N 1.12 1.15 -0.21 2.37 9.65 -1.02 -2.35 114.38 125.08 3hb9 h ARG 51 Ca 0.38 -0.15 -0.07 0.00 -1.10 0.00 0.00 59.98 59.05 3hb9 h ARG 51 Cb 0.09 -0.22 -0.01 0.00 -1.39 0.00 0.00 29.97 28.45 3hb9 h ARG 51 CO -0.13 0.86 -0.12 0.82 2.80 0.00 0.00 179.97 184.20 3hb9 h ILE 52 N 1.14 1.31 -0.94 1.20 1.08 0.00 -2.52 117.51 118.79 3hb9 h ILE 52 Ca 0.28 -1.21 0.05 0.00 -0.39 0.00 0.00 64.86 63.59 3hb9 h ILE 52 Cb 0.06 1.65 -0.06 0.00 -3.07 0.00 0.00 36.82 35.40 3hb9 h ILE 52 CO -0.04 0.37 0.60 -0.26 -0.69 0.00 0.00 178.15 178.13 3hb9 h PHE 53 N 0.16 1.12 -0.59 1.37 0.05 -0.99 0.39 116.94 118.46 3hb9 h PHE 53 Ca 0.05 0.03 -0.09 0.00 3.82 0.00 0.00 57.97 61.78 3hb9 h PHE 53 Cb 0.63 -0.37 -0.02 0.00 2.00 0.00 0.00 35.95 38.19 3hb9 h PHE 53 CO 0.07 0.61 0.03 0.00 -0.18 0.00 0.00 178.31 178.83 3hb9 h ARG 54 N 1.13 1.00 -0.21 1.51 3.08 -1.42 -0.63 114.38 118.85 3hb9 h ARG 54 Ca 0.39 -0.29 -0.06 0.00 0.07 0.00 0.00 59.98 60.09 3hb9 h ARG 54 Cb 0.09 -0.10 -0.01 0.00 0.08 0.00 0.00 29.97 30.03 3hb9 h ARG 54 CO -0.15 0.96 -0.10 0.00 -1.07 0.00 0.00 179.97 179.62 3hb9 h ALA 55 N 1.10 0.30 -0.44 0.04 0.00 -0.92 -2.63 119.26 116.70 3hb9 h ALA 55 Ca 0.17 -0.29 -0.13 0.00 0.00 0.00 0.00 54.91 54.66 3hb9 h ALA 55 Cb 0.50 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.21 3hb9 h ALA 55 CO 0.02 0.13 -0.26 0.00 0.00 0.00 0.00 179.25 179.15 3hb9 h ALA 56 N 0.71 0.71 0.00 0.00 0.00 -0.89 -2.60 119.26 117.20 3hb9 h ALA 56 Ca 0.05 -0.40 -0.05 0.00 0.00 0.00 0.00 54.91 54.50 3hb9 h ALA 56 Cb 0.59 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.21 3hb9 h ALA 56 CO 0.03 0.67 -0.25 0.00 0.00 0.00 0.00 179.25 179.70 3hb9 h ALA 57 N 0.90 1.27 -0.06 0.00 0.00 -1.16 0.98 119.26 121.19 3hb9 h ALA 57 Ca 0.10 -0.22 -0.12 0.00 0.00 0.00 0.00 54.91 54.66 3hb9 h ALA 57 Cb 0.82 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.56 3hb9 h ALA 57 CO 0.07 0.31 -0.51 0.93 0.00 0.00 0.00 179.25 180.04 3hb9 h GLU 58 N 0.00 0.17 -0.37 0.00 5.08 -1.18 -2.65 114.58 115.62 3hb9 h GLU 58 Ca -0.00 -0.10 0.00 0.00 -1.00 0.00 0.00 59.36 58.26 3hb9 h GLU 58 Cb 0.55 0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.81 3hb9 h GLU 58 CO 0.03 0.64 0.00 1.28 -1.00 0.00 0.00 179.01 179.96 3hb9 n LEU 59 N -3.94 1.48 -3.79 1.33 4.77 -0.73 -4.90 117.00 111.23 3hb9 n LEU 59 Ca -0.02 -0.74 -0.26 0.00 -0.03 0.00 0.00 56.01 54.96 3hb9 n LEU 59 Cb 0.55 -0.24 0.04 0.00 -2.33 0.00 0.00 43.42 41.43 3hb9 n LEU 59 CO 0.42 0.31 0.09 -0.67 -1.33 0.00 0.00 177.39 176.22 3hb9 n ASP 60 N 0.16 -4.12 -4.29 -1.43 2.03 -1.00 -5.00 116.55 102.90 3hb9 n ASP 60 Ca 0.08 -0.74 -0.33 0.00 0.52 0.00 0.00 54.79 54.32 3hb9 n ASP 60 Cb 0.27 -4.19 -0.15 0.00 -0.72 0.00 0.00 41.12 36.32 3hb9 n ASP 60 CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 3hb9 s ILE 61 N -3.39 2.71 0.56 5.18 1.01 0.26 -5.00 121.20 122.53 3hb9 s ILE 61 Ca 0.47 -0.77 -0.21 0.00 0.00 0.00 0.00 60.65 60.14 3hb9 s ILE 61 Cb -0.23 -2.13 -0.04 0.00 0.01 0.00 0.00 42.46 40.07 3hb9 s ILE 61 CO 0.80 0.52 1.34 -0.24 0.00 0.00 0.00 174.94 177.36 3hb9 n SER 62 N 3.82 2.55 -4.38 3.58 2.88 -0.97 -3.59 113.62 117.51 3hb9 n SER 62 Ca -0.19 0.95 -0.31 0.00 -1.33 0.00 0.00 58.87 58.00 3hb9 n SER 62 Cb 0.52 -1.57 -0.14 0.00 -0.75 0.00 0.00 64.21 62.27 3hb9 n SER 62 CO 0.00 0.00 0.00 0.42 -1.23 0.00 0.00 175.04 174.23 3hb9 s THR 63 N -1.30 2.38 -0.04 2.46 -4.23 -1.26 -0.47 115.64 113.18 3hb9 s THR 63 Ca 0.73 -1.16 0.02 0.00 -1.18 0.00 0.00 61.69 60.11 3hb9 s THR 63 Cb -0.41 -1.91 0.01 0.00 1.34 0.00 0.00 72.50 71.52 3hb9 s THR 63 CO 0.48 0.46 -0.10 -0.69 -0.54 0.00 0.00 174.62 174.24 3hb9 s VAL 64 N -0.76 0.86 0.06 2.29 1.01 0.17 -1.69 120.40 122.34 3hb9 s VAL 64 Ca 0.12 -0.38 0.08 0.00 0.00 0.00 0.00 61.98 61.79 3hb9 s VAL 64 Cb -0.10 -0.78 -0.03 0.00 0.00 0.00 0.00 36.38 35.47 3hb9 s VAL 64 CO 0.01 0.27 -0.21 0.00 0.00 0.00 0.00 175.10 175.18 3hb9 s ALA 65 N 0.34 1.78 0.15 5.51 0.00 0.12 -1.63 121.76 128.03 3hb9 s ALA 65 Ca -0.06 -1.11 0.10 0.00 0.00 0.00 0.00 51.96 50.89 3hb9 s ALA 65 Cb -0.11 -0.32 -0.04 0.00 0.00 0.00 0.00 23.12 22.65 3hb9 s ALA 65 CO 0.01 0.39 -0.21 0.96 0.00 0.00 0.00 175.76 176.91 3hb9 s ILE 66 N -0.89 2.56 0.17 0.00 -0.00 -1.26 -1.66 121.20 120.13 3hb9 s ILE 66 Ca 0.07 -1.77 -0.05 0.00 -0.00 0.00 0.00 60.65 58.90 3hb9 s ILE 66 Cb -0.09 -2.20 -0.03 0.00 -0.00 0.00 0.00 42.46 40.15 3hb9 s ILE 66 CO 0.02 -0.00 0.20 -0.72 -0.00 0.00 0.00 174.94 174.44 3hb9 s TYR 67 N -1.37 0.73 0.24 1.37 1.13 -1.12 -4.85 117.35 113.47 3hb9 s TYR 67 Ca 0.19 -1.06 0.01 0.00 -1.41 0.00 0.00 57.07 54.80 3hb9 s TYR 67 Cb -0.09 -0.28 0.01 0.00 -1.10 0.00 0.00 41.96 40.50 3hb9 s TYR 67 CO 0.10 -0.67 0.11 -1.13 -2.51 0.00 0.00 175.55 171.45 3hb9 n SER 68 N -0.21 2.10 -0.35 -0.18 3.41 -1.26 -1.99 113.62 115.13 3hb9 n SER 68 Ca -0.04 -1.89 -0.02 0.00 -0.26 0.00 0.00 58.87 56.66 3hb9 n SER 68 Cb 0.64 0.05 0.12 0.00 -0.26 0.00 0.00 64.21 64.75 3hb9 n SER 68 CO 0.00 0.00 0.00 0.78 -0.16 0.00 0.00 175.04 175.66 3hb9 h ASN 69 N 0.39 1.12 0.88 4.04 -0.26 -1.86 -2.92 115.58 116.97 3hb9 h ASN 69 Ca -0.17 -0.05 0.00 0.00 -0.56 0.00 0.00 56.30 55.52 3hb9 h ASN 69 Cb 0.56 -0.28 0.00 0.00 -1.06 0.00 0.00 38.32 37.54 3hb9 h ASN 69 CO 0.27 0.84 -0.92 -0.62 -1.06 0.00 0.00 177.43 175.94 3hb9 n GLU 70 N -4.37 0.48 -1.15 0.81 1.02 -1.26 -3.83 120.64 112.35 3hb9 n GLU 70 Ca 0.11 0.09 -0.26 0.00 -0.02 0.00 0.00 57.16 57.09 3hb9 n GLU 70 Cb 0.04 -1.76 0.12 0.00 -0.02 0.00 0.00 31.44 29.82 3hb9 n GLU 70 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 3hb9 n ASP 71 N -2.43 5.36 0.30 1.62 8.00 -1.11 -4.49 116.55 123.79 3hb9 n ASP 71 Ca 0.01 -3.51 0.18 0.00 0.71 0.00 0.00 54.79 52.18 3hb9 n ASP 71 Cb 0.51 -0.89 0.95 0.00 -0.02 0.00 0.00 41.12 41.67 3hb9 n ASP 71 CO 0.00 0.00 0.00 0.11 -0.39 0.00 0.00 177.20 176.92 3hb9 h LYS 72 N 1.33 0.00 -0.29 -1.24 1.79 -1.63 -3.11 116.57 113.43 3hb9 h LYS 72 Ca 0.55 0.00 -0.24 0.00 -2.18 0.00 0.00 60.65 58.78 3hb9 h LYS 72 Cb 1.83 0.00 -0.34 0.00 -1.58 0.00 0.00 32.23 32.14 3hb9 h LYS 72 CO 1.17 0.03 -0.96 -1.13 -1.08 0.00 0.00 179.45 177.49 3hb9 n SER 73 N -3.38 1.97 -4.79 0.86 3.41 -1.26 -5.06 113.62 105.36 3hb9 n SER 73 Ca -0.02 -2.57 -0.35 0.00 -0.26 0.00 0.00 58.87 55.67 3hb9 n SER 73 Cb 0.15 -0.41 -0.06 0.00 -0.26 0.00 0.00 64.21 63.64 3hb9 n SER 73 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 3hb9 s SER 74 N -3.12 6.95 0.36 4.04 0.15 -1.17 -4.97 113.70 115.92 3hb9 s SER 74 Ca 0.35 1.86 0.03 0.00 0.70 0.00 0.00 55.95 58.88 3hb9 s SER 74 Cb 0.36 -2.57 0.65 0.00 -1.71 0.00 0.00 66.02 62.76 3hb9 s SER 74 CO -0.07 -0.35 2.01 0.25 1.20 0.00 0.00 173.24 176.28 3hb9 h LEU 75 N 2.42 0.70 -2.11 3.45 6.46 -1.93 -2.57 115.31 121.73 3hb9 h LEU 75 Ca -0.48 -0.02 0.00 0.00 -0.12 0.00 0.00 57.88 57.26 3hb9 h LEU 75 Cb 1.20 -0.18 0.00 0.00 -0.73 0.00 0.00 40.66 40.95 3hb9 h LEU 75 CO 0.62 0.51 0.00 1.12 -0.62 0.00 0.00 178.44 180.08 3hb9 h HIS 76 N 0.82 0.00 -0.35 1.25 2.07 -1.94 -2.31 115.15 114.70 3hb9 h HIS 76 Ca 0.22 0.00 -0.03 0.00 -2.85 0.00 0.00 60.37 57.71 3hb9 h HIS 76 Cb -0.08 0.00 -0.02 0.00 2.57 0.00 0.00 27.41 29.88 3hb9 h HIS 76 CO 0.00 0.00 0.10 -0.09 -3.07 0.00 0.00 177.93 174.87 3hb9 h ARG 77 N 0.00 0.50 0.00 5.12 2.43 -1.81 -3.27 114.38 117.35 3hb9 h ARG 77 Ca 0.00 -0.07 -0.18 0.00 -0.81 0.00 0.00 59.98 58.91 3hb9 h ARG 77 Cb 0.29 -0.09 -0.03 0.00 -0.42 0.00 0.00 29.97 29.72 3hb9 h ARG 77 CO 0.00 0.46 -1.92 0.66 -1.51 0.00 0.00 179.97 177.65 3hb9 n TYR 78 N -4.36 0.34 1.05 2.20 4.02 -0.87 -4.33 117.16 115.22 3hb9 n TYR 78 Ca 0.02 0.11 0.11 0.00 -0.01 0.00 0.00 57.90 58.14 3hb9 n TYR 78 Cb 0.17 -0.88 0.57 0.00 -0.02 0.00 0.00 39.34 39.19 3hb9 n TYR 78 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 176.86 177.48 3hb9 n LYS 79 N -2.64 0.28 -3.77 -0.72 4.76 -1.20 -4.78 118.16 110.08 3hb9 n LYS 79 Ca -0.16 0.07 -0.20 0.00 -2.87 0.00 0.00 58.31 55.15 3hb9 n LYS 79 Cb 0.86 -1.50 -0.02 0.00 -1.84 0.00 0.00 35.03 32.53 3hb9 n LYS 79 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 3hb9 s ALA 80 N -2.64 3.96 0.09 7.82 0.00 -1.26 -4.91 121.76 124.83 3hb9 s ALA 80 Ca 0.20 -1.46 -0.16 0.00 0.00 0.00 0.00 51.96 50.55 3hb9 s ALA 80 Cb 0.16 -1.49 -0.08 0.00 0.00 0.00 0.00 23.12 21.71 3hb9 s ALA 80 CO 0.37 0.08 1.44 -0.44 0.00 0.00 0.00 175.76 177.21 3hb9 h ASP 81 N 1.14 0.67 -3.75 0.00 3.45 -1.80 -3.45 116.42 112.68 3hb9 h ASP 81 Ca -0.47 -0.43 -0.56 0.00 0.43 0.00 0.00 57.03 55.99 3hb9 h ASP 81 Cb 1.25 -0.19 -0.32 0.00 -0.56 0.00 0.00 39.33 39.51 3hb9 h ASP 81 CO 0.57 0.96 -0.84 -1.61 -1.57 0.00 0.00 179.24 176.76 3hb9 s GLU 82 N -4.51 1.87 -0.09 3.56 2.02 -0.68 -5.04 118.70 115.84 3hb9 s GLU 82 Ca -0.13 -0.59 0.00 0.00 0.02 0.00 0.00 54.97 54.27 3hb9 s GLU 82 Cb 0.08 -1.58 0.02 0.00 0.10 0.00 0.00 34.13 32.75 3hb9 s GLU 82 CO 0.81 0.19 -0.08 -1.54 0.02 0.00 0.00 175.26 174.66 3hb9 s SER 83 N 0.19 1.91 0.03 -0.19 1.04 -1.26 0.13 113.70 115.55 3hb9 s SER 83 Ca -0.07 -0.27 0.06 0.00 0.48 0.00 0.00 55.95 56.15 3hb9 s SER 83 Cb -0.13 -0.78 -0.02 0.00 0.10 0.00 0.00 66.02 65.19 3hb9 s SER 83 CO 0.03 -0.07 -0.18 -0.31 0.98 0.00 0.00 173.24 173.69 3hb9 s TYR 84 N 1.34 1.60 0.06 5.02 1.51 -0.66 -5.00 117.35 121.22 3hb9 s TYR 84 Ca -0.02 -0.35 -0.30 0.00 -1.01 0.00 0.00 57.07 55.39 3hb9 s TYR 84 Cb -0.14 -0.97 -0.05 0.00 -0.11 0.00 0.00 41.96 40.69 3hb9 s TYR 84 CO -0.04 0.04 1.01 -1.17 -1.11 0.00 0.00 175.55 174.29 3hb9 s LEU 85 N -0.95 4.42 -0.13 -1.29 2.96 -1.26 -2.78 118.68 119.65 3hb9 s LEU 85 Ca 0.06 1.78 -0.03 0.00 -0.22 0.00 0.00 54.13 55.72 3hb9 s LEU 85 Cb -0.08 -3.58 -0.03 0.00 0.50 0.00 0.00 46.19 43.00 3hb9 s LEU 85 CO 0.01 -0.22 -0.04 -0.69 -1.32 0.00 0.00 176.35 174.09 3hb9 s VAL 86 N 0.59 3.93 -0.61 1.68 1.01 -0.84 -4.79 120.40 121.37 3hb9 s VAL 86 Ca 0.51 -0.36 -0.09 0.00 0.00 0.00 0.00 61.98 62.04 3hb9 s VAL 86 Cb -0.23 -2.69 0.01 0.00 0.00 0.00 0.00 36.38 33.47 3hb9 s VAL 86 CO 0.29 0.53 0.65 0.61 0.00 0.00 0.00 175.10 177.18 3hb9 n GLY 87 N 3.13 -1.17 0.29 4.51 0.00 -1.26 -4.67 105.19 106.02 3hb9 n GLY 87 Ca -0.18 0.84 0.16 0.00 0.00 0.00 0.00 46.02 46.85 3hb9 n GLY 87 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 3hb9 h SER 88 N 1.11 0.00 0.02 1.61 0.02 -1.97 -3.11 113.55 111.24 3hb9 h SER 88 Ca -0.10 0.00 -0.38 0.00 -0.84 0.00 0.00 61.79 60.47 3hb9 h SER 88 Cb 1.07 0.00 -0.07 0.00 0.14 0.00 0.00 62.40 63.54 3hb9 h SER 88 CO 0.26 0.06 -2.40 -0.90 -1.14 0.00 0.00 176.83 172.71 3hb9 n ASP 89 N -3.40 1.19 -4.79 3.07 5.68 -1.26 -4.99 116.55 112.04 3hb9 n ASP 89 Ca -0.02 -0.05 -0.33 0.00 -0.50 0.00 0.00 54.79 53.89 3hb9 n ASP 89 Cb 0.20 0.12 0.03 0.00 -1.14 0.00 0.00 41.12 40.33 3hb9 n ASP 89 CO 0.00 0.00 0.00 -0.22 -1.33 0.00 0.00 177.20 175.65 3hb9 s LEU 90 N -6.13 3.43 0.87 -2.12 2.96 -1.18 -5.02 118.68 111.49 3hb9 s LEU 90 Ca -0.24 1.87 -0.10 0.00 -0.22 0.00 0.00 54.13 55.44 3hb9 s LEU 90 Cb 0.08 -4.54 0.12 0.00 0.50 0.00 0.00 46.19 42.35 3hb9 s LEU 90 CO 0.70 -1.37 1.12 -0.83 -1.32 0.00 0.00 176.35 174.66 3hb9 s GLY 91 N -2.78 1.68 0.29 7.98 0.00 -1.26 -4.80 107.32 108.42 3hb9 s GLY 91 Ca 0.64 0.46 0.25 0.00 0.00 0.00 0.00 44.72 46.07 3hb9 s GLY 91 CO 0.40 0.86 1.75 -0.56 0.00 0.00 0.00 173.10 175.54 3hb9 h PRO 92 N -1.63 0.00 0.09 2.90 0.13 -1.95 -1.25 132.00 130.28 3hb9 h PRO 92 Ca -0.44 0.00 -0.35 0.00 -0.87 0.00 0.00 66.00 64.34 3hb9 h PRO 92 Cb 1.26 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.36 3hb9 h PRO 92 CO 0.45 0.00 -1.95 0.00 -0.23 0.00 0.00 178.00 176.28 3hb9 n ALA 93 N -1.81 0.93 0.18 -0.56 0.00 -1.26 -4.32 120.51 113.66 3hb9 n ALA 93 Ca 0.02 -0.64 0.05 0.00 0.00 0.00 0.00 53.44 52.88 3hb9 n ALA 93 Cb 0.26 -0.58 0.24 0.00 0.00 0.00 0.00 19.45 19.37 3hb9 n ALA 93 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 3hb9 h GLU 94 N -0.14 0.00 -0.98 0.00 3.07 -1.92 -3.36 114.58 111.25 3hb9 h GLU 94 Ca -0.44 0.00 0.13 0.00 -0.50 0.00 0.00 59.36 58.55 3hb9 h GLU 94 Cb 1.89 0.00 -0.08 0.00 -0.84 0.00 0.00 28.75 29.72 3hb9 h GLU 94 CO 0.01 0.40 0.62 1.03 -1.40 0.00 0.00 179.01 179.66 3hb9 h SER 95 N 0.00 0.87 1.44 1.42 0.87 -1.42 -0.04 113.55 116.69 3hb9 h SER 95 Ca -0.00 0.05 0.00 0.00 -1.23 0.00 0.00 61.79 60.61 3hb9 h SER 95 Cb 1.06 -0.12 0.00 0.00 -0.44 0.00 0.00 62.40 62.90 3hb9 h SER 95 CO 0.05 0.45 0.00 1.88 -0.53 0.00 0.00 176.83 178.68 3hb9 h TYR 96 N 0.92 0.00 -1.11 2.24 -1.99 -1.82 -3.27 116.97 111.94 3hb9 h TYR 96 Ca 0.50 0.00 -0.64 0.00 2.00 0.00 0.00 58.73 60.59 3hb9 h TYR 96 Cb 0.56 0.00 -0.35 0.00 2.00 0.00 0.00 36.73 38.95 3hb9 h TYR 96 CO -0.00 0.00 0.16 1.28 -0.00 0.00 0.00 178.16 179.60 3hb9 n LEU 97 N -2.95 6.43 -4.04 3.88 4.77 -0.03 -4.82 117.00 120.24 3hb9 n LEU 97 Ca 0.03 -4.62 -0.33 0.00 -0.03 0.00 0.00 56.01 51.06 3hb9 n LEU 97 Cb 0.40 -0.72 -0.13 0.00 -2.33 0.00 0.00 43.42 40.64 3hb9 n LEU 97 CO 0.30 1.81 -0.21 0.21 -1.33 0.00 0.00 177.39 178.16 3hb9 s ASN 98 N -2.51 4.83 0.18 -1.43 2.47 -1.21 -5.00 114.94 112.28 3hb9 s ASN 98 Ca 0.57 -2.41 -0.13 0.00 0.42 0.00 0.00 52.86 51.31 3hb9 s ASN 98 Cb 0.45 -1.71 0.18 0.00 -1.45 0.00 0.00 41.25 38.72 3hb9 s ASN 98 CO -0.07 -0.38 1.75 0.40 -3.72 0.00 0.00 177.10 175.08 3hb9 h ILE 99 N 6.13 0.82 -0.34 -5.21 5.03 -1.93 -2.82 117.51 119.20 3hb9 h ILE 99 Ca -0.07 -0.12 -0.15 0.00 -0.12 0.00 0.00 64.86 64.40 3hb9 h ILE 99 Cb 0.99 0.44 -0.01 0.00 -3.03 0.00 0.00 36.82 35.21 3hb9 h ILE 99 CO 0.62 0.06 -0.39 -0.33 -0.68 0.00 0.00 178.15 177.43 3hb9 h GLU 100 N 0.35 0.83 -0.01 2.37 4.39 -1.99 -3.15 114.58 117.36 3hb9 h GLU 100 Ca 0.24 -0.43 -0.19 0.00 0.34 0.00 0.00 59.36 59.32 3hb9 h GLU 100 Cb 0.26 0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 28.91 3hb9 h GLU 100 CO -0.25 1.07 -0.81 -0.09 -1.16 0.00 0.00 179.01 177.77 3hb9 h ARG 101 N 0.68 0.21 -0.19 2.33 9.65 -1.94 -2.54 114.38 122.57 3hb9 h ARG 101 Ca 0.05 -0.21 -0.11 0.00 -1.10 0.00 0.00 59.98 58.62 3hb9 h ARG 101 Cb 0.96 0.05 -0.01 0.00 -1.39 0.00 0.00 29.97 29.58 3hb9 h ARG 101 CO 0.09 0.91 -0.34 0.82 2.80 0.00 0.00 179.97 184.25 3hb9 h ILE 102 N 0.13 1.29 -0.44 1.20 2.04 -1.56 -2.60 117.51 117.56 3hb9 h ILE 102 Ca -0.04 -1.42 -0.11 0.00 1.00 0.00 0.00 64.86 64.29 3hb9 h ILE 102 Cb 1.41 1.52 -0.02 0.00 -0.74 0.00 0.00 36.82 39.00 3hb9 h ILE 102 CO 0.12 0.44 -0.18 0.40 0.00 0.00 0.00 178.15 178.93 3hb9 h ILE 103 N 0.34 1.27 -0.44 -0.67 1.08 -1.50 -2.48 117.51 115.12 3hb9 h ILE 103 Ca 0.04 -1.31 0.01 0.00 -0.39 0.00 0.00 64.86 63.21 3hb9 h ILE 103 Cb 0.77 1.12 -0.02 0.00 -3.07 0.00 0.00 36.82 35.62 3hb9 h ILE 103 CO 0.06 0.45 0.29 0.44 -0.69 0.00 0.00 178.15 178.70 3hb9 h ASP 104 N 0.76 0.50 -0.02 1.72 3.32 -1.09 0.22 116.42 121.83 3hb9 h ASP 104 Ca 0.11 -0.01 -0.05 0.00 0.02 0.00 0.00 57.03 57.10 3hb9 h ASP 104 Cb 0.71 -0.12 0.00 0.00 0.22 0.00 0.00 39.33 40.14 3hb9 h ASP 104 CO 0.05 0.36 -0.18 0.58 -1.72 0.00 0.00 179.24 178.34 3hb9 h VAL 105 N 0.59 1.51 -0.98 -1.35 2.07 -1.40 -2.82 116.25 113.87 3hb9 h VAL 105 Ca 0.16 -1.75 0.03 0.00 0.82 0.00 0.00 66.70 65.95 3hb9 h VAL 105 Cb -0.06 2.59 -0.05 0.00 -1.52 0.00 0.00 31.29 32.24 3hb9 h VAL 105 CO -0.04 0.48 0.64 0.00 0.02 0.00 0.00 177.57 178.68 3hb9 h ALA 106 N 0.33 1.28 -0.14 1.67 0.00 -1.09 -2.72 119.26 118.59 3hb9 h ALA 106 Ca -0.02 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.83 3hb9 h ALA 106 Cb 0.88 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 18.30 3hb9 h ALA 106 CO 0.04 0.56 0.03 0.87 0.00 0.00 0.00 179.25 180.75 3hb9 h LYS 107 N 1.27 0.23 -0.63 0.00 1.57 -1.06 -0.96 116.57 116.99 3hb9 h LYS 107 Ca 0.38 -0.06 0.00 0.00 -1.87 0.00 0.00 60.65 59.10 3hb9 h LYS 107 Cb -0.05 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.23 3hb9 h LYS 107 CO -0.11 0.40 0.00 1.04 -0.57 0.00 0.00 179.45 180.21 3hb9 n GLN 108 N -4.82 0.83 0.00 3.15 1.13 -1.04 -3.04 117.38 113.59 3hb9 n GLN 108 Ca -0.05 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.01 3hb9 n GLN 108 Cb 0.17 -1.31 0.00 0.00 0.11 0.00 0.00 30.24 29.20 3hb9 n GLN 108 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 3hb9 n ALA 109 N -0.06 0.64 -2.42 -1.58 0.00 -1.10 -5.02 120.51 110.97 3hb9 n ALA 109 Ca 0.00 -0.31 -0.19 0.00 0.00 0.00 0.00 53.44 52.94 3hb9 n ALA 109 Cb 0.16 0.00 -0.00 0.00 0.00 0.00 0.00 19.45 19.60 3hb9 n ALA 109 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 3hb9 n ASN 110 N 0.00 -5.46 -4.68 0.00 4.13 -1.16 -4.98 115.26 103.11 3hb9 n ASN 110 Ca 0.00 -0.04 -0.42 0.00 1.68 0.00 0.00 54.58 55.79 3hb9 n ASN 110 Cb 0.41 -4.49 -0.03 0.00 -1.54 0.00 0.00 39.78 34.13 3hb9 n ASN 110 CO 0.00 0.00 0.00 -0.69 0.28 0.00 0.00 177.26 176.85 3hb9 s VAL 111 N -2.96 4.63 -1.18 2.41 1.01 -0.38 -4.69 120.40 119.24 3hb9 s VAL 111 Ca 0.03 1.92 0.11 0.00 0.00 0.00 0.00 61.98 64.04 3hb9 s VAL 111 Cb -0.01 -4.23 0.20 0.00 0.00 0.00 0.00 36.38 32.33 3hb9 s VAL 111 CO 0.04 -0.02 1.05 -0.90 0.00 0.00 0.00 175.10 175.27 3hb9 n ASP 112 N 5.22 2.43 -3.67 3.32 5.68 -1.18 -4.71 116.55 123.63 3hb9 n ASP 112 Ca 0.10 -1.73 -0.09 0.00 -0.50 0.00 0.00 54.79 52.57 3hb9 n ASP 112 Cb 0.48 -0.11 -0.09 0.00 -1.14 0.00 0.00 41.12 40.25 3hb9 n ASP 112 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 3hb9 s ALA 113 N -0.97 -1.42 -0.12 2.12 0.00 -1.21 -1.40 121.76 118.75 3hb9 s ALA 113 Ca 0.18 1.93 0.03 0.00 0.00 0.00 0.00 51.96 54.10 3hb9 s ALA 113 Cb 0.11 -1.15 0.01 0.00 0.00 0.00 0.00 23.12 22.09 3hb9 s ALA 113 CO 0.15 -0.32 -0.22 0.42 0.00 0.00 0.00 175.76 175.79 3hb9 s ILE 114 N 1.47 2.03 -0.30 0.00 1.01 -0.49 -0.36 121.20 124.57 3hb9 s ILE 114 Ca -0.09 -0.98 -0.14 0.00 0.00 0.00 0.00 60.65 59.44 3hb9 s ILE 114 Cb -0.07 -1.78 -0.03 0.00 0.01 0.00 0.00 42.46 40.59 3hb9 s ILE 114 CO -0.15 0.55 0.31 -2.28 0.00 0.00 0.00 174.94 173.36 3hb9 s HIS 115 N 0.64 3.23 0.07 3.97 2.46 0.74 -2.05 115.29 124.35 3hb9 s HIS 115 Ca -0.11 0.14 0.19 0.00 0.47 0.00 0.00 55.06 55.75 3hb9 s HIS 115 Cb -0.16 -2.54 0.54 0.00 -0.13 0.00 0.00 32.58 30.28 3hb9 s HIS 115 CO 0.02 -0.28 1.66 -1.00 -2.47 0.00 0.00 174.74 172.67 3hb9 h PRO 116 N 8.34 0.00 0.00 2.88 0.13 -1.86 -0.97 132.00 140.52 3hb9 h PRO 116 Ca -0.32 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.81 3hb9 h PRO 116 Cb 1.16 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.29 3hb9 h PRO 116 CO 0.63 0.39 0.00 0.41 -0.23 0.00 0.00 178.00 179.20 3hb9 n GLY 117 N 0.51 0.66 3.08 1.56 0.00 -1.26 -4.18 105.19 105.55 3hb9 n GLY 117 Ca 0.00 -0.70 -0.11 0.00 0.00 0.00 0.00 46.02 45.21 3hb9 n GLY 117 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3hb9 s TYR 118 N 0.00 0.03 -0.94 1.61 -0.85 -1.26 -4.39 117.35 111.54 3hb9 s TYR 118 Ca 0.00 -0.08 -0.05 0.00 -0.52 0.00 0.00 57.07 56.42 3hb9 s TYR 118 Cb 0.00 -0.04 0.01 0.00 0.38 0.00 0.00 41.96 42.30 3hb9 s TYR 118 CO 0.00 -0.23 0.67 0.41 -1.52 0.00 0.00 175.55 174.88 3hb9 n GLY 119 N 1.77 -0.07 0.00 5.49 0.00 -1.26 -4.89 105.19 106.23 3hb9 n GLY 119 Ca -0.21 -0.09 0.00 0.00 0.00 0.00 0.00 46.02 45.72 3hb9 n GLY 119 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3hb9 n PHE 120 N -4.15 0.00 -0.70 1.61 3.72 -1.26 -4.95 117.46 111.73 3hb9 n PHE 120 Ca -0.02 0.00 0.07 0.00 -0.05 0.00 0.00 57.45 57.45 3hb9 n PHE 120 Cb 0.55 0.00 0.21 0.00 -0.94 0.00 0.00 39.48 39.30 3hb9 n PHE 120 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 176.76 177.99 3hb9 n LEU 121 N -0.30 3.39 0.01 4.37 4.77 -1.26 -4.65 117.00 123.32 3hb9 n LEU 121 Ca 0.00 -2.66 -0.02 0.00 -0.03 0.00 0.00 56.01 53.29 3hb9 n LEU 121 Cb 0.00 -0.41 0.23 0.00 -2.33 0.00 0.00 43.42 40.91 3hb9 n LEU 121 CO 0.00 0.69 0.80 0.77 -1.33 0.00 0.00 177.39 178.32 3hb9 h SER 122 N 1.65 0.50 -0.43 -1.43 4.64 -1.88 -2.76 113.55 113.84 3hb9 h SER 122 Ca 0.00 -0.14 0.00 0.00 -0.47 0.00 0.00 61.79 61.18 3hb9 h SER 122 Cb 1.15 -0.13 0.00 0.00 -0.31 0.00 0.00 62.40 63.11 3hb9 h SER 122 CO 0.13 0.68 0.00 -0.62 -0.87 0.00 0.00 176.83 176.15 3hb9 n GLU 123 N -4.18 2.46 -2.75 4.77 1.02 -1.26 -4.88 120.64 115.81 3hb9 n GLU 123 Ca 0.00 -2.21 -0.42 0.00 -0.02 0.00 0.00 57.16 54.51 3hb9 n GLU 123 Cb 0.35 -1.43 -0.03 0.00 -0.02 0.00 0.00 31.44 30.31 3hb9 n GLU 123 CO 0.00 0.00 0.00 1.21 1.18 0.00 0.00 177.13 179.52 3hb9 s ASN 124 N -1.17 7.07 -0.02 1.62 3.84 -1.04 -4.93 114.94 120.31 3hb9 s ASN 124 Ca 0.35 1.33 -0.24 0.00 0.21 0.00 0.00 52.86 54.51 3hb9 s ASN 124 Cb 0.19 -2.51 -0.20 0.00 -0.55 0.00 0.00 41.25 38.18 3hb9 s ASN 124 CO 0.26 -0.52 1.19 -0.33 -2.79 0.00 0.00 177.10 174.91 3hb9 h GLU 125 N 7.35 0.15 0.00 0.43 3.07 -1.92 -3.28 114.58 120.38 3hb9 h GLU 125 Ca -0.25 -0.11 0.00 0.00 -0.50 0.00 0.00 59.36 58.50 3hb9 h GLU 125 Cb 1.11 0.02 0.00 0.00 -0.84 0.00 0.00 28.75 29.03 3hb9 h GLU 125 CO 0.90 0.72 0.00 0.00 -1.40 0.00 0.00 179.01 179.22 3hb9 n GLN 126 N -4.65 0.07 -0.02 2.33 0.00 -1.26 -2.47 117.38 111.38 3hb9 n GLN 126 Ca -0.08 0.28 -0.16 0.00 0.00 0.00 0.00 57.00 57.04 3hb9 n GLN 126 Cb 0.37 -1.63 -0.10 0.00 0.00 0.00 0.00 30.24 28.88 3hb9 n GLN 126 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.06 177.41 3hb9 h PHE 127 N 0.00 0.53 -0.51 2.61 3.57 -1.91 -2.46 116.94 118.77 3hb9 h PHE 127 Ca 0.00 -0.24 -0.07 0.00 3.53 0.00 0.00 57.97 61.19 3hb9 h PHE 127 Cb 0.33 -0.08 -0.02 0.00 2.79 0.00 0.00 35.95 38.97 3hb9 h PHE 127 CO 0.00 1.01 0.05 0.00 -2.23 0.00 0.00 178.31 177.14 3hb9 h ALA 128 N 0.41 0.69 -0.30 2.41 0.00 -1.59 -0.29 119.26 120.58 3hb9 h ALA 128 Ca -0.03 -0.26 0.02 0.00 0.00 0.00 0.00 54.91 54.64 3hb9 h ALA 128 Cb 1.07 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.65 3hb9 h ALA 128 CO 0.08 0.45 0.16 -0.09 0.00 0.00 0.00 179.25 179.85 3hb9 h ARG 129 N 0.75 0.32 -0.38 0.00 2.43 -1.58 -2.06 114.38 113.85 3hb9 h ARG 129 Ca 0.15 -0.02 -0.09 0.00 -0.81 0.00 0.00 59.98 59.21 3hb9 h ARG 129 Cb 0.45 -0.07 -0.02 0.00 -0.42 0.00 0.00 29.97 29.91 3hb9 h ARG 129 CO 0.02 0.21 -0.14 0.00 -1.51 0.00 0.00 179.97 178.54 3hb9 h ARG 130 N 0.33 0.68 0.28 0.20 2.47 -1.29 -1.49 114.38 115.55 3hb9 h ARG 130 Ca 0.12 -0.23 -0.01 0.00 -1.26 0.00 0.00 59.98 58.60 3hb9 h ARG 130 Cb 0.03 -0.06 0.00 0.00 -1.65 0.00 0.00 29.97 28.29 3hb9 h ARG 130 CO -0.08 0.80 -0.13 0.00 0.56 0.00 0.00 179.97 181.12 3hb9 h ALA 132 N 0.33 1.37 -0.16 0.00 0.00 -1.14 0.21 119.26 119.86 3hb9 h ALA 132 Ca -0.04 -0.23 -0.08 0.00 0.00 0.00 0.00 54.91 54.56 3hb9 h ALA 132 Cb 0.30 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 3hb9 h ALA 132 CO 0.06 0.32 -0.23 0.93 0.00 0.00 0.00 179.25 180.33 3hb9 h GLU 133 N 0.00 0.29 -0.62 0.00 5.08 -1.09 -2.72 114.58 115.52 3hb9 h GLU 133 Ca -0.00 -0.09 0.00 0.00 -1.00 0.00 0.00 59.36 58.26 3hb9 h GLU 133 Cb 0.52 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.74 3hb9 h GLU 133 CO 0.03 0.51 0.00 0.39 -1.00 0.00 0.00 179.01 178.95 3hb9 n GLU 134 N -4.17 3.12 -1.65 2.33 -0.58 -0.87 -4.91 120.64 113.91 3hb9 n GLU 134 Ca -0.01 -2.25 -0.08 0.00 -0.42 0.00 0.00 57.16 54.40 3hb9 n GLU 134 Cb 0.36 -1.75 -0.02 0.00 -0.57 0.00 0.00 31.44 29.46 3hb9 n GLU 134 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3hb9 n GLY 135 N 0.99 0.59 3.30 0.62 0.00 -1.02 -5.02 105.19 104.64 3hb9 n GLY 135 Ca 0.20 -0.60 -0.35 0.00 0.00 0.00 0.00 46.02 45.27 3hb9 n GLY 135 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3hb9 s ILE 136 N -2.36 3.23 -0.06 -0.61 1.01 0.68 -4.86 121.20 118.23 3hb9 s ILE 136 Ca 0.00 -0.54 -0.30 0.00 0.00 0.00 0.00 60.65 59.81 3hb9 s ILE 136 Cb 0.00 -2.46 -0.06 0.00 0.01 0.00 0.00 42.46 39.95 3hb9 s ILE 136 CO 0.00 0.44 1.74 -0.75 0.00 0.00 0.00 174.94 176.37 3hb9 s LYS 137 N 1.39 4.09 -0.29 2.79 2.47 -0.49 -2.66 119.74 127.04 3hb9 s LYS 137 Ca 0.05 2.22 -0.25 0.00 -1.56 0.00 0.00 55.97 56.42 3hb9 s LYS 137 Cb -0.14 -4.05 0.00 0.00 -1.46 0.00 0.00 37.83 32.19 3hb9 s LYS 137 CO -0.04 -0.97 0.88 0.12 0.16 0.00 0.00 175.35 175.50 3hb9 s PHE 138 N 4.44 3.22 -0.71 4.03 2.19 -1.26 -1.39 117.98 128.50 3hb9 s PHE 138 Ca 0.78 1.02 -0.26 0.00 0.33 0.00 0.00 56.93 58.79 3hb9 s PHE 138 Cb -0.34 -3.30 0.04 0.00 -1.31 0.00 0.00 43.02 38.10 3hb9 s PHE 138 CO 0.32 -0.57 1.22 0.42 1.83 0.00 0.00 175.22 178.44 3hb9 s ILE 139 N 3.12 3.85 -4.62 3.12 1.01 -0.87 -4.81 121.20 121.99 3hb9 s ILE 139 Ca 0.37 0.33 0.00 0.00 0.00 0.00 0.00 60.65 61.35 3hb9 s ILE 139 Cb -0.14 -4.86 0.00 0.00 0.01 0.00 0.00 42.46 37.47 3hb9 s ILE 139 CO 0.12 -1.74 0.00 0.61 0.00 0.00 0.00 174.94 173.92 3hb9 n GLY 140 N 5.34 -1.36 3.65 6.18 0.00 -1.26 -4.50 105.19 113.24 3hb9 n GLY 140 Ca 0.02 -1.20 -0.29 0.00 0.00 0.00 0.00 46.02 44.56 3hb9 n GLY 140 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3hb9 s PRO 141 N -1.85 0.54 0.97 1.61 0.04 -1.22 -4.58 135.00 130.51 3hb9 s PRO 141 Ca 0.00 0.85 -0.14 0.00 0.04 0.00 0.00 61.00 61.74 3hb9 s PRO 141 Cb 0.00 -1.72 0.18 0.00 0.04 0.00 0.00 34.50 32.99 3hb9 s PRO 141 CO 0.00 -2.74 1.18 -1.01 0.04 0.00 0.00 177.00 174.47 3hb9 s HIS 142 N -2.79 1.97 0.23 0.56 3.76 -1.26 -4.88 115.29 112.87 3hb9 s HIS 142 Ca 0.65 0.66 -0.07 0.00 -0.15 0.00 0.00 55.06 56.15 3hb9 s HIS 142 Cb -0.20 -3.57 0.37 0.00 1.11 0.00 0.00 32.58 30.28 3hb9 s HIS 142 CO 0.59 -2.67 1.72 -0.07 -0.85 0.00 0.00 174.74 173.46 3hb9 h LEU 143 N -1.70 0.17 -0.58 0.89 4.07 -1.96 -1.89 115.31 114.30 3hb9 h LEU 143 Ca -0.48 0.11 -0.01 0.00 0.08 0.00 0.00 57.88 57.58 3hb9 h LEU 143 Cb 1.30 0.11 -0.00 0.00 1.08 0.00 0.00 40.66 43.15 3hb9 h LEU 143 CO 0.52 0.07 -0.03 1.05 -1.08 0.00 0.00 178.44 178.97 3hb9 h GLU 144 N 0.37 0.00 -0.34 1.13 9.09 -1.98 -2.76 114.58 120.09 3hb9 h GLU 144 Ca 0.36 0.00 -0.10 0.00 0.05 0.00 0.00 59.36 59.67 3hb9 h GLU 144 Cb 0.53 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 27.62 3hb9 h GLU 144 CO -0.39 0.03 -0.17 0.45 0.05 0.00 0.00 179.01 178.98 3hb9 h HIS 145 N 0.00 0.84 -0.09 2.06 3.86 -1.70 0.31 115.15 120.43 3hb9 h HIS 145 Ca -0.00 -0.21 -0.19 0.00 -1.16 0.00 0.00 60.37 58.81 3hb9 h HIS 145 Cb 0.83 -0.19 -0.00 0.00 1.06 0.00 0.00 27.41 29.10 3hb9 h HIS 145 CO 0.00 0.93 -0.75 -0.07 0.86 0.00 0.00 177.93 178.90 3hb9 h LEU 146 N 0.50 0.55 -0.73 2.43 3.38 -1.56 -1.81 115.31 118.07 3hb9 h LEU 146 Ca 0.08 -0.37 -0.05 0.00 0.09 0.00 0.00 57.88 57.63 3hb9 h LEU 146 Cb 0.71 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 41.27 3hb9 h LEU 146 CO 0.05 1.12 0.25 -0.78 0.09 0.00 0.00 178.44 179.17 3hb9 h ASP 147 N 0.31 1.05 1.68 -0.43 -0.00 -1.41 0.19 116.42 117.81 3hb9 h ASP 147 Ca -0.04 -0.20 -0.05 0.00 -0.00 0.00 0.00 57.03 56.75 3hb9 h ASP 147 Cb 1.33 -0.27 -0.01 0.00 -0.00 0.00 0.00 39.33 40.38 3hb9 h ASP 147 CO 0.13 0.96 -0.23 -0.03 -0.00 0.00 0.00 179.24 180.08 3hb9 h MET 148 N 1.07 0.00 -0.01 0.28 -1.53 -0.29 -3.32 114.93 111.13 3hb9 h MET 148 Ca 0.24 0.00 0.00 0.00 -3.44 0.00 0.00 59.70 56.50 3hb9 h MET 148 Cb 0.28 0.00 0.00 0.00 -0.55 0.00 0.00 31.60 31.33 3hb9 h MET 148 CO -0.01 0.23 -0.08 1.19 0.14 0.00 0.00 176.91 178.37 3hb9 n PHE 149 N -3.17 0.00 0.00 1.39 0.99 -0.69 -2.39 117.46 113.59 3hb9 n PHE 149 Ca 0.03 0.00 -0.12 0.00 -0.00 0.00 0.00 57.45 57.35 3hb9 n PHE 149 Cb 0.60 0.00 -0.10 0.00 -1.00 0.00 0.00 39.48 38.99 3hb9 n PHE 149 CO 0.00 0.00 0.00 0.78 -0.00 0.00 0.00 176.76 177.54 3hb9 h GLY 150 N 1.45 -0.09 -2.72 1.37 0.00 -0.72 -3.44 103.07 98.91 3hb9 h GLY 150 Ca 0.00 0.03 -0.50 0.00 0.00 0.00 0.00 47.33 46.86 3hb9 h GLY 150 CO 0.00 -0.03 0.47 -0.35 0.00 0.00 0.00 176.54 176.63 3hb9 s ASP 151 N -5.71 6.26 0.24 0.19 3.68 -1.26 -4.96 116.67 115.10 3hb9 s ASP 151 Ca -0.15 2.26 -0.00 0.00 2.13 0.00 0.00 52.55 56.78 3hb9 s ASP 151 Cb 0.00 -2.60 0.26 0.00 -1.45 0.00 0.00 42.92 39.13 3hb9 s ASP 151 CO 0.60 -0.85 1.62 0.11 0.13 0.00 0.00 175.17 176.78 3hb9 h LYS 152 N 2.11 0.54 0.02 4.34 1.57 -1.92 -2.58 116.57 120.65 3hb9 h LYS 152 Ca -0.49 -0.26 -0.17 0.00 -1.87 0.00 0.00 60.65 57.86 3hb9 h LYS 152 Cb 1.24 -0.00 0.01 0.00 0.08 0.00 0.00 32.23 33.56 3hb9 h LYS 152 CO 0.60 0.83 -0.66 0.28 -0.57 0.00 0.00 179.45 179.93 3hb9 h VAL 153 N 0.45 1.43 -0.10 0.50 2.07 -1.96 -3.30 116.25 115.34 3hb9 h VAL 153 Ca 0.05 -2.15 -0.12 0.00 0.82 0.00 0.00 66.70 65.29 3hb9 h VAL 153 Cb 0.85 2.67 -0.01 0.00 -1.52 0.00 0.00 31.29 33.28 3hb9 h VAL 153 CO 0.07 0.63 -0.49 0.50 0.02 0.00 0.00 177.57 178.30 3hb9 h LYS 154 N -0.11 0.25 -2.33 1.57 1.63 -1.83 -2.53 116.57 113.22 3hb9 h LYS 154 Ca -0.09 -0.14 -0.37 0.00 -0.85 0.00 0.00 60.65 59.20 3hb9 h LYS 154 Cb 1.38 0.01 -0.04 0.00 -0.60 0.00 0.00 32.23 32.98 3hb9 h LYS 154 CO 0.13 0.69 1.07 0.00 -3.45 0.00 0.00 179.45 177.89 3hb9 n ALA 155 N -2.47 6.78 0.00 5.00 0.00 -0.97 -2.69 120.51 126.16 3hb9 n ALA 155 Ca -0.02 -2.48 0.00 0.00 0.00 0.00 0.00 53.44 50.95 3hb9 n ALA 155 Cb 0.54 -2.66 0.00 0.00 0.00 0.00 0.00 19.45 17.32 3hb9 n ALA 155 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 3hb9 n ARG 156 N 2.76 0.00 0.14 0.00 0.00 -1.17 -4.78 116.66 113.60 3hb9 n ARG 156 Ca 0.55 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 58.40 3hb9 n ARG 156 Cb 0.67 0.00 0.28 0.00 0.00 0.00 0.00 32.46 33.41 3hb9 n ARG 156 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.63 178.78 3hb9 h THR 157 N 0.00 1.30 -0.09 5.15 2.02 -1.23 -2.62 112.91 117.43 3hb9 h THR 157 Ca 0.00 -1.42 -0.19 0.00 0.77 0.00 0.00 66.41 65.56 3hb9 h THR 157 Cb 0.00 1.70 -0.00 0.00 -1.74 0.00 0.00 68.15 68.10 3hb9 h THR 157 CO 0.00 0.42 -0.74 0.74 0.37 0.00 0.00 175.52 176.30 3hb9 h THR 158 N 0.10 1.35 -0.11 3.16 2.02 -1.83 -2.78 112.91 114.82 3hb9 h THR 158 Ca 0.01 -2.10 -0.14 0.00 0.77 0.00 0.00 66.41 64.95 3hb9 h THR 158 Cb 0.75 2.08 -0.01 0.00 -1.74 0.00 0.00 68.15 69.23 3hb9 h THR 158 CO 0.06 0.64 -0.52 0.00 0.37 0.00 0.00 175.52 176.06 3hb9 h ALA 159 N 0.85 0.90 -0.28 6.16 0.00 -1.82 -1.73 119.26 123.34 3hb9 h ALA 159 Ca -0.04 -0.49 -0.14 0.00 0.00 0.00 0.00 54.91 54.24 3hb9 h ALA 159 Cb 1.33 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 19.02 3hb9 h ALA 159 CO 0.13 0.68 -0.39 0.82 0.00 0.00 0.00 179.25 180.49 3hb9 h ILE 160 N 0.24 1.29 0.00 0.00 2.04 -1.51 0.13 117.51 119.71 3hb9 h ILE 160 Ca 0.01 -1.55 0.00 0.00 1.00 0.00 0.00 64.86 64.31 3hb9 h ILE 160 Cb 1.00 1.50 0.00 0.00 -0.74 0.00 0.00 36.82 38.58 3hb9 h ILE 160 CO 0.09 0.50 0.00 1.17 0.00 0.00 0.00 178.15 179.90 3hb9 n LYS 161 N -4.04 0.05 -0.12 2.37 4.81 -1.05 -2.89 118.16 117.30 3hb9 n LYS 161 Ca -0.02 0.21 0.07 0.00 -0.87 0.00 0.00 58.31 57.71 3hb9 n LYS 161 Cb 0.52 -1.59 0.10 0.00 0.02 0.00 0.00 35.03 34.08 3hb9 n LYS 161 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 3hb9 n ALA 162 N -1.57 2.17 -2.93 3.14 0.00 -0.68 -5.05 120.51 115.59 3hb9 n ALA 162 Ca 0.04 -2.19 -0.03 0.00 0.00 0.00 0.00 53.44 51.26 3hb9 n ALA 162 Cb 0.24 -0.35 0.00 0.00 0.00 0.00 0.00 19.45 19.35 3hb9 n ALA 162 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 3hb9 n ASP 163 N -1.12 -7.73 -3.79 0.00 10.43 -0.36 -4.71 116.55 109.28 3hb9 n ASP 163 Ca 0.12 0.19 -0.13 0.00 2.57 0.00 0.00 54.79 57.55 3hb9 n ASP 163 Cb 0.60 -5.24 -0.12 0.00 1.84 0.00 0.00 41.12 38.19 3hb9 n ASP 163 CO 0.00 0.00 0.00 -0.76 -1.07 0.00 0.00 177.20 175.37 3hb9 s LEU 164 N -3.34 1.11 0.65 0.64 1.43 0.33 -4.99 118.68 114.51 3hb9 s LEU 164 Ca 0.11 0.40 -0.09 0.00 -1.03 0.00 0.00 54.13 53.51 3hb9 s LEU 164 Cb -0.03 0.64 0.01 0.00 0.03 0.00 0.00 46.19 46.84 3hb9 s LEU 164 CO 0.74 -0.09 1.01 -2.16 0.23 0.00 0.00 176.35 176.08 3hb9 s PRO 165 N 0.35 2.96 0.20 1.29 0.04 -1.26 -4.30 135.00 134.29 3hb9 s PRO 165 Ca -0.02 0.31 0.00 0.00 0.04 0.00 0.00 61.00 61.33 3hb9 s PRO 165 Cb -0.03 -2.13 0.00 0.00 0.04 0.00 0.00 34.50 32.38 3hb9 s PRO 165 CO -0.01 -0.85 0.00 1.33 0.04 0.00 0.00 177.00 177.51 3hb9 n VAL 166 N -2.81 0.00 -1.84 -0.36 0.24 -1.26 -2.19 118.33 110.11 3hb9 n VAL 166 Ca 0.06 0.00 -0.42 0.00 -2.04 0.00 0.00 64.34 61.94 3hb9 n VAL 166 Cb 0.57 -0.11 -0.02 0.00 -1.47 0.00 0.00 33.84 32.81 3hb9 n VAL 166 CO 0.00 0.00 0.00 -0.63 -2.14 0.00 0.00 176.83 174.06 3hb9 s ILE 167 N -1.49 2.23 0.69 1.34 1.01 -1.26 -4.99 121.20 118.74 3hb9 s ILE 167 Ca 0.00 0.19 -0.17 0.00 0.00 0.00 0.00 60.65 60.68 3hb9 s ILE 167 Cb 0.00 -3.12 0.01 0.00 0.01 0.00 0.00 42.46 39.35 3hb9 s ILE 167 CO 0.00 0.03 1.15 -0.81 0.00 0.00 0.00 174.94 175.31 3hb9 n PRO 168 N 2.45 0.75 0.00 2.79 -0.04 -1.26 -5.22 135.00 134.47 3hb9 n PRO 168 Ca 0.09 0.32 0.00 0.00 -0.04 0.00 0.00 63.50 63.86 3hb9 n PRO 168 Cb 0.38 -2.39 0.00 0.00 -0.04 0.00 0.00 33.50 31.45 3hb9 n PRO 168 CO 0.00 0.00 0.00 0.44 -0.04 0.00 0.00 175.50 175.90 3hb9 n ILE 239 N -2.32 0.00 -4.05 0.52 -6.64 -1.26 -5.30 119.36 100.31 3hb9 n ILE 239 Ca 0.15 0.00 -0.35 0.00 -1.77 0.00 0.00 62.75 60.78 3hb9 n ILE 239 Cb 0.49 0.00 -0.10 0.00 -1.44 0.00 0.00 39.64 38.59 3hb9 n ILE 239 CO 0.00 0.00 0.00 -0.62 -1.77 0.00 0.00 176.55 174.16 3hb9 s ASP 240 N -0.05 5.59 -1.04 7.28 2.15 -1.26 -4.47 116.67 124.86 3hb9 s ASP 240 Ca 0.00 0.09 -0.09 0.00 0.43 0.00 0.00 52.55 52.97 3hb9 s ASP 240 Cb 0.00 -1.93 -0.05 0.00 -0.30 0.00 0.00 42.92 40.65 3hb9 s ASP 240 CO 0.00 0.20 0.86 0.59 -0.17 0.00 0.00 175.17 176.65 3hb9 n ASN 241 N 3.38 -6.38 -4.83 -0.34 3.02 -1.26 -4.83 115.26 104.01 3hb9 n ASN 241 Ca -0.17 -0.74 -0.33 0.00 -0.03 0.00 0.00 54.58 53.31 3hb9 n ASN 241 Cb 0.52 -4.67 -0.06 0.00 -0.61 0.00 0.00 39.78 34.96 3hb9 n ASN 241 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 3hb9 s PRO 242 N -4.70 4.13 -0.29 3.52 0.05 -1.26 -4.64 135.00 131.80 3hb9 s PRO 242 Ca 0.41 0.88 0.03 0.00 0.05 0.00 0.00 61.00 62.38 3hb9 s PRO 242 Cb -0.08 -2.38 0.08 0.00 0.05 0.00 0.00 34.50 32.16 3hb9 s PRO 242 CO 0.78 0.11 -0.05 0.21 0.05 0.00 0.00 177.00 178.09 3hb9 s LYS 243 N -2.96 1.95 -0.50 4.56 2.47 0.20 -1.62 119.74 123.84 3hb9 s LYS 243 Ca 0.56 -1.55 -0.28 0.00 -1.56 0.00 0.00 55.97 53.14 3hb9 s LYS 243 Cb -0.10 -3.01 0.01 0.00 -1.46 0.00 0.00 37.83 33.26 3hb9 s LYS 243 CO 0.16 -0.71 1.45 -1.58 0.16 0.00 0.00 175.35 174.84 3hb9 s HIS 244 N 1.03 2.27 -0.06 4.03 5.65 -1.26 -1.75 115.29 125.20 3hb9 s HIS 244 Ca -0.01 0.57 0.03 0.00 0.25 0.00 0.00 55.06 55.90 3hb9 s HIS 244 Cb -0.20 -4.34 0.00 0.00 -1.18 0.00 0.00 32.58 26.87 3hb9 s HIS 244 CO -0.06 -2.04 -0.16 0.42 -0.65 0.00 0.00 174.74 172.25 3hb9 s ILE 245 N 6.03 1.40 0.02 0.89 1.09 -1.14 -0.47 121.20 129.02 3hb9 s ILE 245 Ca 0.58 -0.67 0.04 0.00 -1.10 0.00 0.00 60.65 59.50 3hb9 s ILE 245 Cb -0.12 -1.23 -0.02 0.00 -1.06 0.00 0.00 42.46 40.03 3hb9 s ILE 245 CO 0.28 0.41 -0.12 -1.83 -0.10 0.00 0.00 174.94 173.58 3hb9 s GLU 246 N 0.31 0.86 -0.11 2.79 -1.05 -0.79 -0.79 118.70 119.92 3hb9 s GLU 246 Ca -0.10 -0.62 -0.03 0.00 -0.15 0.00 0.00 54.97 54.06 3hb9 s GLU 246 Cb -0.14 -0.84 -0.03 0.00 -0.44 0.00 0.00 34.13 32.68 3hb9 s GLU 246 CO 0.04 0.21 0.02 0.08 0.95 0.00 0.00 175.26 176.56 3hb9 s VAL 247 N -0.69 4.43 -0.01 1.83 1.01 -0.94 0.10 120.40 126.13 3hb9 s VAL 247 Ca 0.01 -0.19 -0.26 0.00 0.00 0.00 0.00 61.98 61.54 3hb9 s VAL 247 Cb -0.07 -2.90 -0.04 0.00 0.00 0.00 0.00 36.38 33.37 3hb9 s VAL 247 CO 0.01 0.57 0.81 -1.58 0.00 0.00 0.00 175.10 174.91 3hb9 s GLN 248 N -0.52 4.50 -0.06 2.72 2.00 -0.90 -2.27 119.66 125.13 3hb9 s GLN 248 Ca 0.09 1.12 0.02 0.00 -2.00 0.00 0.00 55.36 54.59 3hb9 s GLN 248 Cb -0.12 -3.43 0.02 0.00 0.80 0.00 0.00 33.01 30.28 3hb9 s GLN 248 CO 0.02 0.09 -0.10 0.08 -0.50 0.00 0.00 175.29 174.87 3hb9 s VAL 249 N 0.63 0.98 -0.06 1.34 1.01 0.60 -0.60 120.40 124.30 3hb9 s VAL 249 Ca 0.43 -0.39 0.03 0.00 0.00 0.00 0.00 61.98 62.05 3hb9 s VAL 249 Cb -0.20 -0.91 0.00 0.00 0.00 0.00 0.00 36.38 35.27 3hb9 s VAL 249 CO 0.23 0.32 -0.16 -0.63 0.00 0.00 0.00 175.10 174.86 3hb9 s ILE 250 N 0.72 1.40 0.01 2.22 1.01 -0.57 -0.22 121.20 125.77 3hb9 s ILE 250 Ca -0.14 -0.66 0.01 0.00 0.00 0.00 0.00 60.65 59.86 3hb9 s ILE 250 Cb -0.15 -1.23 -0.01 0.00 0.01 0.00 0.00 42.46 41.08 3hb9 s ILE 250 CO 0.03 0.41 -0.03 -0.83 0.00 0.00 0.00 174.94 174.52 3hb9 s GLY 251 N 0.36 0.17 0.00 6.18 0.00 -1.03 -0.33 107.32 112.67 3hb9 s GLY 251 Ca -0.11 -0.25 0.00 0.00 0.00 0.00 0.00 44.72 44.36 3hb9 s GLY 251 CO 0.04 -0.26 0.00 2.09 0.00 0.00 0.00 173.10 174.97 3hb9 n ASP 252 N 2.60 0.00 -1.22 1.64 3.85 -0.80 0.22 116.55 122.84 3hb9 n ASP 252 Ca -0.16 -0.20 0.11 0.00 -0.71 0.00 0.00 54.79 53.84 3hb9 n ASP 252 Cb 0.58 0.00 0.28 0.00 -1.35 0.00 0.00 41.12 40.63 3hb9 n ASP 252 CO 0.00 0.00 0.00 -0.62 -1.01 0.00 0.00 177.20 175.57 3hb9 n GLU 253 N -0.20 2.54 -0.16 0.11 1.02 -1.26 -4.30 120.64 118.39 3hb9 n GLU 253 Ca 0.00 -2.38 0.05 0.00 -0.02 0.00 0.00 57.16 54.81 3hb9 n GLU 253 Cb 0.00 -1.53 0.13 0.00 -0.02 0.00 0.00 31.44 30.02 3hb9 n GLU 253 CO 0.00 0.00 0.00 0.72 1.18 0.00 0.00 177.13 179.03 3hb9 n HIS 254 N 1.48 0.39 -0.64 -0.32 8.25 -1.26 -4.99 115.22 118.13 3hb9 n HIS 254 Ca 0.22 -0.57 0.00 0.00 -0.26 0.00 0.00 57.72 57.11 3hb9 n HIS 254 Cb 0.58 -0.08 0.00 0.00 1.12 0.00 0.00 29.99 31.62 3hb9 n HIS 254 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3hb9 n GLY 255 N 0.05 0.74 3.55 -1.41 0.00 -1.26 -5.04 105.19 101.83 3hb9 n GLY 255 Ca 0.10 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.73 3hb9 n GLY 255 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3hb9 s ASN 256 N -2.45 5.96 -0.08 1.61 0.02 -1.26 -4.98 114.94 113.75 3hb9 s ASN 256 Ca 0.00 -0.23 0.03 0.00 -1.02 0.00 0.00 52.86 51.64 3hb9 s ASN 256 Cb 0.00 -2.11 0.00 0.00 0.02 0.00 0.00 41.25 39.17 3hb9 s ASN 256 CO 0.00 -0.14 -0.19 -0.63 0.02 0.00 0.00 177.10 176.16 3hb9 s ILE 257 N 1.73 1.66 0.28 0.60 1.09 -1.26 -1.91 121.20 123.38 3hb9 s ILE 257 Ca 0.06 -0.79 0.06 0.00 -1.10 0.00 0.00 60.65 58.88 3hb9 s ILE 257 Cb -0.17 -1.46 -0.06 0.00 -1.06 0.00 0.00 42.46 39.72 3hb9 s ILE 257 CO 0.10 0.47 -0.03 0.68 -0.10 0.00 0.00 174.94 176.06 3hb9 s VAL 258 N 0.45 1.50 0.14 2.92 -7.23 0.55 -4.98 120.40 113.75 3hb9 s VAL 258 Ca -0.16 -2.09 0.08 0.00 -1.81 0.00 0.00 61.98 57.99 3hb9 s VAL 258 Cb -0.17 -2.48 -0.04 0.00 0.56 0.00 0.00 36.38 34.25 3hb9 s VAL 258 CO 0.06 -0.27 -0.08 -1.38 -0.31 0.00 0.00 175.10 173.12 3hb9 s HIS 259 N -3.11 2.72 -0.43 2.82 -3.43 -1.26 -1.51 115.29 111.10 3hb9 s HIS 259 Ca 0.30 -0.18 0.05 0.00 -0.80 0.00 0.00 55.06 54.43 3hb9 s HIS 259 Cb 0.05 -1.38 0.43 0.00 -1.43 0.00 0.00 32.58 30.25 3hb9 s HIS 259 CO 0.12 0.47 1.29 1.28 -2.00 0.00 0.00 174.74 175.89 3hb9 n LEU 260 N 0.36 5.26 0.00 5.38 4.32 0.23 -4.98 117.00 127.58 3hb9 n LEU 260 Ca -0.12 -4.92 0.18 0.00 -0.02 0.00 0.00 56.01 51.13 3hb9 n LEU 260 Cb 0.54 -0.50 -0.05 0.00 -1.62 0.00 0.00 43.42 41.79 3hb9 n LEU 260 CO 0.35 2.09 -0.25 0.49 -1.22 0.00 0.00 177.39 178.85 3hb9 n PHE 261 N -0.62 -3.54 -2.77 -1.77 3.01 -1.26 -4.62 117.46 105.90 3hb9 n PHE 261 Ca 0.44 1.68 -0.20 0.00 1.01 0.00 0.00 57.45 60.38 3hb9 n PHE 261 Cb 0.76 -3.09 0.04 0.00 -0.01 0.00 0.00 39.48 37.18 3hb9 n PHE 261 CO 0.00 0.00 0.00 -1.83 1.01 0.00 0.00 176.76 175.94 3hb9 s GLU 262 N -2.08 2.48 -0.02 -1.08 1.03 -1.26 -2.12 118.70 115.64 3hb9 s GLU 262 Ca 0.00 -1.04 0.05 0.00 0.03 0.00 0.00 54.97 54.02 3hb9 s GLU 262 Cb 0.00 -2.56 -0.01 0.00 -0.80 0.00 0.00 34.13 30.76 3hb9 s GLU 262 CO 0.00 -0.71 -0.18 1.03 -1.33 0.00 0.00 175.26 174.07 3hb9 s ARG 263 N -4.69 1.58 -0.95 -4.83 0.52 0.28 -4.50 118.95 106.36 3hb9 s ARG 263 Ca 0.58 -0.64 -0.16 0.00 -0.52 0.00 0.00 55.73 55.00 3hb9 s ARG 263 Cb -0.09 -1.47 0.17 0.00 0.52 0.00 0.00 34.95 34.08 3hb9 s ARG 263 CO 0.38 0.34 1.07 0.34 0.02 0.00 0.00 175.30 177.44 3hb9 s ASP 264 N -0.27 6.79 -0.41 0.23 3.68 0.23 -1.88 116.67 125.03 3hb9 s ASP 264 Ca 0.03 -2.49 0.01 0.00 2.13 0.00 0.00 52.55 52.24 3hb9 s ASP 264 Cb -0.09 -2.33 0.46 0.00 -1.45 0.00 0.00 42.92 39.51 3hb9 s ASP 264 CO 0.00 -0.82 1.82 0.00 0.13 0.00 0.00 175.17 176.31 3hb9 h SER 266 N 1.12 0.36 -2.07 0.00 0.02 -1.76 -3.42 113.55 107.81 3hb9 h SER 266 Ca 0.49 -0.32 -0.51 0.00 -0.84 0.00 0.00 61.79 60.61 3hb9 h SER 266 Cb 1.89 -0.11 -0.04 0.00 0.14 0.00 0.00 62.40 64.28 3hb9 h SER 266 CO 0.99 1.16 1.32 -0.69 -1.14 0.00 0.00 176.83 178.47 3hb9 s VAL 267 N -3.04 3.40 -0.02 2.27 1.01 -1.25 -3.87 120.40 118.90 3hb9 s VAL 267 Ca -0.04 0.25 -0.18 0.00 0.00 0.00 0.00 61.98 62.01 3hb9 s VAL 267 Cb 0.09 -4.01 0.03 0.00 0.00 0.00 0.00 36.38 32.49 3hb9 s VAL 267 CO 0.85 -0.96 0.38 0.00 0.00 0.00 0.00 175.10 175.38 3hb9 s GLN 268 N 6.82 0.76 0.00 2.72 -2.07 -1.26 -2.15 119.66 124.48 3hb9 s GLN 268 Ca 0.65 -0.12 0.00 0.00 -1.82 0.00 0.00 55.36 54.07 3hb9 s GLN 268 Cb -0.13 0.34 0.00 0.00 -1.09 0.00 0.00 33.01 32.13 3hb9 s GLN 268 CO 0.21 -0.22 0.00 0.54 -1.32 0.00 0.00 175.29 174.50 3hb9 n ARG 269 N 1.15 0.00 0.00 9.60 1.74 -0.82 -4.55 116.66 123.77 3hb9 n ARG 269 Ca -0.21 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 56.87 3hb9 n ARG 269 Cb 0.56 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 32.00 3hb9 n ARG 269 CO 0.00 0.00 0.00 -2.13 -1.52 0.00 0.00 177.63 173.98 3hb9 n ARG 270 N 0.00 0.00 -1.84 5.56 3.00 -1.26 -4.76 116.66 117.37 3hb9 n ARG 270 Ca 0.00 0.00 -0.35 0.00 -0.00 0.00 0.00 57.85 57.50 3hb9 n ARG 270 Cb 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 32.46 32.44 3hb9 n ARG 270 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.63 178.35 3hb9 n HIS 271 N 0.00 2.24 -3.62 -0.14 8.25 -1.26 -4.84 115.22 115.85 3hb9 n HIS 271 Ca 0.00 -2.48 -0.04 0.00 -0.26 0.00 0.00 57.72 54.94 3hb9 n HIS 271 Cb 0.00 -1.64 -0.06 0.00 1.12 0.00 0.00 29.99 29.42 3hb9 n HIS 271 CO 0.00 0.00 0.00 -1.14 0.64 0.00 0.00 176.34 175.84 3hb9 s GLN 272 N -1.52 0.58 0.40 -0.41 0.74 -1.26 -5.15 119.66 113.04 3hb9 s GLN 272 Ca 0.55 1.19 -0.24 0.00 0.05 0.00 0.00 55.36 56.91 3hb9 s GLN 272 Cb 0.26 0.42 -0.09 0.00 1.10 0.00 0.00 33.01 34.70 3hb9 s GLN 272 CO -0.15 -0.15 1.09 0.15 -0.55 0.00 0.00 175.29 175.68 3hb9 s LYS 273 N 2.12 4.12 0.08 1.67 1.02 -1.26 -1.95 119.74 125.54 3hb9 s LYS 273 Ca -0.08 1.64 -0.01 0.00 0.02 0.00 0.00 55.97 57.54 3hb9 s LYS 273 Cb -0.07 -2.60 -0.00 0.00 -0.52 0.00 0.00 37.83 34.63 3hb9 s LYS 273 CO -0.19 -0.21 -0.01 0.28 -0.92 0.00 0.00 175.35 174.30 3hb9 n VAL 274 N -0.00 1.15 -4.82 3.17 0.31 -0.91 -4.88 118.33 112.35 3hb9 n VAL 274 Ca 0.05 0.37 -0.27 0.00 -0.01 0.00 0.00 64.34 64.47 3hb9 n VAL 274 Cb 0.48 -1.58 -0.17 0.00 -0.91 0.00 0.00 33.84 31.67 3hb9 n VAL 274 CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 3hb9 s VAL 275 N -1.96 1.45 0.20 2.52 1.01 -0.93 -4.38 120.40 118.31 3hb9 s VAL 275 Ca -0.01 -0.68 0.07 0.00 0.00 0.00 0.00 61.98 61.36 3hb9 s VAL 275 Cb 0.00 -1.29 -0.04 0.00 0.00 0.00 0.00 36.38 35.06 3hb9 s VAL 275 CO 0.02 0.42 0.06 -1.61 0.00 0.00 0.00 175.10 174.00 3hb9 s GLU 276 N 0.45 2.58 -0.02 2.72 8.01 -1.20 -3.86 118.70 127.38 3hb9 s GLU 276 Ca -0.14 -1.11 0.01 0.00 0.01 0.00 0.00 54.97 53.74 3hb9 s GLU 276 Cb -0.16 -2.42 0.02 0.00 -4.31 0.00 0.00 34.13 27.27 3hb9 s GLU 276 CO 0.05 0.43 -0.01 0.08 0.01 0.00 0.00 175.26 175.82 3hb9 s VAL 277 N -1.92 0.23 -0.04 2.63 1.01 -0.81 -2.46 120.40 119.04 3hb9 s VAL 277 Ca 0.30 0.01 -0.01 0.00 0.00 0.00 0.00 61.98 62.28 3hb9 s VAL 277 Cb -0.09 -0.28 0.03 0.00 0.00 0.00 0.00 36.38 36.04 3hb9 s VAL 277 CO 0.21 0.13 0.03 0.00 0.00 0.00 0.00 175.10 175.47 3hb9 s ALA 278 N 0.73 0.32 0.94 5.51 0.00 -0.25 0.74 121.76 129.75 3hb9 s ALA 278 Ca -0.08 0.14 -0.15 0.00 0.00 0.00 0.00 51.96 51.87 3hb9 s ALA 278 Cb -0.11 -0.52 0.19 0.00 0.00 0.00 0.00 23.12 22.68 3hb9 s ALA 278 CO -0.01 -0.33 1.30 -1.25 0.00 0.00 0.00 175.76 175.47 3hb9 s PRO 279 N 1.71 0.77 0.33 0.00 0.04 -1.26 0.24 135.00 136.83 3hb9 s PRO 279 Ca -0.00 -0.39 -0.28 0.00 0.04 0.00 0.00 61.00 60.37 3hb9 s PRO 279 Cb -0.13 -1.87 -0.09 0.00 0.04 0.00 0.00 34.50 32.45 3hb9 s PRO 279 CO -0.03 -2.33 1.15 0.45 0.04 0.00 0.00 177.00 176.29 3hb9 s SER 280 N -4.86 6.92 0.10 6.66 0.15 -1.26 -4.80 113.70 116.60 3hb9 s SER 280 Ca 0.73 2.35 0.01 0.00 0.70 0.00 0.00 55.95 59.74 3hb9 s SER 280 Cb -0.04 -2.62 -0.04 0.00 -1.71 0.00 0.00 66.02 61.60 3hb9 s SER 280 CO 0.52 -0.40 0.25 -0.69 1.20 0.00 0.00 173.24 174.12 3hb9 s VAL 281 N -1.27 5.35 0.00 4.45 1.01 -1.26 -4.58 120.40 124.09 3hb9 s VAL 281 Ca 0.50 -0.48 0.00 0.00 0.00 0.00 0.00 61.98 62.00 3hb9 s VAL 281 Cb -0.32 -3.67 0.00 0.00 0.00 0.00 0.00 36.38 32.39 3hb9 s VAL 281 CO 0.41 0.04 0.00 0.61 0.00 0.00 0.00 175.10 176.17 3hb9 n GLY 282 N -0.05 1.91 3.71 4.51 0.00 -1.26 -4.84 105.19 109.18 3hb9 n GLY 282 Ca -0.06 -0.19 -0.42 0.00 0.00 0.00 0.00 46.02 45.35 3hb9 n GLY 282 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3hb9 s LEU 283 N 0.00 4.37 0.63 0.99 1.43 -1.26 -4.98 118.68 119.86 3hb9 s LEU 283 Ca 0.00 2.36 -0.18 0.00 -1.03 0.00 0.00 54.13 55.28 3hb9 s LEU 283 Cb 0.00 -3.58 -0.03 0.00 0.03 0.00 0.00 46.19 42.61 3hb9 s LEU 283 CO 0.00 -0.69 1.07 -1.54 0.23 0.00 0.00 176.35 175.42 3hb9 n SER 284 N 4.14 1.16 -0.15 2.29 3.41 -1.26 -4.80 113.62 118.41 3hb9 n SER 284 Ca 0.12 0.80 0.17 0.00 -0.26 0.00 0.00 58.87 59.69 3hb9 n SER 284 Cb 0.42 -1.45 0.53 0.00 -0.26 0.00 0.00 64.21 63.45 3hb9 n SER 284 CO 0.00 0.00 0.00 -0.65 -0.16 0.00 0.00 175.04 174.23 3hb9 h PRO 285 N 0.42 0.34 -0.00 4.33 0.11 -2.01 -1.14 132.00 134.06 3hb9 h PRO 285 Ca -0.49 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.60 3hb9 h PRO 285 Cb 1.36 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.39 3hb9 h PRO 285 CO 0.51 0.23 -0.65 0.25 -0.21 0.00 0.00 178.00 178.13 3hb9 n THR 286 N -4.46 0.00 -0.04 -1.15 -2.24 -1.26 -3.24 114.28 101.89 3hb9 n THR 286 Ca 0.14 -0.01 -0.14 0.00 -2.27 0.00 0.00 64.05 61.78 3hb9 n THR 286 Cb 0.56 0.50 -0.11 0.00 -2.10 0.00 0.00 70.33 69.18 3hb9 n THR 286 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 3hb9 h LEU 287 N 0.05 0.10 -1.63 3.22 6.46 -1.56 -2.84 115.31 119.11 3hb9 h LEU 287 Ca 0.00 -0.76 -0.04 0.00 -0.12 0.00 0.00 57.88 56.96 3hb9 h LEU 287 Cb 0.50 -0.03 -0.01 0.00 -0.73 0.00 0.00 40.66 40.40 3hb9 h LEU 287 CO 0.00 0.84 -0.20 0.08 -0.62 0.00 0.00 178.44 178.54 3hb9 h ARG 288 N -0.64 0.00 0.05 1.25 0.11 -1.64 -2.21 114.38 111.30 3hb9 h ARG 288 Ca -0.01 0.00 -0.00 0.00 0.10 0.00 0.00 59.98 60.07 3hb9 h ARG 288 Cb 0.85 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.93 3hb9 h ARG 288 CO 0.02 0.20 -0.02 1.96 0.10 0.00 0.00 179.97 182.23 3hb9 h GLN 289 N 0.00 -0.06 0.00 0.08 1.08 -1.60 -1.81 115.11 112.79 3hb9 h GLN 289 Ca -0.00 0.00 -0.01 0.00 -1.45 0.00 0.00 58.65 57.20 3hb9 h GLN 289 Cb 0.46 0.01 -0.00 0.00 -0.05 0.00 0.00 27.48 27.90 3hb9 h GLN 289 CO 0.03 0.04 -0.03 0.00 -0.95 0.00 0.00 178.83 177.92 3hb9 h ARG 290 N -0.15 0.00 0.01 1.46 3.08 -1.16 0.25 114.38 117.87 3hb9 h ARG 290 Ca -0.01 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 60.04 3hb9 h ARG 290 Cb 0.13 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.18 3hb9 h ARG 290 CO 0.01 0.03 -0.00 0.82 -1.07 0.00 0.00 179.97 179.75 3hb9 h ILE 291 N 0.00 1.45 -0.80 2.04 1.08 -1.32 -3.02 117.51 116.95 3hb9 h ILE 291 Ca -0.00 -2.00 -0.02 0.00 -0.39 0.00 0.00 64.86 62.45 3hb9 h ILE 291 Cb 0.32 2.71 -0.04 0.00 -3.07 0.00 0.00 36.82 36.74 3hb9 h ILE 291 CO 0.00 0.48 0.42 0.00 -0.69 0.00 0.00 178.15 178.36 3hb9 h ASP 293 N 1.12 1.04 0.22 0.00 5.19 -1.11 -1.33 116.42 121.55 3hb9 h ASP 293 Ca 0.28 -0.25 -0.08 0.00 -0.62 0.00 0.00 57.03 56.36 3hb9 h ASP 293 Cb 0.07 -0.28 -0.01 0.00 0.18 0.00 0.00 39.33 39.29 3hb9 h ASP 293 CO -0.04 1.03 -0.31 0.00 -3.12 0.00 0.00 179.24 176.79 3hb9 h ALA 294 N 1.05 1.33 -0.34 3.45 0.00 -1.33 0.71 119.26 124.12 3hb9 h ALA 294 Ca 0.20 -0.32 -0.10 0.00 0.00 0.00 0.00 54.91 54.69 3hb9 h ALA 294 Cb 0.42 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 3hb9 h ALA 294 CO 0.01 0.47 -0.18 0.00 0.00 0.00 0.00 179.25 179.56 3hb9 h ALA 295 N 1.55 0.49 -0.31 0.00 0.00 -0.60 -3.02 119.26 117.36 3hb9 h ALA 295 Ca 0.02 -0.35 -0.13 0.00 0.00 0.00 0.00 54.91 54.45 3hb9 h ALA 295 Cb 0.63 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.29 3hb9 h ALA 295 CO 0.05 0.42 -0.33 0.82 0.00 0.00 0.00 179.25 180.20 3hb9 h ILE 296 N 0.51 1.28 -0.88 0.00 2.04 -1.05 -2.86 117.51 116.55 3hb9 h ILE 296 Ca 0.08 -1.47 0.21 0.00 1.00 0.00 0.00 64.86 64.68 3hb9 h ILE 296 Cb 0.72 1.41 -0.12 0.00 -0.74 0.00 0.00 36.82 38.08 3hb9 h ILE 296 CO 0.05 0.48 0.37 -0.61 0.00 0.00 0.00 178.15 178.44 3hb9 h GLN 297 N 0.57 0.38 0.06 2.37 5.75 -0.74 0.51 115.11 124.01 3hb9 h GLN 297 Ca 0.06 -0.02 -0.12 0.00 -0.15 0.00 0.00 58.65 58.42 3hb9 h GLN 297 Cb 0.84 -0.09 0.01 0.00 1.07 0.00 0.00 27.48 29.32 3hb9 h GLN 297 CO 0.07 0.25 -0.50 1.25 -2.65 0.00 0.00 178.83 177.25 3hb9 h LEU 298 N 0.39 0.34 -0.51 -2.39 5.85 -1.50 -3.25 115.31 114.24 3hb9 h LEU 298 Ca 0.54 -0.89 -0.16 0.00 0.84 0.00 0.00 57.88 58.21 3hb9 h LEU 298 Cb 1.01 -0.11 -0.01 0.00 0.37 0.00 0.00 40.66 41.92 3hb9 h LEU 298 CO -0.52 1.20 -0.72 0.24 -0.34 0.00 0.00 178.44 178.30 3hb9 h MET 299 N -0.47 0.18 0.00 1.25 2.86 -1.19 -2.51 114.93 115.04 3hb9 h MET 299 Ca -0.08 -0.15 -0.03 0.00 -2.06 0.00 0.00 59.70 57.38 3hb9 h MET 299 Cb 1.33 0.03 -0.00 0.00 0.06 0.00 0.00 31.60 33.02 3hb9 h MET 299 CO 0.10 0.82 -0.16 1.49 1.06 0.00 0.00 176.91 180.22 3hb9 h GLU 300 N 0.12 0.00 -0.07 1.72 4.81 -1.10 -1.62 114.58 118.44 3hb9 h GLU 300 Ca -0.02 0.00 -0.20 0.00 -0.13 0.00 0.00 59.36 59.01 3hb9 h GLU 300 Cb 1.27 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 30.65 3hb9 h GLU 300 CO 0.11 0.16 -0.79 -0.97 -0.73 0.00 0.00 179.01 176.79 3hb9 h ASN 301 N 0.00 0.56 -0.55 1.04 -1.24 -1.49 -3.26 115.58 110.65 3hb9 h ASN 301 Ca -0.00 -0.39 0.00 0.00 0.71 0.00 0.00 56.30 56.62 3hb9 h ASN 301 Cb 1.02 -0.17 0.00 0.00 0.73 0.00 0.00 38.32 39.90 3hb9 h ASN 301 CO 0.02 1.15 0.00 2.30 -1.29 0.00 0.00 177.43 179.61 3hb9 n ILE 302 N -3.83 1.49 -3.45 2.57 -6.64 -1.07 -4.99 119.36 103.44 3hb9 n ILE 302 Ca -0.05 -1.18 -0.20 0.00 -1.77 0.00 0.00 62.75 59.54 3hb9 n ILE 302 Cb 0.74 0.26 0.04 0.00 -1.44 0.00 0.00 39.64 39.24 3hb9 n ILE 302 CO 0.00 0.00 0.00 0.29 -1.77 0.00 0.00 176.55 175.07 3hb9 n LYS 303 N 0.90 -1.54 -2.51 6.28 5.02 -1.19 -4.93 118.16 120.19 3hb9 n LYS 303 Ca 0.21 0.80 -0.41 0.00 -2.02 0.00 0.00 58.31 56.90 3hb9 n LYS 303 Cb 0.71 -4.73 -0.04 0.00 -0.02 0.00 0.00 35.03 30.95 3hb9 n LYS 303 CO 0.00 0.00 0.00 -0.47 -0.52 0.00 0.00 177.40 176.41 3hb9 s TYR 304 N -3.31 3.60 0.05 2.13 6.14 -0.61 -5.02 117.35 120.33 3hb9 s TYR 304 Ca 0.33 1.63 0.07 0.00 0.64 0.00 0.00 57.07 59.74 3hb9 s TYR 304 Cb -0.09 -3.27 -0.03 0.00 0.42 0.00 0.00 41.96 38.99 3hb9 s TYR 304 CO 0.81 -0.57 -0.18 0.08 0.64 0.00 0.00 175.55 176.32 3hb9 s VAL 305 N -0.47 2.76 0.00 3.14 1.01 -1.26 -4.39 120.40 121.20 3hb9 s VAL 305 Ca 0.48 -1.23 0.00 0.00 0.00 0.00 0.00 61.98 61.23 3hb9 s VAL 305 Cb -0.30 -2.17 0.00 0.00 0.00 0.00 0.00 36.38 33.91 3hb9 s VAL 305 CO 0.36 0.31 0.00 -3.20 0.00 0.00 0.00 175.10 172.57 3hb9 n ASN 306 N 1.47 -2.73 -4.79 3.32 2.85 0.60 -3.39 115.26 112.59 3hb9 n ASN 306 Ca -0.16 0.00 -0.35 0.00 -0.11 0.00 0.00 54.58 53.96 3hb9 n ASN 306 Cb 0.52 0.00 -0.03 0.00 1.24 0.00 0.00 39.78 41.51 3hb9 n ASN 306 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 3hb9 s ALA 307 N -1.54 2.91 0.02 5.20 0.00 -1.26 -2.46 121.76 124.62 3hb9 s ALA 307 Ca 0.00 0.68 -0.29 0.00 0.00 0.00 0.00 51.96 52.36 3hb9 s ALA 307 Cb 0.00 -3.28 0.10 0.00 0.00 0.00 0.00 23.12 19.94 3hb9 s ALA 307 CO 0.00 -0.37 1.01 0.20 0.00 0.00 0.00 175.76 176.60 3hb9 s GLY 308 N -1.80 -0.36 0.00 0.00 0.00 0.70 -3.65 107.32 102.21 3hb9 s GLY 308 Ca 0.65 0.76 0.02 0.00 0.00 0.00 0.00 44.72 46.16 3hb9 s GLY 308 CO 0.24 0.23 -0.07 -1.59 0.00 0.00 0.00 173.10 171.91 3hb9 s THR 309 N -2.98 0.51 -0.28 0.90 2.01 0.02 -0.29 115.64 115.54 3hb9 s THR 309 Ca 0.09 -0.37 -0.02 0.00 0.31 0.00 0.00 61.69 61.71 3hb9 s THR 309 Cb -0.00 -0.45 0.04 0.00 0.01 0.00 0.00 72.50 72.10 3hb9 s THR 309 CO -0.04 0.09 -0.03 -0.69 -0.69 0.00 0.00 174.62 173.26 3hb9 s VAL 310 N -0.28 2.94 -0.09 3.82 1.01 -0.96 -1.57 120.40 125.26 3hb9 s VAL 310 Ca 0.01 -1.23 -0.25 0.00 0.00 0.00 0.00 61.98 60.51 3hb9 s VAL 310 Cb -0.03 -2.60 -0.03 0.00 0.00 0.00 0.00 36.38 33.71 3hb9 s VAL 310 CO -0.00 0.03 0.80 -1.61 0.00 0.00 0.00 175.10 174.32 3hb9 s GLU 311 N 1.28 4.41 0.27 2.72 2.02 0.19 -2.23 118.70 127.37 3hb9 s GLU 311 Ca -0.03 1.04 0.11 0.00 0.02 0.00 0.00 54.97 56.11 3hb9 s GLU 311 Cb -0.18 -3.49 -0.05 0.00 0.10 0.00 0.00 34.13 30.50 3hb9 s GLU 311 CO -0.02 -0.10 -0.19 -0.06 0.02 0.00 0.00 175.26 174.91 3hb9 s PHE 312 N 1.31 2.20 -0.17 1.61 0.40 0.03 -0.74 117.98 122.63 3hb9 s PHE 312 Ca 0.41 -0.37 0.01 0.00 -0.60 0.00 0.00 56.93 56.38 3hb9 s PHE 312 Cb -0.18 -0.96 0.03 0.00 0.51 0.00 0.00 43.02 42.42 3hb9 s PHE 312 CO 0.18 0.66 -0.15 -1.17 0.70 0.00 0.00 175.22 175.45 3hb9 s LEU 313 N -3.48 1.98 -0.21 -0.37 2.96 0.13 -2.88 118.68 116.82 3hb9 s LEU 313 Ca 0.29 -0.64 -0.09 0.00 -0.22 0.00 0.00 54.13 53.47 3hb9 s LEU 313 Cb -0.04 -1.28 -0.05 0.00 0.50 0.00 0.00 46.19 45.32 3hb9 s LEU 313 CO 0.14 -0.06 0.12 -0.69 -1.32 0.00 0.00 176.35 174.53 3hb9 s VAL 314 N 1.40 5.15 -0.10 1.68 1.01 -0.72 -3.19 120.40 125.64 3hb9 s VAL 314 Ca 0.03 0.10 -0.01 0.00 0.00 0.00 0.00 61.98 62.10 3hb9 s VAL 314 Cb -0.14 -3.36 0.03 0.00 0.00 0.00 0.00 36.38 32.91 3hb9 s VAL 314 CO -0.11 0.41 -0.03 -0.55 0.00 0.00 0.00 175.10 174.82 3hb9 s SER 315 N 0.64 1.98 0.00 3.32 0.15 -1.23 0.59 113.70 119.14 3hb9 s SER 315 Ca 0.06 -0.25 0.00 0.00 0.70 0.00 0.00 55.95 56.47 3hb9 s SER 315 Cb -0.12 -0.65 0.00 0.00 -1.71 0.00 0.00 66.02 63.54 3hb9 s SER 315 CO 0.01 -0.17 0.00 0.61 1.20 0.00 0.00 173.24 174.89 3hb9 n GLY 317 N 5.04 0.69 2.72 9.45 0.00 -1.26 -2.93 105.19 118.90 3hb9 n GLY 317 Ca -0.10 0.54 -0.05 0.00 0.00 0.00 0.00 46.02 46.42 3hb9 n GLY 317 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 3hb9 n ASP 318 N 3.58 0.25 -3.77 1.61 4.64 -1.26 -5.09 116.55 116.50 3hb9 n ASP 318 Ca 0.00 -2.36 -0.13 0.00 -1.38 0.00 0.00 54.79 50.93 3hb9 n ASP 318 Cb 0.00 0.03 -0.11 0.00 -1.04 0.00 0.00 41.12 39.99 3hb9 n ASP 318 CO 0.00 0.00 0.00 -1.83 -0.82 0.00 0.00 177.20 174.55 3hb9 s GLU 319 N -2.04 0.32 0.51 -0.67 -1.05 -1.15 -5.15 118.70 109.47 3hb9 s GLU 319 Ca 0.23 0.40 -0.20 0.00 -0.15 0.00 0.00 54.97 55.25 3hb9 s GLU 319 Cb 0.40 0.15 -0.08 0.00 -0.44 0.00 0.00 34.13 34.16 3hb9 s GLU 319 CO -0.04 -0.05 1.07 -0.59 0.95 0.00 0.00 175.26 176.60 3hb9 s PHE 320 N 0.21 2.89 -0.23 4.83 -0.12 -1.26 -3.58 117.98 120.72 3hb9 s PHE 320 Ca -0.01 1.57 -0.06 0.00 -0.05 0.00 0.00 56.93 58.38 3hb9 s PHE 320 Cb -0.02 -3.14 0.11 0.00 -0.63 0.00 0.00 43.02 39.34 3hb9 s PHE 320 CO -0.00 -1.08 0.45 -0.06 -0.05 0.00 0.00 175.22 174.48 3hb9 s PHE 321 N -1.91 -0.94 0.14 3.49 0.40 -1.19 -4.74 117.98 113.22 3hb9 s PHE 321 Ca 0.69 1.49 -0.30 0.00 -0.60 0.00 0.00 56.93 58.20 3hb9 s PHE 321 Cb -0.19 0.33 -0.07 0.00 0.51 0.00 0.00 43.02 43.59 3hb9 s PHE 321 CO 0.22 -0.59 1.27 0.12 0.70 0.00 0.00 175.22 176.94 3hb9 s PHE 322 N 2.65 3.35 -0.01 0.36 2.19 -0.93 -0.69 117.98 124.90 3hb9 s PHE 322 Ca 0.03 1.24 -0.07 0.00 0.33 0.00 0.00 56.93 58.46 3hb9 s PHE 322 Cb -0.13 -3.52 -0.02 0.00 -1.31 0.00 0.00 43.02 38.03 3hb9 s PHE 322 CO -0.15 -1.64 -0.14 -0.89 1.83 0.00 0.00 175.22 174.23 3hb9 n ILE 323 N 3.25 1.34 -3.83 3.12 2.08 0.08 -4.71 119.36 120.70 3hb9 n ILE 323 Ca 0.08 0.30 -0.07 0.00 0.56 0.00 0.00 62.75 63.61 3hb9 n ILE 323 Cb 0.44 -1.89 0.01 0.00 -0.75 0.00 0.00 39.64 37.45 3hb9 n ILE 323 CO 0.00 0.00 0.00 -1.83 0.56 0.00 0.00 176.55 175.28 3hb9 s GLU 324 N -2.36 1.96 -0.10 0.38 -1.05 -1.21 -4.98 118.70 111.33 3hb9 s GLU 324 Ca -0.12 -1.22 0.01 0.00 -0.15 0.00 0.00 54.97 53.50 3hb9 s GLU 324 Cb 0.02 0.58 0.02 0.00 -0.44 0.00 0.00 34.13 34.30 3hb9 s GLU 324 CO 0.17 -0.91 -0.11 0.08 0.95 0.00 0.00 175.26 175.44 3hb9 s VAL 325 N -2.73 1.21 -0.47 1.83 1.01 -1.26 -0.64 120.40 119.35 3hb9 s VAL 325 Ca 0.15 -0.45 -0.20 0.00 0.00 0.00 0.00 61.98 61.48 3hb9 s VAL 325 Cb -0.05 -1.15 0.04 0.00 0.00 0.00 0.00 36.38 35.22 3hb9 s VAL 325 CO 0.09 0.39 0.63 0.20 0.00 0.00 0.00 175.10 176.41 3hb9 s ASN 326 N 1.21 6.26 -0.44 3.32 0.01 -0.61 -4.93 114.94 119.77 3hb9 s ASN 326 Ca -0.03 -0.64 -0.04 0.00 -0.71 0.00 0.00 52.86 51.43 3hb9 s ASN 326 Cb -0.14 -2.30 -0.00 0.00 0.41 0.00 0.00 41.25 39.21 3hb9 s ASN 326 CO -0.03 -0.84 2.93 -0.81 -1.51 0.00 0.00 177.10 176.83 3hb9 n PRO 327 N 6.22 2.48 -2.41 -0.60 -0.04 -1.26 -0.80 135.00 138.60 3hb9 n PRO 327 Ca -0.04 -2.15 0.00 0.00 -0.04 0.00 0.00 63.50 61.27 3hb9 n PRO 327 Cb 0.47 -2.16 0.01 0.00 -0.04 0.00 0.00 33.50 31.78 3hb9 n PRO 327 CO 0.00 0.00 0.00 2.89 -0.04 0.00 0.00 175.50 178.35 3hb9 n ARG 328 N 1.30 0.13 -2.56 0.54 -4.01 -1.24 -4.59 116.66 106.22 3hb9 n ARG 328 Ca 0.49 -0.35 -0.40 0.00 -1.04 0.00 0.00 57.85 56.54 3hb9 n ARG 328 Cb 0.60 0.52 -0.05 0.00 -3.04 0.00 0.00 32.46 30.50 3hb9 n ARG 328 CO 0.00 0.00 0.00 0.14 -3.04 0.00 0.00 177.63 174.73 3hb9 s VAL 329 N -2.24 3.79 0.45 8.89 -7.23 -1.26 -4.19 120.40 118.61 3hb9 s VAL 329 Ca 0.09 1.70 0.07 0.00 -1.81 0.00 0.00 61.98 62.03 3hb9 s VAL 329 Cb -0.01 -4.08 0.02 0.00 0.56 0.00 0.00 36.38 32.87 3hb9 s VAL 329 CO 0.01 0.36 0.62 -1.10 -0.31 0.00 0.00 175.10 174.68 3hb9 s GLN 330 N -0.99 2.73 0.13 4.82 -0.21 -1.26 -4.53 119.66 120.35 3hb9 s GLN 330 Ca 0.45 -1.23 -0.18 0.00 0.02 0.00 0.00 55.36 54.42 3hb9 s GLN 330 Cb -0.29 -2.71 -0.04 0.00 1.00 0.00 0.00 33.01 30.97 3hb9 s GLN 330 CO 0.37 -0.40 1.73 0.28 -2.12 0.00 0.00 175.29 175.15 3hb9 h VAL 331 N 0.51 1.12 0.00 1.09 2.07 -2.00 -3.07 116.25 115.98 3hb9 h VAL 331 Ca -0.39 -0.32 0.00 0.00 0.82 0.00 0.00 66.70 66.81 3hb9 h VAL 331 Cb 1.28 0.79 0.00 0.00 -1.52 0.00 0.00 31.29 31.84 3hb9 h VAL 331 CO 0.45 0.12 0.00 -1.84 0.02 0.00 0.00 177.57 176.33 3hb9 n GLU 332 N -4.82 0.71 -0.12 1.57 0.00 -1.26 -4.04 120.64 112.68 3hb9 n GLU 332 Ca -0.02 0.00 -0.06 0.00 0.00 0.00 0.00 57.16 57.08 3hb9 n GLU 332 Cb 0.07 -1.29 0.12 0.00 0.00 0.00 0.00 31.44 30.34 3hb9 n GLU 332 CO 0.00 0.00 0.00 1.12 0.00 0.00 0.00 177.13 178.25 3hb9 h HIS 333 N 0.23 0.91 -0.68 -1.84 2.07 -1.95 -3.17 115.15 110.73 3hb9 h HIS 333 Ca 0.00 -0.15 0.12 0.00 -2.85 0.00 0.00 60.37 57.49 3hb9 h HIS 333 Cb 0.29 -0.24 -0.09 0.00 2.57 0.00 0.00 27.41 29.95 3hb9 h HIS 333 CO 0.00 0.87 0.25 1.15 -3.07 0.00 0.00 177.93 177.12 3hb9 h THR 334 N 0.77 0.69 -0.91 6.12 2.02 -1.86 -2.35 112.91 117.40 3hb9 h THR 334 Ca 0.14 -0.14 0.20 0.00 0.77 0.00 0.00 66.41 67.37 3hb9 h THR 334 Cb 0.55 0.25 -0.07 0.00 -1.74 0.00 0.00 68.15 67.14 3hb9 h THR 334 CO 0.03 0.07 0.60 -0.29 0.37 0.00 0.00 175.52 176.30 3hb9 h ILE 335 N 0.41 0.69 0.21 3.11 2.10 -1.88 -1.36 117.51 120.79 3hb9 h ILE 335 Ca 0.36 -0.15 -0.32 0.00 1.08 0.00 0.00 64.86 65.83 3hb9 h ILE 335 Cb 0.51 0.21 0.03 0.00 -1.09 0.00 0.00 36.82 36.47 3hb9 h ILE 335 CO -0.37 0.08 -1.46 0.74 -1.08 0.00 0.00 178.15 176.06 3hb9 h THR 336 N 0.45 1.29 -0.86 2.19 2.02 -1.60 -3.32 112.91 113.09 3hb9 h THR 336 Ca 0.47 -2.78 0.07 0.00 0.77 0.00 0.00 66.41 64.95 3hb9 h THR 336 Cb 1.12 2.98 -0.06 0.00 -1.74 0.00 0.00 68.15 70.46 3hb9 h THR 336 CO -0.19 0.84 0.56 -0.33 0.37 0.00 0.00 175.52 176.77 3hb9 h GLU 337 N 0.12 0.92 -0.33 6.66 5.08 -1.13 -0.68 114.58 125.22 3hb9 h GLU 337 Ca -0.24 -0.06 -0.13 0.00 -1.00 0.00 0.00 59.36 57.94 3hb9 h GLU 337 Cb 2.11 -0.21 -0.01 0.00 0.50 0.00 0.00 28.75 31.15 3hb9 h GLU 337 CO 0.25 0.61 -0.32 0.52 -1.00 0.00 0.00 179.01 179.06 3hb9 h MET 338 N 0.95 0.72 0.03 2.33 2.86 -1.57 0.46 114.93 120.70 3hb9 h MET 338 Ca 0.37 -0.33 -0.25 0.00 -2.06 0.00 0.00 59.70 57.43 3hb9 h MET 338 Cb 0.24 -0.01 -0.03 0.00 0.06 0.00 0.00 31.60 31.86 3hb9 h MET 338 CO -0.14 0.94 -1.30 -0.39 1.06 0.00 0.00 176.91 177.09 3hb9 h VAL 339 N 0.61 1.38 0.13 -2.22 -1.51 -1.57 -3.36 116.25 109.69 3hb9 h VAL 339 Ca 0.07 -3.10 -0.33 0.00 -1.23 0.00 0.00 66.70 62.11 3hb9 h VAL 339 Cb 0.85 2.73 -0.01 0.00 -2.13 0.00 0.00 31.29 32.73 3hb9 h VAL 339 CO 0.07 0.82 -1.72 0.71 -1.23 0.00 0.00 177.57 176.22 3hb9 h THR 340 N 0.02 0.94 0.00 7.19 1.35 -1.13 0.30 112.91 121.58 3hb9 h THR 340 Ca -0.13 -2.61 0.00 0.00 -0.55 0.00 0.00 66.41 63.12 3hb9 h THR 340 Cb 1.89 2.66 0.00 0.00 -1.73 0.00 0.00 68.15 70.98 3hb9 h THR 340 CO 0.13 0.81 0.00 0.61 -0.25 0.00 0.00 175.52 176.82 3hb9 n GLY 341 N 1.78 3.42 3.75 5.82 0.00 0.16 -4.79 105.19 115.32 3hb9 n GLY 341 Ca -0.22 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.40 3hb9 n GLY 341 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3hb9 s ILE 342 N -2.99 4.70 -0.27 -0.61 1.09 -1.23 -4.95 121.20 116.95 3hb9 s ILE 342 Ca 0.00 1.65 -0.25 0.00 -1.10 0.00 0.00 60.65 60.96 3hb9 s ILE 342 Cb 0.00 -4.12 -0.00 0.00 -1.06 0.00 0.00 42.46 37.27 3hb9 s ILE 342 CO 0.00 0.37 0.84 -0.62 -0.10 0.00 0.00 174.94 175.43 3hb9 s ASP 343 N -0.11 6.79 -0.06 3.58 3.68 -1.26 -4.40 116.67 124.89 3hb9 s ASP 343 Ca 0.39 0.92 -0.24 0.00 2.13 0.00 0.00 52.55 55.75 3hb9 s ASP 343 Cb -0.21 -2.44 -0.19 0.00 -1.45 0.00 0.00 42.92 38.64 3hb9 s ASP 343 CO 0.23 -0.57 0.99 0.40 0.13 0.00 0.00 175.17 176.35 3hb9 h ILE 344 N 5.50 1.18 -0.38 4.11 1.08 -1.96 -2.90 117.51 124.15 3hb9 h ILE 344 Ca -0.23 -1.33 -0.01 0.00 -0.39 0.00 0.00 64.86 62.90 3hb9 h ILE 344 Cb 1.09 1.99 -0.02 0.00 -3.07 0.00 0.00 36.82 36.81 3hb9 h ILE 344 CO 0.89 0.31 0.19 0.58 -0.69 0.00 0.00 178.15 179.42 3hb9 h VAL 345 N -0.76 1.17 0.04 1.67 2.07 -1.97 -1.56 116.25 116.91 3hb9 h VAL 345 Ca -0.01 -0.47 0.03 0.00 0.82 0.00 0.00 66.70 67.07 3hb9 h VAL 345 Cb 0.59 0.78 -0.04 0.00 -1.52 0.00 0.00 31.29 31.09 3hb9 h VAL 345 CO 0.02 0.18 -0.27 0.50 0.02 0.00 0.00 177.57 178.01 3hb9 h LYS 346 N 0.48 -0.42 -0.87 1.57 1.63 -1.92 -2.56 116.57 114.47 3hb9 h LYS 346 Ca 0.13 0.03 0.10 0.00 -0.85 0.00 0.00 60.65 60.06 3hb9 h LYS 346 Cb 0.11 0.10 -0.06 0.00 -0.60 0.00 0.00 32.23 31.77 3hb9 h LYS 346 CO -0.02 -0.28 0.57 1.15 -3.45 0.00 0.00 179.45 177.42 3hb9 h THR 347 N -0.44 0.95 -0.41 1.00 2.02 -1.28 -1.96 112.91 112.80 3hb9 h THR 347 Ca 0.05 -0.29 0.08 0.00 0.77 0.00 0.00 66.41 67.03 3hb9 h THR 347 Cb 0.50 0.04 -0.08 0.00 -1.74 0.00 0.00 68.15 66.87 3hb9 h THR 347 CO -0.21 0.15 -0.09 1.56 0.37 0.00 0.00 175.52 177.30 3hb9 h GLN 348 N 0.84 0.01 -0.69 6.66 4.20 -0.86 0.21 115.11 125.47 3hb9 h GLN 348 Ca 0.41 -0.00 -0.05 0.00 0.06 0.00 0.00 58.65 59.06 3hb9 h GLN 348 Cb 0.44 -0.00 -0.03 0.00 0.30 0.00 0.00 27.48 28.19 3hb9 h GLN 348 CO -0.17 0.00 0.22 0.82 -0.67 0.00 0.00 178.83 179.03 3hb9 h ILE 349 N 0.01 1.25 -0.00 2.54 1.08 -1.27 -2.86 117.51 118.26 3hb9 h ILE 349 Ca 0.20 -0.87 -0.09 0.00 -0.39 0.00 0.00 64.86 63.71 3hb9 h ILE 349 Cb 0.30 0.49 -0.01 0.00 -3.07 0.00 0.00 36.82 34.52 3hb9 h ILE 349 CO -0.42 0.34 -0.41 -0.07 -0.69 0.00 0.00 178.15 176.90 3hb9 h LEU 350 N 1.03 0.00 -0.73 1.44 3.38 -0.87 -2.31 115.31 117.25 3hb9 h LEU 350 Ca 0.23 -0.00 -0.14 0.00 0.09 0.00 0.00 57.88 58.06 3hb9 h LEU 350 Cb 0.29 -0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.02 3hb9 h LEU 350 CO -0.01 0.41 -0.61 0.58 0.09 0.00 0.00 178.44 178.90 3hb9 h VAL 351 N 0.00 1.42 0.00 1.22 2.07 -0.79 -2.94 116.25 117.24 3hb9 h VAL 351 Ca -0.00 -2.06 -0.05 0.00 0.82 0.00 0.00 66.70 65.40 3hb9 h VAL 351 Cb 0.73 2.09 -0.01 0.00 -1.52 0.00 0.00 31.29 32.58 3hb9 h VAL 351 CO 0.05 0.60 -0.25 0.00 0.02 0.00 0.00 177.57 177.99 3hb9 h ALA 352 N 1.32 1.30 0.00 1.67 0.00 -1.20 -2.37 119.26 119.96 3hb9 h ALA 352 Ca -0.01 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.68 3hb9 h ALA 352 Cb 1.10 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.85 3hb9 h ALA 352 CO 0.09 0.31 -0.01 0.00 0.00 0.00 0.00 179.25 179.63 3hb9 h ALA 353 N 1.75 0.99 0.00 0.00 0.00 -1.45 -3.48 119.26 117.07 3hb9 h ALA 353 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3hb9 h ALA 353 Cb 0.55 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.34 3hb9 h ALA 353 CO 0.03 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.69 3hb9 n GLY 354 N 1.28 1.58 3.83 0.00 0.00 -0.89 -4.44 105.19 106.55 3hb9 n GLY 354 Ca 0.05 -0.18 -0.36 0.00 0.00 0.00 0.00 46.02 45.53 3hb9 n GLY 354 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hb9 s ALA 355 N -2.00 3.51 0.40 4.61 0.00 -1.12 -4.94 121.76 122.23 3hb9 s ALA 355 Ca 0.00 0.01 -0.25 0.00 0.00 0.00 0.00 51.96 51.72 3hb9 s ALA 355 Cb 0.00 -2.66 -0.08 0.00 0.00 0.00 0.00 23.12 20.38 3hb9 s ALA 355 CO 0.00 0.40 1.15 0.34 0.00 0.00 0.00 175.76 177.65 3hb9 s ASP 356 N -1.62 6.53 0.05 0.00 -1.08 -1.26 -4.66 116.67 114.62 3hb9 s ASP 356 Ca 0.39 2.29 -0.20 0.00 -0.52 0.00 0.00 52.55 54.51 3hb9 s ASP 356 Cb -0.16 -2.61 -0.10 0.00 -1.46 0.00 0.00 42.92 38.59 3hb9 s ASP 356 CO 0.20 -0.67 1.32 -0.07 0.52 0.00 0.00 175.17 176.47 3hb9 h LEU 357 N 2.56 -0.80 -1.68 -1.34 -0.00 -1.97 -2.82 115.31 109.27 3hb9 h LEU 357 Ca -0.49 0.06 -0.02 0.00 -0.00 0.00 0.00 57.88 57.44 3hb9 h LEU 357 Cb 1.23 0.26 -0.01 0.00 -0.00 0.00 0.00 40.66 42.15 3hb9 h LEU 357 CO 0.62 -0.38 0.02 0.49 -0.00 0.00 0.00 178.44 179.20 3hb9 n PHE 357 N -4.12 0.17 -1.99 1.13 3.01 -1.26 -3.36 117.46 111.04 3hb9 n PHE 357 Ca -0.07 -0.33 -0.29 0.00 1.01 0.00 0.00 57.45 57.76 3hb9 n PHE 357 Cb 0.26 -0.22 0.19 0.00 -0.01 0.00 0.00 39.48 39.71 3hb9 n PHE 357 CO 0.00 0.00 0.00 0.20 1.01 0.00 0.00 176.76 177.97 3hb9 s GLY 357 N 0.43 1.81 0.00 1.37 0.00 -1.06 -4.80 107.32 105.06 3hb9 s GLY 357 Ca 0.04 -1.33 0.22 0.00 0.00 0.00 0.00 44.72 43.65 3hb9 s GLY 357 CO 0.01 -0.53 1.70 -2.21 0.00 0.00 0.00 173.10 172.07 3hb9 n GLU 358 N -3.76 0.01 -0.10 2.90 2.13 -1.26 -1.84 120.64 118.73 3hb9 n GLU 358 Ca 0.16 0.12 -0.11 0.00 0.66 0.00 0.00 57.16 57.99 3hb9 n GLU 358 Cb 0.59 -1.50 -0.15 0.00 0.27 0.00 0.00 31.44 30.65 3hb9 n GLU 358 CO 0.00 0.00 0.00 -1.91 -0.41 0.00 0.00 177.13 174.81 3hb9 n GLU 359 N -1.49 0.68 -0.09 5.31 2.13 -1.26 -4.49 120.64 121.43 3hb9 n GLU 359 Ca 0.06 0.05 -0.12 0.00 0.66 0.00 0.00 57.16 57.81 3hb9 n GLU 359 Cb 0.25 -1.55 -0.15 0.00 0.27 0.00 0.00 31.44 30.26 3hb9 n GLU 359 CO 0.00 0.00 0.00 -0.89 -0.41 0.00 0.00 177.13 175.83 3hb9 n ILE 360 N -2.88 1.45 -2.36 6.31 5.41 -1.24 -5.00 119.36 121.05 3hb9 n ILE 360 Ca -0.34 -0.79 -0.19 0.00 1.00 0.00 0.00 62.75 62.44 3hb9 n ILE 360 Cb 1.12 -0.76 -0.01 0.00 -0.71 0.00 0.00 39.64 39.27 3hb9 n ILE 360 CO 0.00 0.00 0.00 0.59 0.00 0.00 0.00 176.55 177.14 3hb9 n ASN 361 N -2.91 -5.36 -4.69 4.38 4.13 -0.77 -4.94 115.26 105.10 3hb9 n ASN 361 Ca -0.34 0.06 -0.42 0.00 1.68 0.00 0.00 54.58 55.57 3hb9 n ASN 361 Cb 1.11 -4.50 -0.03 0.00 -1.54 0.00 0.00 39.78 34.82 3hb9 n ASN 361 CO 0.00 0.00 0.00 -0.32 0.28 0.00 0.00 177.26 177.22 3hb9 s MET 362 N -4.96 4.21 0.82 3.52 1.75 -1.21 -5.00 119.30 118.43 3hb9 s MET 362 Ca 0.00 2.27 -0.11 0.00 -1.25 0.00 0.00 55.69 56.61 3hb9 s MET 362 Cb 0.00 -3.56 0.09 0.00 2.84 0.00 0.00 34.83 34.20 3hb9 s MET 362 CO 0.00 -0.70 1.10 -2.14 -0.65 0.00 0.00 175.02 172.63 3hb9 s PRO 362 N 2.48 1.84 1.03 4.11 0.02 -1.26 -4.31 135.00 138.91 3hb9 s PRO 362 Ca 0.72 1.19 -0.12 0.00 0.02 0.00 0.00 61.00 62.80 3hb9 s PRO 362 Cb -0.39 -1.85 0.20 0.00 0.02 0.00 0.00 34.50 32.49 3hb9 s PRO 362 CO 0.31 -1.94 1.08 -0.65 -0.33 0.00 0.00 177.00 175.47 3hb9 s GLN 363 N -4.85 0.20 0.25 5.54 -1.52 -1.26 -4.69 119.66 113.32 3hb9 s GLN 363 Ca 0.63 0.67 -0.04 0.00 -1.95 0.00 0.00 55.36 54.67 3hb9 s GLN 363 Cb -0.18 -1.70 0.39 0.00 -0.22 0.00 0.00 33.01 31.30 3hb9 s GLN 363 CO 0.57 -2.93 1.85 0.37 -0.25 0.00 0.00 175.29 174.90 3hb9 h GLN 364 N -2.04 0.98 -0.28 2.91 5.75 -1.96 0.93 115.11 121.40 3hb9 h GLN 364 Ca -0.55 -0.06 0.00 0.00 -0.15 0.00 0.00 58.65 57.89 3hb9 h GLN 364 Cb 1.32 -0.22 0.00 0.00 1.07 0.00 0.00 27.48 29.65 3hb9 h GLN 364 CO 0.55 0.65 0.00 0.36 -2.65 0.00 0.00 178.83 177.73 3hb9 n LYS 365 N -4.60 1.90 -0.01 1.69 0.00 -1.26 -3.73 118.16 112.14 3hb9 n LYS 365 Ca 0.14 -1.37 0.11 0.00 -0.00 0.00 0.00 58.31 57.19 3hb9 n LYS 365 Cb 0.22 -1.38 -0.17 0.00 -0.00 0.00 0.00 35.03 33.70 3hb9 n LYS 365 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.40 177.15 3hb9 n ASP 366 N 0.60 0.12 -4.61 -5.58 9.92 0.23 -4.88 116.55 112.35 3hb9 n ASP 366 Ca 0.16 -0.05 -0.43 0.00 -0.53 0.00 0.00 54.79 53.94 3hb9 n ASP 366 Cb 0.37 1.94 -0.03 0.00 -0.64 0.00 0.00 41.12 42.75 3hb9 n ASP 366 CO 0.00 0.00 0.00 -0.63 0.13 0.00 0.00 177.20 176.70 3hb9 s ILE 367 N -3.47 4.56 0.09 0.53 1.01 -0.65 -4.84 121.20 118.43 3hb9 s ILE 367 Ca -0.07 1.23 0.01 0.00 0.00 0.00 0.00 60.65 61.82 3hb9 s ILE 367 Cb 0.14 -4.36 -0.04 0.00 0.01 0.00 0.00 42.46 38.21 3hb9 s ILE 367 CO 0.90 -0.56 -0.06 0.42 0.00 0.00 0.00 174.94 175.63 3hb9 s THR 368 N 3.54 0.64 0.13 2.92 -4.23 -1.26 -5.02 115.64 112.36 3hb9 s THR 368 Ca 0.39 -1.89 -0.22 0.00 -1.18 0.00 0.00 61.69 58.79 3hb9 s THR 368 Cb -0.12 -1.62 -0.07 0.00 1.34 0.00 0.00 72.50 72.02 3hb9 s THR 368 CO 0.19 -0.87 0.68 0.42 -0.54 0.00 0.00 174.62 174.51 3hb9 s THR 369 N -3.57 4.54 -0.26 3.99 -4.23 -1.26 -4.48 115.64 110.37 3hb9 s THR 369 Ca 0.10 1.48 -0.05 0.00 -1.18 0.00 0.00 61.69 62.04 3hb9 s THR 369 Cb 0.05 -4.02 0.00 0.00 1.34 0.00 0.00 72.50 69.87 3hb9 s THR 369 CO -0.05 0.53 0.02 -0.22 -0.54 0.00 0.00 174.62 174.36 3hb9 s LEU 370 N -1.15 3.43 0.00 4.79 2.96 0.11 -5.00 118.68 123.81 3hb9 s LEU 370 Ca 0.33 -0.61 0.00 0.00 -0.22 0.00 0.00 54.13 53.63 3hb9 s LEU 370 Cb -0.21 -1.80 0.00 0.00 0.50 0.00 0.00 46.19 44.67 3hb9 s LEU 370 CO 0.23 -0.12 0.00 0.61 -1.32 0.00 0.00 176.35 175.75 3hb9 n GLY 371 N 4.81 0.92 3.33 7.98 0.00 -1.26 -4.53 105.19 116.44 3hb9 n GLY 371 Ca -0.16 -0.65 -0.17 0.00 0.00 0.00 0.00 46.02 45.03 3hb9 n GLY 371 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3hb9 s TYR 372 N 0.00 1.58 -0.02 1.61 1.51 0.68 -4.50 117.35 118.22 3hb9 s TYR 372 Ca 0.00 -0.76 -0.06 0.00 -1.01 0.00 0.00 57.07 55.25 3hb9 s TYR 372 Cb 0.00 -0.85 0.00 0.00 -0.11 0.00 0.00 41.96 41.01 3hb9 s TYR 372 CO 0.00 0.14 0.12 0.00 -1.11 0.00 0.00 175.55 174.71 3hb9 s ALA 373 N -3.22 -0.30 -0.02 3.71 0.00 0.14 -2.38 121.76 119.70 3hb9 s ALA 373 Ca 0.24 0.02 0.02 0.00 0.00 0.00 0.00 51.96 52.24 3hb9 s ALA 373 Cb 0.03 -0.01 0.01 0.00 0.00 0.00 0.00 23.12 23.14 3hb9 s ALA 373 CO 0.07 -0.15 -0.05 0.42 0.00 0.00 0.00 175.76 176.04 3hb9 s ILE 374 N -0.86 0.48 0.00 0.00 1.01 -0.59 -1.09 121.20 120.15 3hb9 s ILE 374 Ca -0.09 -0.20 0.07 0.00 0.00 0.00 0.00 60.65 60.42 3hb9 s ILE 374 Cb -0.05 -0.44 -0.03 0.00 0.01 0.00 0.00 42.46 41.94 3hb9 s ILE 374 CO 0.01 0.16 -0.21 -1.58 0.00 0.00 0.00 174.94 173.32 3hb9 s GLN 375 N 0.24 2.14 -0.04 2.79 0.74 -1.03 -1.14 119.66 123.35 3hb9 s GLN 375 Ca -0.03 -0.92 0.02 0.00 0.05 0.00 0.00 55.36 54.48 3hb9 s GLN 375 Cb -0.07 -2.15 0.01 0.00 1.10 0.00 0.00 33.01 31.90 3hb9 s GLN 375 CO -0.00 0.56 -0.09 0.00 -0.55 0.00 0.00 175.29 175.21 3hb9 s ARG 377 N 0.53 4.36 -0.82 0.00 0.52 -1.26 -1.72 118.95 120.55 3hb9 s ARG 377 Ca -0.09 0.54 -0.14 0.00 -0.52 0.00 0.00 55.73 55.52 3hb9 s ARG 377 Cb -0.13 -3.43 0.22 0.00 0.52 0.00 0.00 34.95 32.13 3hb9 s ARG 377 CO 0.01 0.15 0.77 0.42 0.02 0.00 0.00 175.30 176.67 3hb9 s ILE 378 N 0.62 5.59 0.00 1.52 -1.09 -0.83 -4.99 121.20 122.03 3hb9 s ILE 378 Ca 0.28 -2.44 0.00 0.00 -2.23 0.00 0.00 60.65 56.27 3hb9 s ILE 378 Cb -0.16 -4.47 0.00 0.00 -1.58 0.00 0.00 42.46 36.25 3hb9 s ILE 378 CO 0.12 -1.03 0.00 0.35 -1.23 0.00 0.00 174.94 173.15 3hb9 n THR 379 N 4.02 0.00 -2.05 2.92 -2.24 -1.26 0.56 114.28 116.24 3hb9 n THR 379 Ca 0.13 0.00 -0.30 0.00 -2.27 0.00 0.00 64.05 61.61 3hb9 n THR 379 Cb 0.47 -1.19 0.03 0.00 -2.10 0.00 0.00 70.33 67.53 3hb9 n THR 379 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 3hb9 n THR 380 N -0.80 2.87 -4.17 4.28 -2.24 -1.18 -3.91 114.28 109.12 3hb9 n THR 380 Ca 0.00 -4.28 -0.31 0.00 -2.27 0.00 0.00 64.05 57.19 3hb9 n THR 380 Cb 0.00 -1.21 -0.08 0.00 -2.10 0.00 0.00 70.33 66.94 3hb9 n THR 380 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 3hb9 s GLU 381 N -3.71 2.60 -0.12 -0.78 2.02 -1.26 -3.76 118.70 113.69 3hb9 s GLU 381 Ca 0.52 -0.78 -0.23 0.00 0.02 0.00 0.00 54.97 54.50 3hb9 s GLU 381 Cb 0.43 -2.57 0.06 0.00 0.10 0.00 0.00 34.13 32.15 3hb9 s GLU 381 CO -0.14 0.56 0.57 0.16 0.02 0.00 0.00 175.26 176.43 3hb9 s ASP 382 N -2.12 -0.55 0.00 -0.19 -4.77 -1.26 -1.23 116.67 106.55 3hb9 s ASP 382 Ca 0.24 0.82 0.11 0.00 -3.30 0.00 0.00 52.55 50.42 3hb9 s ASP 382 Cb -0.12 0.81 0.58 0.00 -1.09 0.00 0.00 42.92 43.10 3hb9 s ASP 382 CO 0.16 -0.39 1.17 -0.81 0.70 0.00 0.00 175.17 176.01 3hb9 n PRO 383 N 1.85 0.23 0.08 2.11 -0.04 -1.26 0.05 135.00 138.01 3hb9 n PRO 383 Ca -0.17 0.11 -0.15 0.00 -0.04 0.00 0.00 63.50 63.25 3hb9 n PRO 383 Cb 0.56 -1.50 -0.14 0.00 -0.04 0.00 0.00 33.50 32.38 3hb9 n PRO 383 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 3hb9 h LEU 384 N 0.00 0.34 -3.13 1.53 -0.00 -1.99 -3.28 115.31 108.78 3hb9 h LEU 384 Ca 0.00 -0.42 0.00 0.00 -0.00 0.00 0.00 57.88 57.46 3hb9 h LEU 384 Cb 0.06 -0.11 0.00 0.00 -0.00 0.00 0.00 40.66 40.61 3hb9 h LEU 384 CO 0.00 1.34 0.00 0.59 -0.00 0.00 0.00 178.44 180.37 3hb9 n ASN 385 N -3.46 4.03 -3.65 -0.43 5.03 -0.84 -5.00 115.26 110.93 3hb9 n ASN 385 Ca -0.11 -2.54 -0.28 0.00 0.87 0.00 0.00 54.58 52.52 3hb9 n ASN 385 Cb 1.02 -0.48 0.03 0.00 -1.02 0.00 0.00 39.78 39.34 3hb9 n ASN 385 CO 0.00 0.00 0.00 0.47 -1.83 0.00 0.00 177.26 175.90 3hb9 n ASP 386 N 0.40 -5.48 -3.49 6.41 8.00 -0.19 -3.68 116.55 118.51 3hb9 n ASP 386 Ca 0.21 -0.92 -0.19 0.00 0.71 0.00 0.00 54.79 54.59 3hb9 n ASP 386 Cb 0.78 -3.23 0.08 0.00 -0.02 0.00 0.00 41.12 38.73 3hb9 n ASP 386 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 3hb9 n PHE 387 N -3.75 -2.35 -5.10 1.24 3.72 0.11 -4.90 117.46 106.42 3hb9 n PHE 387 Ca -0.11 0.95 -0.29 0.00 -0.05 0.00 0.00 57.45 57.95 3hb9 n PHE 387 Cb 0.59 -5.03 -0.16 0.00 -0.94 0.00 0.00 39.48 33.94 3hb9 n PHE 387 CO 0.00 0.00 0.00 -1.64 -0.05 0.00 0.00 176.76 175.07 3hb9 s MET 388 N -5.65 1.95 0.84 -1.08 -1.94 -1.24 -4.75 119.30 107.44 3hb9 s MET 388 Ca 0.16 -0.79 -0.11 0.00 -1.71 0.00 0.00 55.69 53.23 3hb9 s MET 388 Cb -0.07 -1.81 0.10 0.00 2.01 0.00 0.00 34.83 35.06 3hb9 s MET 388 CO 0.74 0.43 1.10 -2.14 -0.01 0.00 0.00 175.02 175.14 3hb9 s PRO 389 N -0.38 1.66 0.11 2.03 0.02 -1.25 -4.44 135.00 132.75 3hb9 s PRO 389 Ca 0.05 1.15 0.04 0.00 0.02 0.00 0.00 61.00 62.25 3hb9 s PRO 389 Cb -0.10 -1.83 -0.04 0.00 0.02 0.00 0.00 34.50 32.55 3hb9 s PRO 389 CO 0.00 -2.06 -0.11 -0.51 -0.33 0.00 0.00 177.00 174.00 3hb9 s ASP 390 N -3.23 1.57 -0.02 2.53 -0.00 -1.26 -5.04 116.67 111.22 3hb9 s ASP 390 Ca 0.63 -0.84 -0.03 0.00 -0.00 0.00 0.00 52.55 52.31 3hb9 s ASP 390 Cb -0.19 -0.00 -0.04 0.00 -0.00 0.00 0.00 42.92 42.69 3hb9 s ASP 390 CO 0.57 -0.26 0.18 -0.89 -0.00 0.00 0.00 175.17 174.77 3hb9 s THR 391 N -2.53 5.44 0.00 -1.27 2.01 -1.26 -4.87 115.64 113.15 3hb9 s THR 391 Ca 0.07 -0.13 0.00 0.00 0.31 0.00 0.00 61.69 61.95 3hb9 s THR 391 Cb -0.02 -3.53 0.00 0.00 0.01 0.00 0.00 72.50 68.96 3hb9 s THR 391 CO 0.00 0.35 0.00 0.61 -0.69 0.00 0.00 174.62 174.90 3hb9 n GLY 392 N 1.04 3.78 3.72 4.40 0.00 -1.26 -4.96 105.19 111.90 3hb9 n GLY 392 Ca -0.12 -1.04 -0.42 0.00 0.00 0.00 0.00 46.02 44.45 3hb9 n GLY 392 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3hb9 s THR 393 N -2.00 4.10 -1.27 2.61 -4.23 -1.26 -3.30 115.64 110.29 3hb9 s THR 393 Ca 0.00 1.60 -0.19 0.00 -1.18 0.00 0.00 61.69 61.92 3hb9 s THR 393 Cb 0.00 -4.02 0.05 0.00 1.34 0.00 0.00 72.50 69.86 3hb9 s THR 393 CO 0.00 0.17 1.76 -0.63 -0.54 0.00 0.00 174.62 175.38 3hb9 s ILE 394 N 0.62 4.02 0.26 2.99 1.01 -1.25 -4.48 121.20 124.38 3hb9 s ILE 394 Ca 0.55 -1.71 -0.02 0.00 0.00 0.00 0.00 60.65 59.47 3hb9 s ILE 394 Cb -0.28 -5.10 0.26 0.00 0.01 0.00 0.00 42.46 37.35 3hb9 s ILE 394 CO 0.31 -1.87 1.68 0.16 0.00 0.00 0.00 174.94 175.22 3hb9 h ILE 395 N 5.72 0.47 -3.37 2.92 3.07 -1.75 -3.05 117.51 121.52 3hb9 h ILE 395 Ca 0.40 -0.10 -0.43 0.00 1.55 0.00 0.00 64.86 66.28 3hb9 h ILE 395 Cb 0.89 0.15 -0.35 0.00 -0.27 0.00 0.00 36.82 37.23 3hb9 h ILE 395 CO 1.42 0.05 -0.77 0.00 -1.05 0.00 0.00 178.15 177.80 3hb9 s ALA 396 N -5.99 0.73 -0.22 0.16 0.00 -1.21 -4.21 121.76 111.02 3hb9 s ALA 396 Ca -0.12 -0.11 0.01 0.00 0.00 0.00 0.00 51.96 51.73 3hb9 s ALA 396 Cb 0.23 -0.56 0.03 0.00 0.00 0.00 0.00 23.12 22.82 3hb9 s ALA 396 CO 0.77 -0.19 -0.14 -0.47 0.00 0.00 0.00 175.76 175.73 3hb9 s TYR 397 N 1.32 2.98 -0.25 0.00 6.14 -1.26 -1.43 117.35 124.86 3hb9 s TYR 397 Ca -0.05 -1.78 0.01 0.00 0.64 0.00 0.00 57.07 55.90 3hb9 s TYR 397 Cb -0.13 -1.96 0.04 0.00 0.42 0.00 0.00 41.96 40.33 3hb9 s TYR 397 CO -0.02 -0.80 -0.10 1.03 0.64 0.00 0.00 175.55 176.29 3hb9 s ARG 398 N 1.26 2.56 0.32 4.97 0.52 -1.26 -4.98 118.95 122.33 3hb9 s ARG 398 Ca 0.00 -1.14 0.08 0.00 -0.52 0.00 0.00 55.73 54.15 3hb9 s ARG 398 Cb -0.16 -2.88 -0.04 0.00 0.52 0.00 0.00 34.95 32.40 3hb9 s ARG 398 CO -0.09 -0.46 0.19 0.45 0.02 0.00 0.00 175.30 175.42 3hb9 s SER 399 N 1.21 5.03 0.00 0.23 0.15 -1.26 -4.02 113.70 115.04 3hb9 s SER 399 Ca -0.03 -0.57 0.00 0.00 0.70 0.00 0.00 55.95 56.05 3hb9 s SER 399 Cb -0.18 -0.94 0.00 0.00 -1.71 0.00 0.00 66.02 63.19 3hb9 s SER 399 CO -0.06 -0.25 0.00 -0.24 1.20 0.00 0.00 173.24 173.89 3hb9 n SER 400 N -1.21 0.00 0.00 5.45 2.88 -1.26 -4.91 113.62 114.57 3hb9 n SER 400 Ca -0.04 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.50 3hb9 n SER 400 Cb 0.60 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.06 3hb9 n SER 400 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3hb9 n GLY 401 N 4.50 -1.14 0.73 0.46 0.00 -1.26 -5.14 105.19 103.33 3hb9 n GLY 401 Ca 0.00 -2.10 0.00 0.00 0.00 0.00 0.00 46.02 43.92 3hb9 n GLY 401 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hb9 n GLY 402 N 0.00 -1.76 3.75 -0.02 0.00 -1.26 -4.70 105.19 101.20 3hb9 n GLY 402 Ca 0.00 -1.98 -0.41 0.00 0.00 0.00 0.00 46.02 43.64 3hb9 n GLY 402 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 3hb9 s PHE 403 N 0.00 3.47 0.00 1.61 2.19 -1.26 -3.73 117.98 120.27 3hb9 s PHE 403 Ca 0.00 1.57 0.00 0.00 0.33 0.00 0.00 56.93 58.83 3hb9 s PHE 403 Cb 0.00 -3.37 0.00 0.00 -1.31 0.00 0.00 43.02 38.34 3hb9 s PHE 403 CO 0.00 -0.90 0.00 0.41 1.83 0.00 0.00 175.22 176.56 3hb9 n GLY 404 N 1.52 1.14 3.67 13.12 0.00 -1.26 -4.89 105.19 118.49 3hb9 n GLY 404 Ca 0.01 -0.01 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 3hb9 n GLY 404 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3hb9 s VAL 405 N -0.01 3.85 -0.13 1.61 1.01 -1.24 -1.80 120.40 123.68 3hb9 s VAL 405 Ca 0.00 1.11 -0.01 0.00 0.00 0.00 0.00 61.98 63.08 3hb9 s VAL 405 Cb 0.00 -3.71 -0.02 0.00 0.00 0.00 0.00 36.38 32.65 3hb9 s VAL 405 CO 0.00 -0.06 -0.11 -0.60 0.00 0.00 0.00 175.10 174.33 3hb9 s ARG 406 N 3.26 3.41 -0.33 2.72 6.06 0.21 -4.56 118.95 129.72 3hb9 s ARG 406 Ca 0.64 -0.64 0.03 0.00 -2.50 0.00 0.00 55.73 53.26 3hb9 s ARG 406 Cb -0.29 -2.69 0.10 0.00 0.06 0.00 0.00 34.95 32.13 3hb9 s ARG 406 CO 0.24 0.24 0.06 -0.51 -2.50 0.00 0.00 175.30 172.83 3hb9 s LEU 407 N 0.29 4.23 -1.05 -0.88 1.43 -1.26 -2.00 118.68 119.43 3hb9 s LEU 407 Ca -0.08 -2.05 -0.09 0.00 -1.03 0.00 0.00 54.13 50.88 3hb9 s LEU 407 Cb -0.15 -1.47 0.27 0.00 0.03 0.00 0.00 46.19 44.87 3hb9 s LEU 407 CO 0.05 -0.39 1.03 -1.81 0.23 0.00 0.00 176.35 175.47 3hb9 s ASP 408 N 1.05 7.13 0.87 2.29 1.01 -1.23 -4.98 116.67 122.81 3hb9 s ASP 408 Ca 0.11 -3.49 -0.12 0.00 0.71 0.00 0.00 52.55 49.76 3hb9 s ASP 408 Cb -0.19 -2.18 0.15 0.00 1.01 0.00 0.00 42.92 41.71 3hb9 s ASP 408 CO -0.12 -0.32 1.21 0.00 0.21 0.00 0.00 175.17 176.16 3hb9 s ALA 409 N -1.08 2.64 0.00 5.23 0.00 -1.26 -2.36 121.76 124.93 3hb9 s ALA 409 Ca 0.29 -1.13 0.00 0.00 0.00 0.00 0.00 51.96 51.12 3hb9 s ALA 409 Cb -0.10 -2.68 0.00 0.00 0.00 0.00 0.00 23.12 20.34 3hb9 s ALA 409 CO -0.08 -2.01 0.00 0.41 0.00 0.00 0.00 175.76 174.07 3hb9 n GLY 410 N -3.44 -0.65 0.00 0.00 0.00 -0.31 -4.28 105.19 96.49 3hb9 n GLY 410 Ca 0.13 0.53 0.00 0.00 0.00 0.00 0.00 46.02 46.68 3hb9 n GLY 410 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 3hb9 n ASP 411 N 0.00 0.00 -4.62 1.61 -0.08 -1.21 -3.32 116.55 108.92 3hb9 n ASP 411 Ca 0.00 0.00 -0.37 0.00 -1.51 0.00 0.00 54.79 52.91 3hb9 n ASP 411 Cb 0.00 0.00 -0.10 0.00 2.34 0.00 0.00 41.12 43.36 3hb9 n ASP 411 CO 0.00 0.00 0.00 -0.83 0.12 0.00 0.00 177.20 176.49 3hb9 s GLY 412 N 0.00 1.95 0.00 0.27 0.00 -1.25 -4.92 107.32 103.36 3hb9 s GLY 412 Ca 0.00 -0.93 0.00 0.00 0.00 0.00 0.00 44.72 43.79 3hb9 s GLY 412 CO 0.00 0.42 0.00 1.97 0.00 0.00 0.00 173.10 175.49 3hb9 n PHE 413 N 4.40 0.00 -0.32 1.90 1.16 -1.26 -5.01 117.46 118.32 3hb9 n PHE 413 Ca -0.15 0.00 0.18 0.00 -1.87 0.00 0.00 57.45 55.61 3hb9 n PHE 413 Cb 0.52 0.00 0.37 0.00 -1.61 0.00 0.00 39.48 38.76 3hb9 n PHE 413 CO 0.00 0.00 0.00 -0.56 -1.87 0.00 0.00 176.76 174.33 3hb9 h GLN 414 N 0.00 0.10 0.00 3.97 3.07 -1.94 -3.38 115.11 116.93 3hb9 h GLN 414 Ca 0.00 -0.01 0.00 0.00 0.09 0.00 0.00 58.65 58.73 3hb9 h GLN 414 Cb 0.00 -0.02 0.00 0.00 0.08 0.00 0.00 27.48 27.54 3hb9 h GLN 414 CO 0.00 0.07 0.00 0.41 0.09 0.00 0.00 178.83 179.40 3hb9 n GLY 415 N -1.39 -0.77 3.55 0.06 0.00 -1.15 -4.49 105.19 101.00 3hb9 n GLY 415 Ca 0.26 0.13 -0.32 0.00 0.00 0.00 0.00 46.02 46.09 3hb9 n GLY 415 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hb9 s ALA 416 N 0.00 2.87 -0.24 4.61 0.00 -1.26 -4.41 121.76 123.33 3hb9 s ALA 416 Ca 0.00 -1.02 -0.28 0.00 0.00 0.00 0.00 51.96 50.66 3hb9 s ALA 416 Cb 0.00 -1.05 -0.04 0.00 0.00 0.00 0.00 23.12 22.03 3hb9 s ALA 416 CO 0.00 0.59 2.05 -1.83 0.00 0.00 0.00 175.76 176.57 3hb9 s GLU 417 N -1.20 3.26 0.19 0.00 -1.05 -1.26 -3.86 118.70 114.78 3hb9 s GLU 417 Ca 0.15 1.85 -0.30 0.00 -0.15 0.00 0.00 54.97 56.52 3hb9 s GLU 417 Cb -0.11 -4.30 -0.08 0.00 -0.44 0.00 0.00 34.13 29.20 3hb9 s GLU 417 CO 0.05 -1.95 1.20 0.96 0.95 0.00 0.00 175.26 176.46 3hb9 s ILE 418 N 7.60 3.55 0.05 1.83 -4.36 -1.21 -4.94 121.20 123.72 3hb9 s ILE 418 Ca 0.92 1.32 -0.31 0.00 -0.26 0.00 0.00 60.65 62.33 3hb9 s ILE 418 Cb -0.30 -3.84 -0.06 0.00 1.25 0.00 0.00 42.46 39.51 3hb9 s ILE 418 CO 0.35 0.22 1.35 -0.94 0.24 0.00 0.00 174.94 176.15 3hb9 s SER 419 N 0.09 6.90 -1.22 4.36 1.04 -1.26 -4.41 113.70 119.19 3hb9 s SER 419 Ca 0.52 2.15 -0.08 0.00 0.48 0.00 0.00 55.95 59.02 3hb9 s SER 419 Cb -0.33 -2.57 0.21 0.00 0.10 0.00 0.00 66.02 63.43 3hb9 s SER 419 CO 0.37 -0.64 1.76 -0.81 0.98 0.00 0.00 173.24 174.89 3hb9 n PRO 420 N 4.64 3.87 0.13 4.02 -0.04 -1.26 -4.48 135.00 141.89 3hb9 n PRO 420 Ca 0.12 -3.83 0.00 0.00 -0.04 0.00 0.00 63.50 59.75 3hb9 n PRO 420 Cb 0.44 -2.80 0.00 0.00 -0.04 0.00 0.00 33.50 31.09 3hb9 n PRO 420 CO 0.00 0.00 0.00 0.98 -0.04 0.00 0.00 175.50 176.44 3hb9 n TYR 421 N 3.13 -2.32 -2.93 0.54 9.36 -1.26 -5.11 117.16 118.57 3hb9 n TYR 421 Ca 0.36 0.41 -0.20 0.00 3.32 0.00 0.00 57.90 61.79 3hb9 n TYR 421 Cb 0.35 0.57 0.08 0.00 -0.63 0.00 0.00 39.34 39.71 3hb9 n TYR 421 CO 0.00 0.00 0.00 2.48 0.22 0.00 0.00 176.86 179.56 3hb9 n TYR 422 N -3.41 -2.47 -1.63 2.98 0.18 -1.26 -5.04 117.16 106.51 3hb9 n TYR 422 Ca 0.00 -1.98 -0.50 0.00 1.88 0.00 0.00 57.90 57.30 3hb9 n TYR 422 Cb 0.00 -0.58 -0.05 0.00 -0.38 0.00 0.00 39.34 38.33 3hb9 n TYR 422 CO 0.00 0.00 0.00 -0.25 -2.08 0.00 0.00 176.86 174.53 3hb9 n ASP 423 N -2.49 2.32 -3.43 9.48 10.43 -1.26 -4.90 116.55 126.69 3hb9 n ASP 423 Ca 0.16 1.10 -0.39 0.00 2.57 0.00 0.00 54.79 58.23 3hb9 n ASP 423 Cb 0.58 -1.29 0.02 0.00 1.84 0.00 0.00 41.12 42.27 3hb9 n ASP 423 CO 0.00 0.00 0.00 -1.54 -1.07 0.00 0.00 177.20 174.59 3hb9 n SER 424 N 3.19 7.04 -4.71 -2.24 3.41 -1.26 -5.00 113.62 114.05 3hb9 n SER 424 Ca 0.18 -3.71 -0.42 0.00 -0.26 0.00 0.00 58.87 54.66 3hb9 n SER 424 Cb 0.23 -1.08 -0.03 0.00 -0.26 0.00 0.00 64.21 63.07 3hb9 n SER 424 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 3hb9 s LEU 425 N -4.19 4.36 -0.23 1.04 0.20 -1.26 -3.11 118.68 115.48 3hb9 s LEU 425 Ca 0.42 1.68 -0.09 0.00 0.69 0.00 0.00 54.13 56.83 3hb9 s LEU 425 Cb 0.24 -3.57 -0.11 0.00 -0.43 0.00 0.00 46.19 42.32 3hb9 s LEU 425 CO -0.18 -0.29 -0.28 0.18 -0.29 0.00 0.00 176.35 175.49 3hb9 n LEU 426 N 4.01 1.87 -3.86 -0.68 4.77 0.19 -4.42 117.00 118.87 3hb9 n LEU 426 Ca 0.07 0.21 -0.12 0.00 -0.03 0.00 0.00 56.01 56.14 3hb9 n LEU 426 Cb 0.50 -0.70 -0.13 0.00 -2.33 0.00 0.00 43.42 40.76 3hb9 n LEU 426 CO 0.52 0.55 -0.32 -0.69 -1.33 0.00 0.00 177.39 176.12 3hb9 s VAL 427 N -2.43 0.01 -1.08 4.08 1.01 -1.23 -1.17 120.40 119.59 3hb9 s VAL 427 Ca -0.32 -0.05 -0.14 0.00 0.00 0.00 0.00 61.98 61.48 3hb9 s VAL 427 Cb 0.12 -0.07 0.19 0.00 0.00 0.00 0.00 36.38 36.61 3hb9 s VAL 427 CO 0.42 -0.03 1.23 -0.54 0.00 0.00 0.00 175.10 176.19 3hb9 s LYS 428 N -0.06 3.95 -0.32 2.72 1.02 -0.99 -1.97 119.74 124.09 3hb9 s LYS 428 Ca -0.01 -2.50 -0.29 0.00 0.02 0.00 0.00 55.97 53.19 3hb9 s LYS 428 Cb -0.01 -4.86 -0.00 0.00 -0.52 0.00 0.00 37.83 32.44 3hb9 s LYS 428 CO 0.00 -1.61 1.41 -1.17 -0.92 0.00 0.00 175.35 173.05 3hb9 s LEU 429 N 1.12 3.79 -0.22 3.17 2.96 -0.70 -3.48 118.68 125.33 3hb9 s LEU 429 Ca 0.35 1.19 -0.03 0.00 -0.22 0.00 0.00 54.13 55.43 3hb9 s LEU 429 Cb -0.05 -3.54 0.07 0.00 0.50 0.00 0.00 46.19 43.17 3hb9 s LEU 429 CO -0.05 -1.23 0.05 -0.44 -1.32 0.00 0.00 176.35 173.36 3hb9 s SER 430 N 3.48 3.11 0.18 3.68 0.01 -0.85 0.21 113.70 123.53 3hb9 s SER 430 Ca 0.61 -0.96 -0.01 0.00 1.31 0.00 0.00 55.95 56.89 3hb9 s SER 430 Cb -0.18 -0.62 -0.04 0.00 0.21 0.00 0.00 66.02 65.39 3hb9 s SER 430 CO 0.27 -0.33 0.38 0.42 0.41 0.00 0.00 173.24 174.39 3hb9 s THR 431 N 1.84 5.21 -0.16 1.44 -4.23 -0.29 0.66 115.64 120.10 3hb9 s THR 431 Ca 0.01 -0.30 -0.10 0.00 -1.18 0.00 0.00 61.69 60.12 3hb9 s THR 431 Cb -0.17 -3.71 0.05 0.00 1.34 0.00 0.00 72.50 70.02 3hb9 s THR 431 CO -0.12 -0.11 0.40 -2.28 -0.54 0.00 0.00 174.62 171.97 3hb9 s HIS 432 N -1.81 -0.56 0.31 3.99 5.65 -0.75 -1.54 115.29 120.58 3hb9 s HIS 432 Ca 0.39 1.23 -0.15 0.00 0.25 0.00 0.00 55.06 56.77 3hb9 s HIS 432 Cb -0.11 0.23 0.02 0.00 -1.18 0.00 0.00 32.58 31.54 3hb9 s HIS 432 CO 0.28 -0.31 0.64 0.00 -0.65 0.00 0.00 174.74 174.70 3hb9 s ALA 433 N 1.17 -0.57 0.04 1.58 0.00 -1.00 -4.30 121.76 118.68 3hb9 s ALA 433 Ca -0.08 -0.74 -0.19 0.00 0.00 0.00 0.00 51.96 50.95 3hb9 s ALA 433 Cb -0.07 0.90 -0.17 0.00 0.00 0.00 0.00 23.12 23.78 3hb9 s ALA 433 CO -0.10 -0.94 1.26 -0.84 0.00 0.00 0.00 175.76 175.13 3hb9 h ILE 434 N 2.08 1.37 -3.37 0.00 3.07 -1.90 0.19 117.51 118.96 3hb9 h ILE 434 Ca -0.26 -1.67 -0.56 0.00 1.55 0.00 0.00 64.86 63.92 3hb9 h ILE 434 Cb 1.25 2.11 -0.05 0.00 -0.27 0.00 0.00 36.82 39.86 3hb9 h ILE 434 CO 0.33 0.50 0.12 -0.55 -1.05 0.00 0.00 178.15 177.50 3hb9 s SER 435 N -6.49 7.05 0.31 2.16 0.15 -1.26 -4.00 113.70 111.61 3hb9 s SER 435 Ca -0.13 1.26 0.00 0.00 0.70 0.00 0.00 55.95 57.78 3hb9 s SER 435 Cb 0.05 -2.43 0.48 0.00 -1.71 0.00 0.00 66.02 62.41 3hb9 s SER 435 CO 0.80 -0.12 1.89 0.15 1.20 0.00 0.00 173.24 177.16 3hb9 h PHE 436 N 6.66 0.82 -0.36 3.44 3.57 -1.93 -1.05 116.94 128.08 3hb9 h PHE 436 Ca -0.41 -0.05 -0.05 0.00 3.53 0.00 0.00 57.97 61.00 3hb9 h PHE 436 Cb 1.20 -0.25 -0.02 0.00 2.79 0.00 0.00 35.95 39.67 3hb9 h PHE 436 CO 0.65 0.64 0.03 0.87 -2.23 0.00 0.00 178.31 178.27 3hb9 h LYS 437 N 0.80 0.55 -0.06 1.11 1.57 -1.93 -1.66 116.57 116.94 3hb9 h LYS 437 Ca 0.19 -0.11 -0.21 0.00 -1.87 0.00 0.00 60.65 58.65 3hb9 h LYS 437 Cb 0.17 -0.08 0.01 0.00 0.08 0.00 0.00 32.23 32.41 3hb9 h LYS 437 CO -0.02 0.55 -0.80 1.96 -0.57 0.00 0.00 179.45 180.58 3hb9 h GLN 438 N 0.53 0.65 0.00 3.15 4.20 -1.73 -1.58 115.11 120.33 3hb9 h GLN 438 Ca 0.12 -0.62 -0.08 0.00 0.06 0.00 0.00 58.65 58.13 3hb9 h GLN 438 Cb 0.30 0.15 -0.01 0.00 0.30 0.00 0.00 27.48 28.22 3hb9 h GLN 438 CO 0.01 1.22 -0.36 0.00 -0.67 0.00 0.00 178.83 179.03 3hb9 h ALA 439 N 0.44 1.27 -0.13 3.87 0.00 -1.17 0.34 119.26 123.88 3hb9 h ALA 439 Ca -0.08 -0.33 -0.10 0.00 0.00 0.00 0.00 54.91 54.40 3hb9 h ALA 439 Cb 1.45 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.19 3hb9 h ALA 439 CO 0.16 0.45 -0.29 1.49 0.00 0.00 0.00 179.25 181.06 3hb9 h GLU 440 N 0.00 0.44 0.00 0.00 4.81 -1.29 -2.12 114.58 116.41 3hb9 h GLU 440 Ca -0.00 -0.29 0.00 0.00 -0.13 0.00 0.00 59.36 58.94 3hb9 h GLU 440 Cb 0.70 0.04 0.00 0.00 0.63 0.00 0.00 28.75 30.11 3hb9 h GLU 440 CO 0.05 0.90 -0.04 -0.85 -0.73 0.00 0.00 179.01 178.34 3hb9 n GLU 441 N -4.40 0.13 0.10 1.92 0.28 -0.60 -1.59 120.64 116.47 3hb9 n GLU 441 Ca -0.07 0.10 -0.03 0.00 -0.16 0.00 0.00 57.16 57.00 3hb9 n GLU 441 Cb 0.47 -1.64 -0.01 0.00 1.43 0.00 0.00 31.44 31.69 3hb9 n GLU 441 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 177.13 176.75 3hb9 h LYS 442 N 0.00 0.00 -0.09 3.44 3.64 -0.32 -2.87 116.57 120.38 3hb9 h LYS 442 Ca 0.00 0.00 -0.20 0.00 -1.27 0.00 0.00 60.65 59.18 3hb9 h LYS 442 Cb 0.61 0.00 0.01 0.00 -0.41 0.00 0.00 32.23 32.45 3hb9 h LYS 442 CO 0.00 0.79 -0.74 1.98 -2.27 0.00 0.00 179.45 179.21 3hb9 h MET 443 N 0.00 0.65 -0.24 1.90 4.05 -0.90 -3.06 114.93 117.34 3hb9 h MET 443 Ca -0.01 -0.59 0.00 0.00 -0.28 0.00 0.00 59.70 58.83 3hb9 h MET 443 Cb 1.52 0.14 -0.01 0.00 -0.80 0.00 0.00 31.60 32.44 3hb9 h MET 443 CO 0.10 1.20 0.15 0.28 0.23 0.00 0.00 176.91 178.87 3hb9 h VAL 444 N 0.31 1.07 -0.75 -5.77 2.07 -1.34 -0.25 116.25 111.60 3hb9 h VAL 444 Ca -0.07 -0.15 -0.02 0.00 0.82 0.00 0.00 66.70 67.28 3hb9 h VAL 444 Cb 1.39 0.74 -0.03 0.00 -1.52 0.00 0.00 31.29 31.86 3hb9 h VAL 444 CO 0.15 0.07 0.39 -0.09 0.02 0.00 0.00 177.57 178.11 3hb9 h ARG 445 N 0.32 1.06 -0.05 1.57 1.12 -1.62 -0.58 114.38 116.19 3hb9 h ARG 445 Ca 0.09 -0.14 -0.08 0.00 -1.11 0.00 0.00 59.98 58.74 3hb9 h ARG 445 Cb -0.02 -0.20 -0.01 0.00 -0.01 0.00 0.00 29.97 29.73 3hb9 h ARG 445 CO -0.02 0.80 -0.35 0.77 -3.11 0.00 0.00 179.97 178.07 3hb9 h SER 446 N 1.04 0.10 0.85 -3.80 0.02 -1.38 0.32 113.55 110.70 3hb9 h SER 446 Ca 0.26 -0.03 -0.17 0.00 -0.84 0.00 0.00 61.79 61.01 3hb9 h SER 446 Cb 0.07 -0.03 -0.02 0.00 0.14 0.00 0.00 62.40 62.56 3hb9 h SER 446 CO -0.04 0.45 -0.82 -0.07 -1.14 0.00 0.00 176.83 175.21 3hb9 h LEU 447 N 0.09 0.00 0.00 5.07 3.38 -0.57 -2.99 115.31 120.29 3hb9 h LEU 447 Ca 0.01 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.93 3hb9 h LEU 447 Cb 0.66 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.40 3hb9 h LEU 447 CO 0.05 0.82 -0.88 0.03 0.09 0.00 0.00 178.44 178.55 3hb9 h ARG 448 N 0.00 0.00 0.09 1.13 3.08 -0.80 -3.33 114.38 114.55 3hb9 h ARG 448 Ca -0.01 0.00 -0.29 0.00 0.07 0.00 0.00 59.98 59.75 3hb9 h ARG 448 Cb 1.46 0.00 0.03 0.00 0.08 0.00 0.00 29.97 31.54 3hb9 h ARG 448 CO 0.11 0.11 -1.20 0.93 -1.07 0.00 0.00 179.97 178.85 3hb9 h GLU 449 N 0.00 0.64 -6.40 0.04 5.08 -1.01 -3.43 114.58 109.50 3hb9 h GLU 449 Ca -0.04 -0.81 -0.54 0.00 -1.00 0.00 0.00 59.36 56.97 3hb9 h GLU 449 Cb 1.17 0.26 -0.06 0.00 0.50 0.00 0.00 28.75 30.62 3hb9 h GLU 449 CO 0.02 1.36 1.10 -1.64 -1.00 0.00 0.00 179.01 178.85 3hb9 s MET 450 N -3.06 3.29 -0.65 2.33 -1.94 -1.13 -4.87 119.30 113.27 3hb9 s MET 450 Ca -0.09 0.43 0.02 0.00 -1.71 0.00 0.00 55.69 54.34 3hb9 s MET 450 Cb 0.06 -4.13 0.16 0.00 2.01 0.00 0.00 34.83 32.93 3hb9 s MET 450 CO 0.93 -1.95 0.44 1.03 -0.01 0.00 0.00 175.02 175.46 3hb9 s ARG 451 N 5.53 2.44 -0.13 2.03 0.52 -1.26 -4.94 118.95 123.15 3hb9 s ARG 451 Ca 0.52 -2.86 -0.17 0.00 -0.52 0.00 0.00 55.73 52.69 3hb9 s ARG 451 Cb -0.11 -3.55 -0.04 0.00 0.52 0.00 0.00 34.95 31.77 3hb9 s ARG 451 CO 0.25 -1.19 0.44 0.42 0.02 0.00 0.00 175.30 175.23 3hb9 s ILE 452 N -0.66 5.21 0.40 1.52 1.01 -1.26 -4.29 121.20 123.13 3hb9 s ILE 452 Ca 0.20 0.86 0.05 0.00 0.00 0.00 0.00 60.65 61.76 3hb9 s ILE 452 Cb -0.17 -3.78 -0.06 0.00 0.01 0.00 0.00 42.46 38.47 3hb9 s ILE 452 CO -0.06 0.33 0.04 -0.13 0.00 0.00 0.00 174.94 175.12 3hb9 s ARG 453 N 0.63 1.90 0.00 2.79 0.52 -0.51 -4.80 118.95 119.48 3hb9 s ARG 453 Ca 0.24 -2.10 0.00 0.00 -0.52 0.00 0.00 55.73 53.35 3hb9 s ARG 453 Cb -0.15 -1.27 0.00 0.00 0.52 0.00 0.00 34.95 34.05 3hb9 s ARG 453 CO 0.09 -0.19 0.00 0.41 0.02 0.00 0.00 175.30 175.63 3hb9 n GLY 454 N -0.92 3.06 1.56 -3.53 0.00 -1.26 -2.83 105.19 101.27 3hb9 n GLY 454 Ca -0.07 -0.83 -0.12 0.00 0.00 0.00 0.00 46.02 45.01 3hb9 n GLY 454 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3hb9 n VAL 455 N 0.00 0.00 -4.43 1.61 0.31 -1.26 -4.66 118.33 109.90 3hb9 n VAL 455 Ca 0.00 -0.93 -0.32 0.00 -0.01 0.00 0.00 64.34 63.08 3hb9 n VAL 455 Cb 0.00 -0.17 -0.10 0.00 -0.91 0.00 0.00 33.84 32.66 3hb9 n VAL 455 CO 0.00 0.00 0.00 -0.54 -1.32 0.00 0.00 176.83 174.97 3hb9 s LYS 456 N -2.89 2.48 0.18 5.55 3.01 -1.26 -5.06 119.74 121.76 3hb9 s LYS 456 Ca 0.09 -0.77 0.10 0.00 -1.01 0.00 0.00 55.97 54.38 3hb9 s LYS 456 Cb -0.01 -2.47 -0.04 0.00 -1.01 0.00 0.00 37.83 34.30 3hb9 s LYS 456 CO 0.06 0.59 -0.22 0.99 0.51 0.00 0.00 175.35 177.28 3hb9 s THR 457 N -1.03 2.16 -2.11 2.17 2.01 -1.26 -4.09 115.64 113.48 3hb9 s THR 457 Ca 0.18 -1.99 0.20 0.00 0.31 0.00 0.00 61.69 60.39 3hb9 s THR 457 Cb -0.11 -2.02 0.51 0.00 0.01 0.00 0.00 72.50 70.89 3hb9 s THR 457 CO 0.09 -0.19 1.66 -0.46 -0.69 0.00 0.00 174.62 175.03 3hb9 n ASN 458 N 0.27 0.64 -0.10 3.53 2.04 -0.37 -4.43 115.26 116.85 3hb9 n ASN 458 Ca -0.13 -1.52 -0.06 0.00 -0.44 0.00 0.00 54.58 52.44 3hb9 n ASN 458 Cb 0.56 -0.04 0.01 0.00 -2.53 0.00 0.00 39.78 37.78 3hb9 n ASN 458 CO 0.00 0.00 0.00 0.40 -0.44 0.00 0.00 177.26 177.22 3hb9 h ILE 459 N 0.86 0.50 -0.21 1.53 2.04 -1.90 -1.82 117.51 118.51 3hb9 h ILE 459 Ca 0.00 0.00 0.06 0.00 1.00 0.00 0.00 64.86 65.92 3hb9 h ILE 459 Cb 0.19 0.50 -0.01 0.00 -0.74 0.00 0.00 36.82 36.76 3hb9 h ILE 459 CO 0.00 0.00 0.21 1.55 0.00 0.00 0.00 178.15 179.91 3hb9 h PRO 460 N -0.10 0.00 -0.03 2.37 0.13 -1.94 -1.65 132.00 130.78 3hb9 h PRO 460 Ca 0.18 0.00 -0.11 0.00 -0.87 0.00 0.00 66.00 65.20 3hb9 h PRO 460 Cb 0.37 0.00 0.01 0.00 0.13 0.00 0.00 31.00 31.51 3hb9 h PRO 460 CO -0.43 0.00 -0.41 0.35 -0.23 0.00 0.00 178.00 177.29 3hb9 h PHE 461 N 0.00 0.47 0.00 1.56 3.57 -1.67 -3.33 116.94 117.55 3hb9 h PHE 461 Ca 0.10 -0.23 -0.06 0.00 3.53 0.00 0.00 57.97 61.31 3hb9 h PHE 461 Cb 0.52 -0.06 -0.01 0.00 2.79 0.00 0.00 35.95 39.19 3hb9 h PHE 461 CO 0.00 1.01 -0.28 -0.07 -2.23 0.00 0.00 178.31 176.75 3hb9 h LEU 462 N -0.20 0.00 0.24 0.59 3.38 -1.01 -3.16 115.31 115.15 3hb9 h LEU 462 Ca -0.04 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.92 3hb9 h LEU 462 Cb 1.10 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.85 3hb9 h LEU 462 CO 0.08 0.28 -0.12 0.40 0.09 0.00 0.00 178.44 179.17 3hb9 h ILE 463 N 0.00 0.77 0.00 1.22 2.04 -1.54 -3.01 117.51 117.00 3hb9 h ILE 463 Ca -0.00 -0.05 -0.01 0.00 1.00 0.00 0.00 64.86 65.79 3hb9 h ILE 463 Cb 0.62 0.81 -0.00 0.00 -0.74 0.00 0.00 36.82 37.51 3hb9 h ILE 463 CO 0.04 0.01 -0.04 0.78 0.00 0.00 0.00 178.15 178.94 3hb9 h ASN 464 N -0.35 0.00 -0.32 1.72 4.21 -1.68 -2.05 115.58 117.10 3hb9 h ASN 464 Ca -0.03 0.00 -0.08 0.00 1.21 0.00 0.00 56.30 57.40 3hb9 h ASN 464 Cb 0.27 0.00 -0.01 0.00 -1.12 0.00 0.00 38.32 37.46 3hb9 h ASN 464 CO 0.05 0.04 -0.09 0.58 -1.29 0.00 0.00 177.43 176.72 3hb9 h VAL 465 N 0.00 1.28 -0.11 2.81 2.07 -1.60 -3.27 116.25 117.43 3hb9 h VAL 465 Ca -0.00 -1.16 -0.06 0.00 0.82 0.00 0.00 66.70 66.30 3hb9 h VAL 465 Cb 0.19 1.37 -0.00 0.00 -1.52 0.00 0.00 31.29 31.33 3hb9 h VAL 465 CO 0.01 0.37 -0.16 0.24 0.02 0.00 0.00 177.57 178.05 3hb9 h MET 466 N 0.40 0.30 -1.03 1.57 2.86 -1.36 -3.14 114.93 114.54 3hb9 h MET 466 Ca 0.08 -0.18 -0.12 0.00 -2.06 0.00 0.00 59.70 57.42 3hb9 h MET 466 Cb 0.60 0.02 -0.07 0.00 0.06 0.00 0.00 31.60 32.20 3hb9 h MET 466 CO 0.04 0.75 0.15 1.63 1.06 0.00 0.00 176.91 180.53 3hb9 n LYS 467 N -4.56 1.28 -4.00 1.72 4.76 -1.15 -4.64 118.16 111.56 3hb9 n LYS 467 Ca -0.07 -0.67 -0.35 0.00 -2.87 0.00 0.00 58.31 54.36 3hb9 n LYS 467 Cb 0.38 -1.26 -0.10 0.00 -1.84 0.00 0.00 35.03 32.21 3hb9 n LYS 467 CO 0.00 0.00 0.00 1.21 -1.37 0.00 0.00 177.40 177.24 3hb9 s ASN 468 N 0.52 5.58 0.20 4.39 3.84 -1.19 -5.02 114.94 123.26 3hb9 s ASN 468 Ca 0.13 0.06 -0.10 0.00 0.21 0.00 0.00 52.86 53.15 3hb9 s ASN 468 Cb 0.11 -1.96 0.24 0.00 -0.55 0.00 0.00 41.25 39.09 3hb9 s ASN 468 CO 0.02 0.16 1.78 0.11 -2.79 0.00 0.00 177.10 176.38 3hb9 h LYS 469 N 6.79 0.51 0.00 0.43 1.57 -1.90 0.23 116.57 124.21 3hb9 h LYS 469 Ca -0.37 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.38 3hb9 h LYS 469 Cb 1.17 -0.12 0.00 0.00 0.08 0.00 0.00 32.23 33.36 3hb9 h LYS 469 CO 0.69 0.34 0.00 0.87 -0.57 0.00 0.00 179.45 180.78 3hb9 h LYS 470 N 0.53 0.00 0.07 3.15 1.79 -1.95 0.49 116.57 120.65 3hb9 h LYS 470 Ca 0.29 0.00 -0.35 0.00 -2.18 0.00 0.00 60.65 58.41 3hb9 h LYS 470 Cb 0.27 0.00 -0.04 0.00 -1.58 0.00 0.00 32.23 30.88 3hb9 h LYS 470 CO -0.23 0.00 -2.03 0.34 -1.08 0.00 0.00 179.45 176.45 3hb9 n PHE 471 N -2.63 0.94 -0.21 -1.35 -0.00 -0.68 -3.89 117.46 109.64 3hb9 n PHE 471 Ca 0.01 0.23 -0.07 0.00 -0.00 0.00 0.00 57.45 57.62 3hb9 n PHE 471 Cb 0.26 -1.13 0.03 0.00 -0.00 0.00 0.00 39.48 38.63 3hb9 n PHE 471 CO 0.00 0.00 0.00 1.15 -0.00 0.00 0.00 176.76 177.91 3hb9 h THR 472 N 0.04 1.21 0.00 -2.13 2.02 -0.05 -2.36 112.91 111.64 3hb9 h THR 472 Ca -0.43 -0.61 0.00 0.00 0.77 0.00 0.00 66.41 66.14 3hb9 h THR 472 Cb 2.02 0.52 0.00 0.00 -1.74 0.00 0.00 68.15 68.96 3hb9 h THR 472 CO 0.06 0.25 0.00 0.77 0.37 0.00 0.00 175.52 176.96 3hb9 h SER 473 N 0.81 0.00 0.00 4.18 4.64 -1.11 -3.46 113.55 118.61 3hb9 h SER 473 Ca 0.20 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.52 3hb9 h SER 473 Cb 0.13 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.22 3hb9 h SER 473 CO -0.02 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.55 3hb9 n GLY 474 N -0.76 1.78 3.34 -0.77 0.00 -0.89 -4.84 105.19 103.04 3hb9 n GLY 474 Ca -0.01 0.00 -0.46 0.00 0.00 0.00 0.00 46.02 45.55 3hb9 n GLY 474 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3hb9 s ASP 475 N -3.34 7.10 0.38 1.61 2.15 -1.25 -4.52 116.67 118.80 3hb9 s ASP 475 Ca 0.00 -3.24 0.04 0.00 0.43 0.00 0.00 52.55 49.78 3hb9 s ASP 475 Cb 0.00 -2.21 -0.03 0.00 -0.30 0.00 0.00 42.92 40.38 3hb9 s ASP 475 CO 0.00 -0.40 0.13 -0.72 -0.17 0.00 0.00 175.17 174.00 3hb9 s TYR 476 N -0.68 1.78 0.21 -5.34 1.13 -1.26 -4.85 117.35 108.35 3hb9 s TYR 476 Ca 0.26 -1.27 0.03 0.00 -1.41 0.00 0.00 57.07 54.68 3hb9 s TYR 476 Cb -0.10 -1.12 -0.01 0.00 -1.10 0.00 0.00 41.96 39.63 3hb9 s TYR 476 CO -0.08 -0.31 0.12 0.25 -2.51 0.00 0.00 175.55 173.02 3hb9 n THR 477 N -0.83 0.00 0.40 -3.49 -2.24 -1.26 -4.86 114.28 102.00 3hb9 n THR 477 Ca -0.04 -1.37 0.13 0.00 -2.27 0.00 0.00 64.05 60.50 3hb9 n THR 477 Cb 0.65 0.58 0.51 0.00 -2.10 0.00 0.00 70.33 69.96 3hb9 n THR 477 CO 0.00 0.00 0.00 0.71 -0.57 0.00 0.00 175.07 175.21 3hb9 h THR 478 N 1.48 0.00 -0.44 4.28 1.35 -1.41 -2.76 112.91 115.41 3hb9 h THR 478 Ca -0.16 -0.37 -0.12 0.00 -0.55 0.00 0.00 66.41 65.21 3hb9 h THR 478 Cb 0.69 1.22 -0.07 0.00 -1.73 0.00 0.00 68.15 68.26 3hb9 h THR 478 CO 0.25 0.00 0.15 0.29 -0.25 0.00 0.00 175.52 175.96 3hb9 n LYS 479 N -2.48 2.73 0.18 4.72 4.76 -1.26 -4.54 118.16 122.27 3hb9 n LYS 479 Ca 0.02 -1.84 -0.13 0.00 -2.87 0.00 0.00 58.31 53.49 3hb9 n LYS 479 Cb 0.29 -1.86 -0.08 0.00 -1.84 0.00 0.00 35.03 31.55 3hb9 n LYS 479 CO 0.00 0.00 0.00 0.35 -1.37 0.00 0.00 177.40 176.38 3hb9 h PHE 480 N 1.70 -0.44 -0.72 2.13 3.57 -1.80 -2.87 116.94 118.51 3hb9 h PHE 480 Ca 0.14 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.63 3hb9 h PHE 480 Cb 1.66 0.14 -0.04 0.00 2.79 0.00 0.00 35.95 40.51 3hb9 h PHE 480 CO 0.77 -0.11 0.45 0.82 -2.23 0.00 0.00 178.31 178.01 3hb9 h ILE 481 N -0.83 1.20 -0.02 1.41 5.03 -1.80 -2.65 117.51 119.85 3hb9 h ILE 481 Ca -0.05 -0.41 -0.00 0.00 -0.12 0.00 0.00 64.86 64.28 3hb9 h ILE 481 Cb 0.53 0.17 -0.00 0.00 -3.03 0.00 0.00 36.82 34.49 3hb9 h ILE 481 CO 0.08 0.20 0.01 -0.33 -0.68 0.00 0.00 178.15 177.43 3hb9 h GLU 482 N 0.98 0.03 -0.19 2.37 3.07 -1.87 -2.93 114.58 116.05 3hb9 h GLU 482 Ca 0.26 -0.01 0.00 0.00 -0.50 0.00 0.00 59.36 59.12 3hb9 h GLU 482 Cb -0.06 -0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.84 3hb9 h GLU 482 CO -0.05 0.21 0.00 -0.85 -1.40 0.00 0.00 179.01 176.92 3hb9 n GLU 483 N -4.98 1.52 -3.91 2.33 0.28 -1.08 -4.31 120.64 110.49 3hb9 n GLU 483 Ca -0.07 -0.80 -0.30 0.00 -0.16 0.00 0.00 57.16 55.83 3hb9 n GLU 483 Cb 0.12 -1.26 -0.13 0.00 1.43 0.00 0.00 31.44 31.61 3hb9 n GLU 483 CO 0.00 0.00 0.00 0.99 -0.16 0.00 0.00 177.13 177.96 3hb9 s THR 484 N -1.76 2.83 -0.52 3.84 2.01 -1.00 -4.93 115.64 116.11 3hb9 s THR 484 Ca 0.22 -3.70 0.25 0.00 0.31 0.00 0.00 61.69 58.77 3hb9 s THR 484 Cb 0.11 -2.91 0.32 0.00 0.01 0.00 0.00 72.50 70.04 3hb9 s THR 484 CO 0.17 -0.89 1.70 1.55 -0.69 0.00 0.00 174.62 176.45 3hb9 h PRO 485 N 6.08 0.00 0.00 4.92 0.13 -1.75 -3.14 132.00 138.24 3hb9 h PRO 485 Ca 0.02 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.15 3hb9 h PRO 485 Cb 0.84 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.97 3hb9 h PRO 485 CO 0.71 0.00 0.00 -0.85 -0.23 0.00 0.00 178.00 177.63 3hb9 n GLU 486 N -2.74 0.07 0.02 0.86 0.00 -1.26 -2.13 120.64 115.46 3hb9 n GLU 486 Ca 0.04 0.20 0.11 0.00 0.00 0.00 0.00 57.16 57.51 3hb9 n GLU 486 Cb 0.47 -1.50 0.47 0.00 0.00 0.00 0.00 31.44 30.87 3hb9 n GLU 486 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.13 177.02 3hb9 n LEU 487 N -1.43 0.13 -1.15 -1.84 7.94 -1.19 -2.78 117.00 116.68 3hb9 n LEU 487 Ca 0.05 0.52 0.12 0.00 -1.11 0.00 0.00 56.01 55.59 3hb9 n LEU 487 Cb 0.16 -0.49 0.21 0.00 0.53 0.00 0.00 43.42 43.84 3hb9 n LEU 487 CO 0.14 -0.16 0.70 0.49 -1.11 0.00 0.00 177.39 177.44 3hb9 n PHE 488 N -1.63 0.50 -2.09 1.96 3.01 -0.90 -4.91 117.46 113.39 3hb9 n PHE 488 Ca 0.05 -0.26 -0.42 0.00 1.01 0.00 0.00 57.45 57.83 3hb9 n PHE 488 Cb 0.27 -0.00 -0.03 0.00 -0.01 0.00 0.00 39.48 39.71 3hb9 n PHE 488 CO 0.00 0.00 0.00 -0.51 1.01 0.00 0.00 176.76 177.26 3hb9 s ASP 489 N -1.47 6.73 -0.22 4.37 -0.00 -1.12 -4.99 116.67 119.98 3hb9 s ASP 489 Ca 0.39 2.21 -0.19 0.00 -0.00 0.00 0.00 52.55 54.96 3hb9 s ASP 489 Cb 0.23 -2.55 -0.03 0.00 -0.00 0.00 0.00 42.92 40.57 3hb9 s ASP 489 CO 0.31 -0.84 0.55 -0.63 -0.00 0.00 0.00 175.17 174.56 3hb9 s ILE 490 N 3.18 5.07 -0.17 0.77 1.01 -1.26 -5.05 121.20 124.75 3hb9 s ILE 490 Ca 0.69 1.00 -0.22 0.00 0.00 0.00 0.00 60.65 62.12 3hb9 s ILE 490 Cb -0.33 -3.87 -0.02 0.00 0.01 0.00 0.00 42.46 38.25 3hb9 s ILE 490 CO 0.28 0.14 0.69 -1.58 0.00 0.00 0.00 174.94 174.47 3hb9 s GLN 491 N 1.88 4.27 -1.05 2.79 2.00 -1.26 -4.98 119.66 123.30 3hb9 s GLN 491 Ca 0.25 0.76 -0.25 0.00 -2.00 0.00 0.00 55.36 54.12 3hb9 s GLN 491 Cb -0.16 -3.56 -0.15 0.00 0.80 0.00 0.00 33.01 29.95 3hb9 s GLN 491 CO 0.10 -0.22 2.08 -1.25 -0.50 0.00 0.00 175.29 175.50 3hb9 s PRO 492 N 1.82 1.79 -1.12 1.67 0.04 -1.26 -4.87 135.00 133.06 3hb9 s PRO 492 Ca 0.33 -0.51 -0.16 0.00 0.04 0.00 0.00 61.00 60.70 3hb9 s PRO 492 Cb -0.16 -5.04 0.15 0.00 0.04 0.00 0.00 34.50 29.49 3hb9 s PRO 492 CO 0.12 -4.66 1.36 -1.54 0.04 0.00 0.00 177.00 172.31 3hb9 s SER 493 N 8.19 6.91 0.26 6.66 1.04 -1.26 -5.01 113.70 130.49 3hb9 s SER 493 Ca 0.78 -2.64 -0.30 0.00 0.48 0.00 0.00 55.95 54.28 3hb9 s SER 493 Cb -0.05 -2.42 -0.09 0.00 0.10 0.00 0.00 66.02 63.56 3hb9 s SER 493 CO 0.13 -0.89 1.00 -0.76 0.98 0.00 0.00 173.24 173.71 3hb9 s LEU 494 N 2.16 4.61 -0.56 2.42 1.02 -1.26 -5.03 118.68 122.04 3hb9 s LEU 494 Ca 0.40 2.07 -0.07 0.00 0.02 0.00 0.00 54.13 56.56 3hb9 s LEU 494 Cb -0.03 -3.63 0.14 0.00 0.02 0.00 0.00 46.19 42.70 3hb9 s LEU 494 CO -0.03 0.04 0.41 -0.62 0.02 0.00 0.00 176.35 176.17 3hb9 s ASP 495 N -1.07 5.66 0.21 2.29 -1.08 -1.26 -4.95 116.67 116.47 3hb9 s ASP 495 Ca 0.43 -2.31 -0.08 0.00 -0.52 0.00 0.00 52.55 50.06 3hb9 s ASP 495 Cb -0.28 -1.97 0.16 0.00 -1.46 0.00 0.00 42.92 39.37 3hb9 s ASP 495 CO 0.35 -0.57 1.80 0.03 0.52 0.00 0.00 175.17 177.31 3hb9 h ARG 496 N 7.90 1.15 -0.38 4.34 3.08 -1.99 -2.93 114.38 125.55 3hb9 h ARG 496 Ca -0.10 -0.17 0.03 0.00 0.07 0.00 0.00 59.98 59.80 3hb9 h ARG 496 Cb 1.03 -0.21 -0.03 0.00 0.08 0.00 0.00 29.97 30.84 3hb9 h ARG 496 CO 0.78 0.89 0.19 0.78 -1.07 0.00 0.00 179.97 181.55 3hb9 h GLY 497 N 1.13 0.51 1.09 0.04 0.00 -1.99 -2.77 103.07 101.09 3hb9 h GLY 497 Ca 0.27 -0.13 -0.05 0.00 0.00 0.00 0.00 47.33 47.42 3hb9 h GLY 497 CO -0.03 0.10 0.27 -0.84 0.00 0.00 0.00 176.54 176.04 3hb9 h THR 498 N 0.39 1.26 -0.53 4.70 2.02 -1.97 -2.65 112.91 116.13 3hb9 h THR 498 Ca 0.16 -0.85 -0.06 0.00 0.77 0.00 0.00 66.41 66.44 3hb9 h THR 498 Cb 0.07 0.38 -0.02 0.00 -1.74 0.00 0.00 68.15 66.84 3hb9 h THR 498 CO -0.11 0.34 0.12 0.11 0.37 0.00 0.00 175.52 176.34 3hb9 h LYS 499 N 1.11 0.86 0.00 6.66 1.57 -1.33 -1.74 116.57 123.71 3hb9 h LYS 499 Ca 0.25 -0.21 -0.08 0.00 -1.87 0.00 0.00 60.65 58.73 3hb9 h LYS 499 Cb 0.25 -0.11 -0.01 0.00 0.08 0.00 0.00 32.23 32.44 3hb9 h LYS 499 CO -0.02 0.82 -0.40 1.79 -0.57 0.00 0.00 179.45 181.08 3hb9 h THR 500 N 0.75 1.03 -0.59 -0.16 1.35 -1.44 -2.03 112.91 111.82 3hb9 h THR 500 Ca 0.16 -1.49 -0.10 0.00 -0.55 0.00 0.00 66.41 64.43 3hb9 h THR 500 Cb 0.36 1.87 -0.02 0.00 -1.73 0.00 0.00 68.15 68.62 3hb9 h THR 500 CO 0.00 0.39 -0.03 -0.07 -0.25 0.00 0.00 175.52 175.56 3hb9 h LEU 501 N 0.00 1.04 -1.06 3.87 3.38 -1.10 -1.69 115.31 119.74 3hb9 h LEU 501 Ca -0.00 -0.32 -0.10 0.00 0.09 0.00 0.00 57.88 57.55 3hb9 h LEU 501 Cb 0.84 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 41.29 3hb9 h LEU 501 CO 0.05 1.11 -0.41 -0.33 0.09 0.00 0.00 178.44 178.94 3hb9 h GLU 502 N 0.95 0.11 0.24 1.13 5.08 -1.05 -1.61 114.58 119.42 3hb9 h GLU 502 Ca 0.16 -0.05 -0.01 0.00 -1.00 0.00 0.00 59.36 58.46 3hb9 h GLU 502 Cb 0.59 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.84 3hb9 h GLU 502 CO 0.04 0.51 -0.11 -0.92 -1.00 0.00 0.00 179.01 177.52 3hb9 h TYR 503 N 0.09 -0.29 -0.79 4.33 5.03 -1.24 -2.33 116.97 121.76 3hb9 h TYR 503 Ca 0.01 -0.01 0.10 0.00 2.58 0.00 0.00 58.73 61.41 3hb9 h TYR 503 Cb 0.77 0.10 -0.07 0.00 1.55 0.00 0.00 36.73 39.08 3hb9 h TYR 503 CO 0.01 0.08 0.44 0.82 -1.32 0.00 0.00 178.16 178.18 3hb9 h ILE 504 N -0.90 0.88 -0.42 1.81 2.04 -1.35 -1.13 117.51 118.44 3hb9 h ILE 504 Ca -0.03 -0.25 0.03 0.00 1.00 0.00 0.00 64.86 65.61 3hb9 h ILE 504 Cb 0.50 0.09 -0.04 0.00 -0.74 0.00 0.00 36.82 36.64 3hb9 h ILE 504 CO 0.05 0.13 0.21 1.23 0.00 0.00 0.00 178.15 179.77 3hb9 h GLY 505 N 0.73 0.57 0.92 5.37 0.00 -1.37 -1.01 103.07 108.28 3hb9 h GLY 505 Ca 0.39 -0.14 -0.01 0.00 0.00 0.00 0.00 47.33 47.56 3hb9 h GLY 505 CO -0.26 0.10 0.11 -0.57 0.00 0.00 0.00 176.54 175.93 3hb9 h ASN 506 N 0.42 0.32 -0.54 0.19 -0.00 -0.71 -2.31 115.58 112.94 3hb9 h ASN 506 Ca 0.18 -0.13 -0.12 0.00 -0.00 0.00 0.00 56.30 56.24 3hb9 h ASN 506 Cb 0.09 -0.08 -0.02 0.00 -0.00 0.00 0.00 38.32 38.31 3hb9 h ASN 506 CO -0.13 0.36 -0.11 0.58 -0.00 0.00 0.00 177.43 178.13 3hb9 h VAL 507 N 0.26 1.27 -0.62 2.57 2.07 -1.19 0.98 116.25 121.59 3hb9 h VAL 507 Ca 0.08 -1.27 0.02 0.00 0.82 0.00 0.00 66.70 66.35 3hb9 h VAL 507 Cb 0.12 0.97 -0.04 0.00 -1.52 0.00 0.00 31.29 30.82 3hb9 h VAL 507 CO -0.01 0.45 0.39 0.74 0.02 0.00 0.00 177.57 179.16 3hb9 h THR 508 N 0.92 1.10 0.16 2.57 2.02 -1.06 0.25 112.91 118.86 3hb9 h THR 508 Ca 0.14 -0.27 -0.30 0.00 0.77 0.00 0.00 66.41 66.75 3hb9 h THR 508 Cb 0.68 0.26 0.01 0.00 -1.74 0.00 0.00 68.15 67.36 3hb9 h THR 508 CO 0.05 0.14 -1.48 0.40 0.37 0.00 0.00 175.52 175.00 3hb9 h ILE 509 N 0.78 1.08 0.00 3.11 2.04 -1.35 -3.40 117.51 119.76 3hb9 h ILE 509 Ca 0.24 -2.49 0.00 0.00 1.00 0.00 0.00 64.86 63.61 3hb9 h ILE 509 Cb -0.02 2.82 0.00 0.00 -0.74 0.00 0.00 36.82 38.89 3hb9 h ILE 509 CO -0.08 0.77 -1.04 0.59 0.00 0.00 0.00 178.15 178.39 3hb9 n ASN 510 N -3.80 1.04 0.00 1.72 3.02 0.33 -4.94 115.26 112.63 3hb9 n ASN 510 Ca -0.23 -0.52 0.00 0.00 -0.03 0.00 0.00 54.58 53.80 3hb9 n ASN 510 Cb 0.98 1.25 0.00 0.00 -0.61 0.00 0.00 39.78 41.40 3hb9 n ASN 510 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3hb9 n GLY 511 N 1.46 -2.51 3.15 7.41 0.00 0.87 -4.98 105.19 110.59 3hb9 n GLY 511 Ca 0.01 -1.74 -0.26 0.00 0.00 0.00 0.00 46.02 44.03 3hb9 n GLY 511 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 3hb9 s PHE 512 N -0.47 1.67 0.19 1.61 5.36 -1.26 -4.47 117.98 120.61 3hb9 s PHE 512 Ca 0.00 -0.41 -0.33 0.00 -0.96 0.00 0.00 56.93 55.23 3hb9 s PHE 512 Cb 0.00 -1.11 -0.14 0.00 -0.34 0.00 0.00 43.02 41.44 3hb9 s PHE 512 CO 0.00 -0.10 1.47 -2.30 -1.46 0.00 0.00 175.22 172.83 3hb9 n PRO 513 N 2.91 1.99 -0.83 10.12 -0.02 -1.26 -1.49 135.00 146.43 3hb9 n PRO 513 Ca -0.17 0.71 0.00 0.00 -2.02 0.00 0.00 63.50 62.03 3hb9 n PRO 513 Cb 0.53 -2.41 0.00 0.00 -0.02 0.00 0.00 33.50 31.60 3hb9 n PRO 513 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 3hb9 n ASN 515 N 2.72 -1.24 -4.38 2.55 3.02 -1.26 -4.99 115.26 111.68 3hb9 n ASN 515 Ca 0.14 0.00 -0.35 0.00 -0.03 0.00 0.00 54.58 54.34 3hb9 n ASN 515 Cb 0.29 -1.38 -0.13 0.00 -0.61 0.00 0.00 39.78 37.95 3hb9 n ASN 515 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 3hb9 s VAL 516 N -2.29 3.68 0.25 2.41 1.01 -0.56 -4.87 120.40 120.04 3hb9 s VAL 516 Ca 0.00 -0.40 -0.30 0.00 0.00 0.00 0.00 61.98 61.28 3hb9 s VAL 516 Cb 0.00 -2.67 -0.10 0.00 0.00 0.00 0.00 36.38 33.61 3hb9 s VAL 516 CO 0.00 0.42 1.43 -0.70 0.00 0.00 0.00 175.10 176.25 3hb9 s GLU 517 N 1.24 4.28 -0.70 2.72 2.12 -1.26 -4.51 118.70 122.59 3hb9 s GLU 517 Ca 0.03 2.29 -0.26 0.00 0.36 0.00 0.00 54.97 57.39 3hb9 s GLU 517 Cb -0.14 -3.11 -0.08 0.00 0.26 0.00 0.00 34.13 31.05 3hb9 s GLU 517 CO -0.00 -0.40 2.22 0.15 -0.54 0.00 0.00 175.26 176.68 3hb9 s LYS 518 N -0.44 2.11 0.05 4.30 -0.14 -1.26 -4.92 119.74 119.45 3hb9 s LYS 518 Ca 0.59 0.60 0.01 0.00 -1.36 0.00 0.00 55.97 55.81 3hb9 s LYS 518 Cb -0.41 -4.72 -0.03 0.00 -1.68 0.00 0.00 37.83 30.99 3hb9 s LYS 518 CO 0.44 -3.61 -0.06 -0.98 -0.76 0.00 0.00 175.35 170.38 3hb9 s ARG 519 N 8.00 0.56 0.14 1.68 1.70 -1.26 -5.12 118.95 124.65 3hb9 s ARG 519 Ca 0.85 -0.92 -0.35 0.00 -0.47 0.00 0.00 55.73 54.84 3hb9 s ARG 519 Cb -0.13 -0.11 -0.16 0.00 -0.57 0.00 0.00 34.95 33.98 3hb9 s ARG 519 CO 0.13 -0.01 1.34 -0.35 -1.08 0.00 0.00 175.30 175.33 3hb9 n PRO 520 N 0.96 1.41 -1.48 3.89 -0.04 -1.26 -4.87 135.00 133.61 3hb9 n PRO 520 Ca -0.19 0.51 -0.48 0.00 -0.04 0.00 0.00 63.50 63.30 3hb9 n PRO 520 Cb 0.57 -2.13 -0.03 0.00 -0.04 0.00 0.00 33.50 31.87 3hb9 n PRO 520 CO 0.00 0.00 0.00 1.17 -0.04 0.00 0.00 175.50 176.63 3hb9 n LYS 521 N 2.43 0.51 0.00 0.54 4.81 -1.26 -5.00 118.16 120.19 3hb9 n LYS 521 Ca 0.17 0.18 0.00 0.00 -0.87 0.00 0.00 58.31 57.79 3hb9 n LYS 521 Cb 0.23 -1.37 0.00 0.00 0.02 0.00 0.00 35.03 33.92 3hb9 n LYS 521 CO 0.00 0.00 0.00 -2.30 1.17 0.00 0.00 177.40 176.27 3hb9 n PRO 522 N 1.01 0.00 -2.88 1.64 -0.02 -1.26 -4.65 135.00 128.83 3hb9 n PRO 522 Ca 0.15 0.00 -0.13 0.00 -2.02 0.00 0.00 63.50 61.51 3hb9 n PRO 522 Cb 0.26 0.00 -0.01 0.00 -0.02 0.00 0.00 33.50 33.73 3hb9 n PRO 522 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 3hb9 n ASP 523 N 0.00 -2.43 0.22 2.55 10.43 -1.26 -4.86 116.55 121.20 3hb9 n ASP 523 Ca 0.00 0.05 -0.14 0.00 2.57 0.00 0.00 54.79 57.27 3hb9 n ASP 523 Cb 0.00 -2.12 -0.07 0.00 1.84 0.00 0.00 41.12 40.77 3hb9 n ASP 523 CO 0.00 0.00 0.00 0.22 -1.07 0.00 0.00 177.20 176.35 3hb9 h TYR 524 N -0.30 -0.55 -3.72 1.24 3.20 -1.98 -3.42 116.97 111.44 3hb9 h TYR 524 Ca -0.23 -0.01 -0.68 0.00 3.14 0.00 0.00 58.73 60.95 3hb9 h TYR 524 Cb 1.16 0.18 -0.19 0.00 1.54 0.00 0.00 36.73 39.42 3hb9 h TYR 524 CO 0.78 -0.23 -0.73 -2.00 -1.64 0.00 0.00 178.16 174.35 3hb9 s GLU 525 N -4.62 2.49 -0.10 1.82 2.12 -1.26 -5.04 118.70 114.11 3hb9 s GLU 525 Ca -0.14 -0.74 0.04 0.00 0.36 0.00 0.00 54.97 54.49 3hb9 s GLU 525 Cb 0.02 -2.45 -0.09 0.00 0.26 0.00 0.00 34.13 31.87 3hb9 s GLU 525 CO 0.49 0.60 -0.04 -0.11 -0.54 0.00 0.00 175.26 175.67 3hb9 n LEU 526 N 1.71 1.56 -3.70 2.70 7.94 -1.26 -4.99 117.00 120.96 3hb9 n LEU 526 Ca -0.16 -0.03 -0.25 0.00 -1.11 0.00 0.00 56.01 54.46 3hb9 n LEU 526 Cb 0.52 -0.10 0.00 0.00 0.53 0.00 0.00 43.42 44.37 3hb9 n LEU 526 CO 0.29 0.46 -0.21 0.00 -1.11 0.00 0.00 177.39 176.82 3hb9 n ALA 527 N -2.59 -2.55 -1.56 1.96 0.00 -1.26 -4.63 120.51 109.88 3hb9 n ALA 527 Ca -0.17 -0.29 -0.45 0.00 0.00 0.00 0.00 53.44 52.53 3hb9 n ALA 527 Cb 0.75 -0.85 -0.02 0.00 0.00 0.00 0.00 19.45 19.33 3hb9 n ALA 527 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 3hb9 n SER 528 N -2.15 0.93 -4.69 0.00 3.41 -1.26 -4.81 113.62 105.05 3hb9 n SER 528 Ca -0.26 1.17 -0.42 0.00 -0.26 0.00 0.00 58.87 59.10 3hb9 n SER 528 Cb 0.59 -1.24 -0.03 0.00 -0.26 0.00 0.00 64.21 63.27 3hb9 n SER 528 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 3hb9 s ILE 529 N -1.06 2.86 0.34 -1.33 1.01 -1.26 -4.99 121.20 116.78 3hb9 s ILE 529 Ca 0.59 0.37 -0.28 0.00 0.00 0.00 0.00 60.65 61.34 3hb9 s ILE 529 Cb -0.73 -3.24 -0.09 0.00 0.01 0.00 0.00 42.46 38.41 3hb9 s ILE 529 CO 0.59 0.00 1.21 -2.16 0.00 0.00 0.00 174.94 174.58 3hb9 s PRO 530 N 2.52 4.31 0.01 2.79 0.04 -1.26 -5.05 135.00 138.36 3hb9 s PRO 530 Ca 0.75 1.98 -0.00 0.00 0.04 0.00 0.00 61.00 63.77 3hb9 s PRO 530 Cb -0.42 -2.95 -0.01 0.00 0.04 0.00 0.00 34.50 31.16 3hb9 s PRO 530 CO 0.33 -0.14 -0.01 -0.08 0.04 0.00 0.00 177.00 177.14 3hb9 s THR 531 N -1.25 0.06 -0.04 1.26 -1.32 -1.26 -4.41 115.64 108.68 3hb9 s THR 531 Ca 0.51 -0.46 0.05 0.00 -1.21 0.00 0.00 61.69 60.58 3hb9 s THR 531 Cb -0.35 -0.14 -0.02 0.00 -1.51 0.00 0.00 72.50 70.48 3hb9 s THR 531 CO 0.45 -0.25 -0.17 -0.69 -2.21 0.00 0.00 174.62 171.74 3hb9 s VAL 532 N -0.74 2.79 0.67 5.08 1.01 -1.26 -4.91 120.40 123.05 3hb9 s VAL 532 Ca -0.08 -0.83 -0.17 0.00 0.00 0.00 0.00 61.98 60.90 3hb9 s VAL 532 Cb -0.05 -2.07 0.01 0.00 0.00 0.00 0.00 36.38 34.27 3hb9 s VAL 532 CO -0.00 0.58 1.26 -0.94 0.00 0.00 0.00 175.10 176.00 3hb9 s SER 533 N -0.71 4.47 0.34 3.32 1.04 -1.26 -4.79 113.70 116.11 3hb9 s SER 533 Ca 0.11 2.52 0.11 0.00 0.48 0.00 0.00 55.95 59.18 3hb9 s SER 533 Cb -0.10 -2.61 0.60 0.00 0.10 0.00 0.00 66.02 64.01 3hb9 s SER 533 CO 0.00 -2.09 1.76 0.28 0.98 0.00 0.00 173.24 174.18 3hb9 h SER 534 N 0.27 0.04 -0.17 7.02 0.02 -1.99 -3.08 113.55 115.65 3hb9 h SER 534 Ca -0.50 -0.01 -0.02 0.00 -0.84 0.00 0.00 61.79 60.42 3hb9 h SER 534 Cb 1.32 -0.01 -0.01 0.00 0.14 0.00 0.00 62.40 63.84 3hb9 h SER 534 CO 0.52 0.46 0.04 0.28 -1.14 0.00 0.00 176.83 176.99 3hb9 h SER 535 N 0.03 0.26 -0.54 3.07 0.02 -1.99 -2.12 113.55 112.28 3hb9 h SER 535 Ca -0.00 -0.24 -0.06 0.00 -0.84 0.00 0.00 61.79 60.66 3hb9 h SER 535 Cb 0.77 -0.07 -0.03 0.00 0.14 0.00 0.00 62.40 63.22 3hb9 h SER 535 CO 0.06 0.43 0.14 0.50 -1.14 0.00 0.00 176.83 176.81 3hb9 h LYS 536 N 0.08 0.91 -0.11 3.45 3.64 -1.94 -2.86 116.57 119.74 3hb9 h LYS 536 Ca 0.05 -0.20 -0.18 0.00 -1.27 0.00 0.00 60.65 59.05 3hb9 h LYS 536 Cb 0.27 -0.13 -0.00 0.00 -0.41 0.00 0.00 32.23 31.96 3hb9 h LYS 536 CO 0.00 0.82 -0.69 0.82 -2.27 0.00 0.00 179.45 178.12 3hb9 h ILE 537 N 0.87 1.35 0.00 2.00 2.04 -1.54 -2.95 117.51 119.29 3hb9 h ILE 537 Ca 0.19 -2.03 0.00 0.00 1.00 0.00 0.00 64.86 64.01 3hb9 h ILE 537 Cb 0.32 2.01 0.00 0.00 -0.74 0.00 0.00 36.82 38.41 3hb9 h ILE 537 CO -0.00 0.62 0.00 0.00 0.00 0.00 0.00 178.15 178.77 3hb9 h ALA 538 N 0.89 1.00 -0.52 1.87 0.00 -1.15 -1.87 119.26 119.49 3hb9 h ALA 538 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.89 3hb9 h ALA 538 Cb 1.27 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.06 3hb9 h ALA 538 CO 0.12 0.00 0.00 -1.13 0.00 0.00 0.00 179.25 178.24 3hb9 n SER 538 N -2.71 3.44 -4.78 0.00 3.41 -1.12 -4.95 113.62 106.91 3hb9 n SER 538 Ca -0.01 -1.98 -0.39 0.00 -0.26 0.00 0.00 58.87 56.24 3hb9 n SER 538 Cb 0.13 -0.34 -0.06 0.00 -0.26 0.00 0.00 64.21 63.68 3hb9 n SER 538 CO 0.00 0.00 0.00 -0.36 -0.16 0.00 0.00 175.04 174.52 3hb9 s PHE 538 N -1.06 3.85 -0.54 7.33 2.99 -0.70 -5.04 117.98 124.80 3hb9 s PHE 538 Ca 0.37 1.62 0.04 0.00 0.00 0.00 0.00 56.93 58.96 3hb9 s PHE 538 Cb 0.20 -2.77 0.14 0.00 0.00 0.00 0.00 43.02 40.59 3hb9 s PHE 538 CO 0.26 0.45 0.32 0.45 -0.00 0.00 0.00 175.22 176.70 3hb9 s SER 539 N -1.29 4.14 0.00 1.36 0.15 -1.26 -4.82 113.70 111.98 3hb9 s SER 539 Ca 0.39 -3.15 0.00 0.00 0.70 0.00 0.00 55.95 53.89 3hb9 s SER 539 Cb -0.22 -1.43 0.00 0.00 -1.71 0.00 0.00 66.02 62.66 3hb9 s SER 539 CO 0.25 -0.20 0.00 0.61 1.20 0.00 0.00 173.24 175.11 3hb9 n GLY 540 N 2.89 1.63 0.02 9.45 0.00 -1.21 -4.95 105.19 113.02 3hb9 n GLY 540 Ca 0.11 -1.87 0.13 0.00 0.00 0.00 0.00 46.02 44.39 3hb9 n GLY 540 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3hb9 n THR 541 N 0.00 0.29 0.08 2.61 -2.24 -0.87 -2.88 114.28 111.27 3hb9 n THR 541 Ca 0.00 0.00 -0.13 0.00 -2.27 0.00 0.00 64.05 61.66 3hb9 n THR 541 Cb 0.00 -0.62 -0.05 0.00 -2.10 0.00 0.00 70.33 67.56 3hb9 n THR 541 CO 0.00 0.00 0.00 0.50 -0.57 0.00 0.00 175.07 175.00 3hb9 h LYS 542 N 0.00 0.34 -0.25 -0.78 3.11 -1.61 -2.73 116.57 114.64 3hb9 h LYS 542 Ca 0.00 -0.39 -0.18 0.00 -2.81 0.00 0.00 60.65 57.27 3hb9 h LYS 542 Cb 0.49 0.12 -0.00 0.00 -1.00 0.00 0.00 32.23 31.84 3hb9 h LYS 542 CO 0.00 1.08 -0.57 1.96 -2.81 0.00 0.00 179.45 179.12 3hb9 h GLN 543 N 0.18 0.79 -0.76 1.90 7.50 -1.72 -2.72 115.11 120.27 3hb9 h GLN 543 Ca -0.08 -0.51 0.09 0.00 0.50 0.00 0.00 58.65 58.65 3hb9 h GLN 543 Cb 1.61 0.06 -0.07 0.00 0.05 0.00 0.00 27.48 29.14 3hb9 h GLN 543 CO 0.16 1.14 0.42 1.25 -1.50 0.00 0.00 178.83 180.30 3hb9 h LEU 544 N 0.60 0.59 -0.62 1.46 5.85 -1.54 -0.72 115.31 120.93 3hb9 h LEU 544 Ca 0.01 0.05 -0.02 0.00 0.84 0.00 0.00 57.88 58.75 3hb9 h LEU 544 Cb 1.16 -0.06 -0.03 0.00 0.37 0.00 0.00 40.66 42.10 3hb9 h LEU 544 CO 0.12 0.34 0.29 0.25 -0.34 0.00 0.00 178.44 179.10 3hb9 h LEU 545 N 0.72 0.82 -0.34 2.25 5.85 -1.42 0.21 115.31 123.40 3hb9 h LEU 545 Ca 0.37 -0.14 0.00 0.00 0.84 0.00 0.00 57.88 58.95 3hb9 h LEU 545 Cb 0.34 -0.21 0.00 0.00 0.37 0.00 0.00 40.66 41.15 3hb9 h LEU 545 CO -0.24 0.73 0.00 0.47 -0.34 0.00 0.00 178.44 179.06 3hb9 n ASP 546 N -4.49 0.26 -0.05 1.25 8.00 -0.68 -1.83 116.55 119.00 3hb9 n ASP 546 Ca 0.04 0.57 -0.06 0.00 0.71 0.00 0.00 54.79 56.06 3hb9 n ASP 546 Cb 0.13 -0.63 -0.02 0.00 -0.02 0.00 0.00 41.12 40.59 3hb9 n ASP 546 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 3hb9 n GLU 547 N -1.80 0.33 0.00 -1.24 -0.58 -0.36 -4.82 120.64 112.17 3hb9 n GLU 547 Ca 0.02 0.13 0.10 0.00 -0.42 0.00 0.00 57.16 56.99 3hb9 n GLU 547 Cb 0.16 -1.07 0.04 0.00 -0.57 0.00 0.00 31.44 30.00 3hb9 n GLU 547 CO 0.00 0.00 0.00 1.33 -0.48 0.00 0.00 177.13 177.98 3hb9 n VAL 548 N -3.78 0.00 -0.40 2.62 0.24 0.66 -5.10 118.33 112.59 3hb9 n VAL 548 Ca -0.09 -0.40 0.05 0.00 -2.04 0.00 0.00 64.34 61.86 3hb9 n VAL 548 Cb 0.33 1.32 -0.02 0.00 -1.47 0.00 0.00 33.84 34.00 3hb9 n VAL 548 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3hb9 n GLY 549 N 1.19 -1.84 0.10 7.63 0.00 -0.76 -3.06 105.19 108.45 3hb9 n GLY 549 Ca 0.10 -1.41 -0.09 0.00 0.00 0.00 0.00 46.02 44.62 3hb9 n GLY 549 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3hb9 h PRO 550 N -0.38 0.05 -0.90 1.61 0.11 -1.81 -0.11 132.00 130.57 3hb9 h PRO 550 Ca -0.01 -0.00 0.02 0.00 0.11 0.00 0.00 66.00 66.12 3hb9 h PRO 550 Cb 0.37 -0.01 -0.05 0.00 0.11 0.00 0.00 31.00 31.42 3hb9 h PRO 550 CO 0.01 0.03 0.59 1.57 -0.21 0.00 0.00 178.00 179.99 3hb9 h LYS 551 N 0.05 1.14 -0.61 1.05 -0.00 -1.95 -0.93 116.57 115.32 3hb9 h LYS 551 Ca 0.09 -0.07 -0.04 0.00 -0.00 0.00 0.00 60.65 60.63 3hb9 h LYS 551 Cb 0.11 -0.26 -0.03 0.00 -0.00 0.00 0.00 32.23 32.05 3hb9 h LYS 551 CO -0.15 0.76 0.22 0.78 -0.00 0.00 0.00 179.45 181.06 3hb9 h GLY 552 N 1.18 0.97 0.94 0.07 0.00 -1.30 -0.29 103.07 104.64 3hb9 h GLY 552 Ca 0.34 -0.52 -0.05 0.00 0.00 0.00 0.00 47.33 47.11 3hb9 h GLY 552 CO -0.09 0.49 0.07 -2.08 0.00 0.00 0.00 176.54 174.93 3hb9 h VAL 553 N 0.89 1.24 -0.88 4.60 2.07 -0.51 -1.58 116.25 122.08 3hb9 h VAL 553 Ca 0.21 -0.85 0.02 0.00 0.82 0.00 0.00 66.70 66.89 3hb9 h VAL 553 Cb 0.21 1.02 -0.05 0.00 -1.52 0.00 0.00 31.29 30.95 3hb9 h VAL 553 CO -0.01 0.29 0.58 0.00 0.02 0.00 0.00 177.57 178.45 3hb9 h ALA 554 N 0.93 1.13 -0.03 1.67 0.00 -0.67 -0.82 119.26 121.47 3hb9 h ALA 554 Ca 0.12 -0.05 -0.08 0.00 0.00 0.00 0.00 54.91 54.90 3hb9 h ALA 554 Cb 0.36 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 3hb9 h ALA 554 CO 0.01 0.48 -0.35 0.93 0.00 0.00 0.00 179.25 180.31 3hb9 h GLU 555 N 1.16 0.06 -0.09 0.00 4.39 -0.92 -3.06 114.58 116.12 3hb9 h GLU 555 Ca 0.33 -0.02 -0.22 0.00 0.34 0.00 0.00 59.36 59.79 3hb9 h GLU 555 Cb -0.08 -0.00 0.01 0.00 -0.10 0.00 0.00 28.75 28.57 3hb9 h GLU 555 CO -0.09 0.41 -0.84 2.35 -1.16 0.00 0.00 179.01 179.68 3hb9 h TRP 556 N 0.05 0.88 0.10 4.33 7.01 -0.49 -3.33 115.95 124.50 3hb9 h TRP 556 Ca 0.00 -0.42 -0.00 0.00 2.11 0.00 0.00 58.89 60.58 3hb9 h TRP 556 Cb 0.65 -0.12 0.00 0.00 -2.10 0.00 0.00 29.16 27.58 3hb9 h TRP 556 CO 0.00 1.23 -0.05 0.28 -2.79 0.00 0.00 178.44 177.11 3hb9 h VAL 557 N 0.41 0.94 0.00 2.65 2.07 -1.08 -2.77 116.25 118.48 3hb9 h VAL 557 Ca -0.07 -0.16 0.00 0.00 0.82 0.00 0.00 66.70 67.30 3hb9 h VAL 557 Cb 1.46 1.05 0.00 0.00 -1.52 0.00 0.00 31.29 32.27 3hb9 h VAL 557 CO 0.16 0.04 0.00 2.29 0.02 0.00 0.00 177.57 180.08 3hb9 n LYS 558 N -5.12 0.77 0.00 1.57 2.85 -1.21 -1.84 118.16 115.19 3hb9 n LYS 558 Ca -0.08 0.00 0.11 0.00 -1.05 0.00 0.00 58.31 57.29 3hb9 n LYS 558 Cb 0.11 -1.40 0.09 0.00 -0.65 0.00 0.00 35.03 33.18 3hb9 n LYS 558 CO 0.00 0.00 0.00 1.17 -0.05 0.00 0.00 177.40 178.52 3hb9 n LYS 559 N -0.90 0.53 -3.21 -1.58 4.81 -1.05 -4.93 118.16 111.83 3hb9 n LYS 559 Ca 0.15 -0.39 -0.39 0.00 -0.87 0.00 0.00 58.31 56.81 3hb9 n LYS 559 Cb 0.07 -1.49 -0.06 0.00 0.02 0.00 0.00 35.03 33.57 3hb9 n LYS 559 CO 0.00 0.00 0.00 -0.65 1.17 0.00 0.00 177.40 177.92 3hb9 s GLN 560 N -2.74 4.30 0.09 1.64 -1.52 -0.76 -4.97 119.66 115.69 3hb9 s GLN 560 Ca 0.15 0.56 -0.13 0.00 -1.95 0.00 0.00 55.36 53.98 3hb9 s GLN 560 Cb 0.18 -3.49 -0.16 0.00 -0.22 0.00 0.00 33.01 29.31 3hb9 s GLN 560 CO 0.68 -0.01 1.29 0.22 -0.25 0.00 0.00 175.29 177.22 3hb9 h ASP 561 N 7.04 0.92 -4.14 5.90 3.58 -1.91 -3.45 116.42 124.36 3hb9 h ASP 561 Ca -0.37 -0.64 -0.54 0.00 0.42 0.00 0.00 57.03 55.90 3hb9 h ASP 561 Cb 1.17 -0.27 0.14 0.00 1.72 0.00 0.00 39.33 42.09 3hb9 h ASP 561 CO 0.76 1.41 0.45 -1.81 -2.88 0.00 0.00 179.24 177.16 3hb9 s ASP 562 N -7.09 4.63 -0.24 2.28 1.11 -1.26 -4.75 116.67 111.35 3hb9 s ASP 562 Ca -0.11 2.41 -0.26 0.00 0.18 0.00 0.00 52.55 54.78 3hb9 s ASP 562 Cb 0.08 -2.60 -0.00 0.00 1.07 0.00 0.00 42.92 41.47 3hb9 s ASP 562 CO 0.90 -1.98 0.90 -0.69 1.18 0.00 0.00 175.17 175.48 3hb9 s VAL 563 N -1.74 4.79 0.40 -1.27 1.01 -0.41 -4.90 120.40 118.28 3hb9 s VAL 563 Ca 0.77 1.73 -0.16 0.00 0.00 0.00 0.00 61.98 64.32 3hb9 s VAL 563 Cb -0.31 -4.18 -0.09 0.00 0.00 0.00 0.00 36.38 31.80 3hb9 s VAL 563 CO 0.40 -0.11 0.84 -0.76 0.00 0.00 0.00 175.10 175.48 3hb9 s LEU 564 N 2.94 3.90 0.14 3.92 1.43 -0.42 -1.50 118.68 129.09 3hb9 s LEU 564 Ca 0.38 1.41 0.08 0.00 -1.03 0.00 0.00 54.13 54.97 3hb9 s LEU 564 Cb -0.15 -4.26 -0.04 0.00 0.03 0.00 0.00 46.19 41.77 3hb9 s LEU 564 CO 0.07 -0.35 -0.19 -1.48 0.23 0.00 0.00 176.35 174.63 3hb9 s LEU 565 N -3.41 2.39 -0.18 1.79 0.05 -1.26 -1.78 118.68 116.28 3hb9 s LEU 565 Ca 0.56 -0.80 0.00 0.00 0.05 0.00 0.00 54.13 53.95 3hb9 s LEU 565 Cb -0.10 -0.84 0.01 0.00 -2.05 0.00 0.00 46.19 43.22 3hb9 s LEU 565 CO 0.22 -0.00 -0.18 -0.89 -0.55 0.00 0.00 176.35 174.94 3hb9 s THR 566 N -1.73 2.27 0.11 5.48 2.01 0.88 -1.10 115.64 123.57 3hb9 s THR 566 Ca 0.12 -0.87 -0.29 0.00 0.31 0.00 0.00 61.69 60.96 3hb9 s THR 566 Cb -0.07 -1.96 -0.06 0.00 0.01 0.00 0.00 72.50 70.42 3hb9 s THR 566 CO 0.06 0.52 0.92 -0.62 -0.69 0.00 0.00 174.62 174.81 3hb9 s ASP 567 N 1.23 7.46 -0.05 3.53 2.15 -1.07 -0.53 116.67 129.38 3hb9 s ASP 567 Ca 0.03 1.74 0.07 0.00 0.43 0.00 0.00 52.55 54.83 3hb9 s ASP 567 Cb -0.14 -2.57 0.11 0.00 -0.30 0.00 0.00 42.92 40.02 3hb9 s ASP 567 CO -0.10 -0.03 1.06 0.35 -0.17 0.00 0.00 175.17 176.28 3hb9 n THR 568 N 2.66 1.33 -0.13 1.71 -2.24 0.80 -0.28 114.28 118.13 3hb9 n THR 568 Ca 0.01 -1.47 0.12 0.00 -2.27 0.00 0.00 64.05 60.44 3hb9 n THR 568 Cb 0.49 0.22 0.48 0.00 -2.10 0.00 0.00 70.33 69.42 3hb9 n THR 568 CO 0.00 0.00 0.00 0.74 -0.57 0.00 0.00 175.07 175.24 3hb9 h THR 569 N 0.00 0.88 -0.00 4.28 2.02 -1.79 -0.63 112.91 117.67 3hb9 h THR 569 Ca 0.00 -0.16 0.00 0.00 0.77 0.00 0.00 66.41 67.02 3hb9 h THR 569 Cb 0.69 0.37 0.00 0.00 -1.74 0.00 0.00 68.15 67.46 3hb9 h THR 569 CO 0.00 0.09 -0.03 0.49 0.37 0.00 0.00 175.52 176.43 3hb9 n PHE 570 N -4.48 0.00 0.00 3.16 3.01 -1.25 -4.31 117.46 113.59 3hb9 n PHE 570 Ca 0.12 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.58 3hb9 n PHE 570 Cb 0.40 -0.43 0.00 0.00 -0.01 0.00 0.00 39.48 39.44 3hb9 n PHE 570 CO 0.00 0.00 0.00 -2.13 1.01 0.00 0.00 176.76 175.64 3hb9 n ARG 571 N -1.44 0.00 0.10 -1.08 0.00 -0.61 -4.65 116.66 108.99 3hb9 n ARG 571 Ca 0.09 0.00 -0.02 0.00 -0.00 0.00 0.00 57.85 57.91 3hb9 n ARG 571 Cb 0.32 0.00 0.20 0.00 0.00 0.00 0.00 32.46 32.98 3hb9 n ARG 571 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.63 177.85 3hb9 h ASP 572 N 0.00 0.22 -0.43 6.15 -0.00 -1.63 -1.80 116.42 118.92 3hb9 h ASP 572 Ca 0.00 -0.10 0.08 0.00 -0.00 0.00 0.00 57.03 57.01 3hb9 h ASP 572 Cb 0.00 -0.06 -0.07 0.00 -0.00 0.00 0.00 39.33 39.19 3hb9 h ASP 572 CO 0.00 0.66 -0.03 0.00 -0.00 0.00 0.00 179.24 179.86 3hb9 h ALA 573 N 1.35 0.37 0.00 -0.78 0.00 -1.39 -2.04 119.26 116.76 3hb9 h ALA 573 Ca 0.01 0.14 -0.04 0.00 0.00 0.00 0.00 54.91 55.02 3hb9 h ALA 573 Cb 0.90 0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.94 3hb9 h ALA 573 CO 0.07 -0.41 -1.00 1.12 0.00 0.00 0.00 179.25 179.03 3hb9 h HIS 574 N 0.07 0.00 -0.20 0.00 2.07 -1.73 -2.46 115.15 112.91 3hb9 h HIS 574 Ca 0.21 0.00 0.05 0.00 -2.85 0.00 0.00 60.37 57.79 3hb9 h HIS 574 Cb 0.32 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 30.29 3hb9 h HIS 574 CO -0.31 0.13 0.14 0.37 -3.07 0.00 0.00 177.93 175.19 3hb9 h GLN 575 N 0.00 0.02 0.00 5.12 4.15 -0.84 0.21 115.11 123.77 3hb9 h GLN 575 Ca -0.03 -0.00 -0.16 0.00 0.77 0.00 0.00 58.65 59.23 3hb9 h GLN 575 Cb 1.13 -0.01 -0.03 0.00 0.21 0.00 0.00 27.48 28.78 3hb9 h GLN 575 CO 0.01 0.01 -2.02 -1.13 -1.93 0.00 0.00 178.83 173.77 3hb9 n SER 576 N -4.48 0.73 -0.09 -0.69 3.41 -0.81 -3.95 113.62 107.73 3hb9 n SER 576 Ca 0.02 0.00 -0.13 0.00 -0.26 0.00 0.00 58.87 58.49 3hb9 n SER 576 Cb 0.27 1.39 -0.14 0.00 -0.26 0.00 0.00 64.21 65.46 3hb9 n SER 576 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3hb9 n LEU 577 N -2.40 1.28 -0.78 1.04 4.77 -0.93 -4.65 117.00 115.33 3hb9 n LEU 577 Ca -0.16 0.05 0.06 0.00 -0.03 0.00 0.00 56.01 55.92 3hb9 n LEU 577 Cb 0.78 -0.13 0.14 0.00 -2.33 0.00 0.00 43.42 41.87 3hb9 n LEU 577 CO 0.38 0.65 0.29 0.18 -1.33 0.00 0.00 177.39 177.56 3hb9 n LEU 578 N -3.02 2.02 -4.06 2.23 4.77 0.57 -2.70 117.00 116.81 3hb9 n LEU 578 Ca -0.34 -3.10 -0.33 0.00 -0.03 0.00 0.00 56.01 52.21 3hb9 n LEU 578 Cb 1.08 -0.34 0.00 0.00 -2.33 0.00 0.00 43.42 41.84 3hb9 n LEU 578 CO 0.38 1.00 0.04 0.00 -1.33 0.00 0.00 177.39 177.49 3hb9 n ALA 579 N -0.64 -1.28 -1.36 -1.18 0.00 -0.94 -1.52 120.51 113.60 3hb9 n ALA 579 Ca 0.14 0.10 -0.12 0.00 0.00 0.00 0.00 53.44 53.55 3hb9 n ALA 579 Cb 0.81 -3.99 -0.05 0.00 0.00 0.00 0.00 19.45 16.22 3hb9 n ALA 579 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 3hb9 n THR 580 N -4.54 0.00 1.74 0.00 -1.04 -0.15 -4.87 114.28 105.42 3hb9 n THR 580 Ca 0.05 0.00 0.15 0.00 -2.04 0.00 0.00 64.05 62.21 3hb9 n THR 580 Cb 0.51 -1.58 0.73 0.00 -1.82 0.00 0.00 70.33 68.16 3hb9 n THR 580 CO 0.00 0.00 0.00 0.54 -0.64 0.00 0.00 175.07 174.97 3hb9 n ARG 581 N -1.05 1.35 -2.02 -2.82 5.12 -0.57 -4.83 116.66 111.83 3hb9 n ARG 581 Ca -0.12 -0.51 -0.42 0.00 -1.93 0.00 0.00 57.85 54.87 3hb9 n ARG 581 Cb 0.61 -1.49 -0.03 0.00 -1.16 0.00 0.00 32.46 30.39 3hb9 n ARG 581 CO 0.00 0.00 0.00 0.08 -1.93 0.00 0.00 177.63 175.78 3hb9 s VAL 582 N -2.00 3.01 0.51 1.55 1.01 -1.26 -4.98 120.40 118.23 3hb9 s VAL 582 Ca 0.43 0.65 -0.05 0.00 0.00 0.00 0.00 61.98 63.01 3hb9 s VAL 582 Cb 0.21 -3.42 -0.02 0.00 0.00 0.00 0.00 36.38 33.16 3hb9 s VAL 582 CO 0.35 0.03 0.81 -0.13 0.00 0.00 0.00 175.10 176.16 3hb9 s ARG 583 N 1.60 3.28 0.23 2.72 0.52 -1.26 -5.00 118.95 121.03 3hb9 s ARG 583 Ca 0.69 0.05 -0.08 0.00 -0.52 0.00 0.00 55.73 55.87 3hb9 s ARG 583 Cb -0.40 -2.36 0.24 0.00 0.52 0.00 0.00 34.95 32.95 3hb9 s ARG 583 CO 0.31 -0.37 1.87 1.15 0.02 0.00 0.00 175.30 178.28 3hb9 h THR 584 N 0.12 1.14 -0.78 0.02 2.02 -1.94 -2.98 112.91 110.50 3hb9 h THR 584 Ca -0.46 -0.36 0.18 0.00 0.77 0.00 0.00 66.41 66.54 3hb9 h THR 584 Cb 1.23 0.00 -0.14 0.00 -1.74 0.00 0.00 68.15 67.50 3hb9 h THR 584 CO 0.61 0.19 0.01 0.50 0.37 0.00 0.00 175.52 177.20 3hb9 h LYS 585 N 1.04 0.10 0.00 6.66 1.63 -1.88 0.29 116.57 124.41 3hb9 h LYS 585 Ca 0.33 -0.01 -0.09 0.00 -0.85 0.00 0.00 60.65 60.03 3hb9 h LYS 585 Cb -0.01 -0.02 -0.01 0.00 -0.60 0.00 0.00 32.23 31.59 3hb9 h LYS 585 CO -0.11 0.06 -0.42 -0.44 -3.45 0.00 0.00 179.45 175.09 3hb9 h ASP 586 N 0.10 0.00 0.11 4.20 3.45 -1.90 -1.93 116.42 120.44 3hb9 h ASP 586 Ca 0.43 0.00 -0.15 0.00 0.43 0.00 0.00 57.03 57.75 3hb9 h ASP 586 Cb 0.78 0.00 0.02 0.00 -0.56 0.00 0.00 39.33 39.57 3hb9 h ASP 586 CO -0.69 0.42 -0.64 0.24 -1.57 0.00 0.00 179.24 177.01 3hb9 h MET 587 N 0.00 0.24 -0.11 3.56 2.86 -0.79 -3.26 114.93 117.43 3hb9 h MET 587 Ca -0.00 -0.40 -0.07 0.00 -2.06 0.00 0.00 59.70 57.16 3hb9 h MET 587 Cb 0.97 0.15 -0.01 0.00 0.06 0.00 0.00 31.60 32.77 3hb9 h MET 587 CO 0.06 1.19 -0.25 0.97 1.06 0.00 0.00 176.91 179.93 3hb9 h ILE 588 N -0.49 1.23 -0.46 -1.22 6.09 -0.58 -1.37 117.51 120.71 3hb9 h ILE 588 Ca -0.11 -1.07 0.01 0.00 -1.37 0.00 0.00 64.86 62.32 3hb9 h ILE 588 Cb 1.50 1.42 -0.02 0.00 0.47 0.00 0.00 36.82 40.19 3hb9 h ILE 588 CO 0.12 0.32 0.30 0.78 -3.07 0.00 0.00 178.15 176.60 3hb9 h ASN 589 N 0.18 0.52 0.03 2.19 -0.26 -1.45 -3.00 115.58 113.79 3hb9 h ASN 589 Ca 0.03 -0.01 0.00 0.00 -0.56 0.00 0.00 56.30 55.76 3hb9 h ASN 589 Cb 0.55 -0.13 0.00 0.00 -1.06 0.00 0.00 38.32 37.68 3hb9 h ASN 589 CO 0.04 0.37 -0.11 0.00 -1.06 0.00 0.00 177.43 176.67 3hb9 n ILE 590 N -4.77 0.00 -0.16 2.81 0.13 -1.12 -4.48 119.36 111.77 3hb9 n ILE 590 Ca 0.02 -0.29 -0.02 0.00 -1.10 0.00 0.00 62.75 61.36 3hb9 n ILE 590 Cb 0.03 0.83 0.07 0.00 -0.84 0.00 0.00 39.64 39.72 3hb9 n ILE 590 CO 0.00 0.00 0.00 0.00 2.80 0.00 0.00 176.55 179.35 3hb9 h ALA 591 N 4.25 0.57 -0.47 1.51 0.00 -1.10 0.21 119.26 124.24 3hb9 h ALA 591 Ca 0.00 0.11 0.01 0.00 0.00 0.00 0.00 54.91 55.03 3hb9 h ALA 591 Cb 0.66 0.14 -0.03 0.00 0.00 0.00 0.00 17.79 18.57 3hb9 h ALA 591 CO 0.00 -0.31 0.30 0.66 0.00 0.00 0.00 179.25 179.90 3hb9 h SER 592 N 0.24 0.50 -0.61 0.00 4.64 -1.78 0.23 113.55 116.77 3hb9 h SER 592 Ca 0.25 -0.01 -0.07 0.00 -0.47 0.00 0.00 61.79 61.49 3hb9 h SER 592 Cb 0.34 -0.12 -0.02 0.00 -0.31 0.00 0.00 62.40 62.29 3hb9 h SER 592 CO -0.33 0.36 0.09 0.50 -0.87 0.00 0.00 176.83 176.58 3hb9 h LYS 593 N 0.60 1.01 -0.31 4.77 1.63 -1.64 -2.98 116.57 119.66 3hb9 h LYS 593 Ca 0.18 -0.28 0.02 0.00 -0.85 0.00 0.00 60.65 59.72 3hb9 h LYS 593 Cb -0.03 -0.11 -0.02 0.00 -0.60 0.00 0.00 32.23 31.46 3hb9 h LYS 593 CO -0.06 0.95 0.16 1.15 -3.45 0.00 0.00 179.45 178.20 3hb9 h THR 594 N 0.91 1.00 -0.97 1.00 2.02 0.06 -0.28 112.91 116.66 3hb9 h THR 594 Ca 0.18 -0.11 0.13 0.00 0.77 0.00 0.00 66.41 67.38 3hb9 h THR 594 Cb 0.44 0.64 -0.08 0.00 -1.74 0.00 0.00 68.15 67.41 3hb9 h THR 594 CO 0.01 0.06 0.61 0.00 0.37 0.00 0.00 175.52 176.58 3hb9 h ALA 595 N 1.15 1.62 0.04 6.16 0.00 -0.44 -0.59 119.26 127.21 3hb9 h ALA 595 Ca 0.13 0.02 -0.00 0.00 0.00 0.00 0.00 54.91 55.06 3hb9 h ALA 595 Cb 0.03 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.65 3hb9 h ALA 595 CO -0.08 0.12 -0.02 0.22 0.00 0.00 0.00 179.25 179.49 3hb9 h ASP 596 N 0.89 -0.05 -0.71 0.00 3.58 -1.33 -2.91 116.42 115.89 3hb9 h ASP 596 Ca 0.49 -0.55 0.07 0.00 0.42 0.00 0.00 57.03 57.46 3hb9 h ASP 596 Cb 0.59 0.01 -0.06 0.00 1.72 0.00 0.00 39.33 41.59 3hb9 h ASP 596 CO -0.26 0.55 0.40 0.58 -2.88 0.00 0.00 179.24 177.63 3hb9 h VAL 597 N -0.68 0.96 -0.89 2.25 2.07 -0.55 -2.37 116.25 117.03 3hb9 h VAL 597 Ca -0.01 -0.25 -0.53 0.00 0.82 0.00 0.00 66.70 66.74 3hb9 h VAL 597 Cb 0.60 0.18 -0.28 0.00 -1.52 0.00 0.00 31.29 30.26 3hb9 h VAL 597 CO 0.01 0.13 0.53 0.49 0.02 0.00 0.00 177.57 178.75 3hb9 n PHE 598 N -4.77 2.82 0.02 1.57 3.01 -0.28 -3.97 117.46 115.88 3hb9 n PHE 598 Ca 0.10 -2.25 0.10 0.00 1.01 0.00 0.00 57.45 56.41 3hb9 n PHE 598 Cb 0.19 -1.02 0.54 0.00 -0.01 0.00 0.00 39.48 39.18 3hb9 n PHE 598 CO 0.00 0.00 0.00 1.57 1.01 0.00 0.00 176.76 179.34 3hb9 h LYS 599 N 1.42 0.29 -0.51 -1.08 2.10 -1.21 -1.90 116.57 115.69 3hb9 h LYS 599 Ca 0.55 -0.02 0.00 0.00 -2.00 0.00 0.00 60.65 59.18 3hb9 h LYS 599 Cb 1.90 -0.07 0.00 0.00 -0.90 0.00 0.00 32.23 33.17 3hb9 h LYS 599 CO 1.15 0.19 0.00 -0.25 -2.00 0.00 0.00 179.45 178.55 3hb9 n ASP 600 N -4.47 3.44 -4.82 7.07 8.00 -1.26 -4.52 116.55 119.98 3hb9 n ASP 600 Ca 0.05 -2.05 -0.32 0.00 0.71 0.00 0.00 54.79 53.18 3hb9 n ASP 600 Cb 0.27 -0.36 -0.00 0.00 -0.02 0.00 0.00 41.12 41.01 3hb9 n ASP 600 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 3hb9 s GLY 601 N -1.02 2.09 0.01 0.44 0.00 -0.72 -4.82 107.32 103.31 3hb9 s GLY 601 Ca 0.35 0.31 -0.26 0.00 0.00 0.00 0.00 44.72 45.12 3hb9 s GLY 601 CO 0.23 0.61 1.16 -2.75 0.00 0.00 0.00 173.10 172.35 3hb9 h PHE 602 N 0.56 -0.72 -3.71 1.90 3.57 -1.43 -3.43 116.94 113.69 3hb9 h PHE 602 Ca -0.47 -0.02 -0.08 0.00 3.53 0.00 0.00 57.97 60.94 3hb9 h PHE 602 Cb 1.21 0.24 -0.11 0.00 2.79 0.00 0.00 35.95 40.07 3hb9 h PHE 602 CO 0.60 -0.39 -0.20 -1.54 -2.23 0.00 0.00 178.31 174.56 3hb9 s SER 603 N -4.66 -0.06 -0.25 0.41 1.04 -1.22 -3.64 113.70 105.32 3hb9 s SER 603 Ca -0.14 -0.81 -0.02 0.00 0.48 0.00 0.00 55.95 55.46 3hb9 s SER 603 Cb 0.02 0.51 0.02 0.00 0.10 0.00 0.00 66.02 66.66 3hb9 s SER 603 CO 0.46 -0.99 -0.04 -0.76 0.98 0.00 0.00 173.24 172.89 3hb9 s LEU 604 N -2.96 3.24 -0.29 2.42 1.43 0.36 -2.61 118.68 120.27 3hb9 s LEU 604 Ca 0.17 -0.81 -0.29 0.00 -1.03 0.00 0.00 54.13 52.17 3hb9 s LEU 604 Cb 0.01 -1.69 0.01 0.00 0.03 0.00 0.00 46.19 44.55 3hb9 s LEU 604 CO 0.02 -0.13 1.10 -0.70 0.23 0.00 0.00 176.35 176.87 3hb9 s GLU 605 N 1.36 4.10 0.00 1.70 2.12 0.62 -0.46 118.70 128.14 3hb9 s GLU 605 Ca 0.01 1.18 0.00 0.00 0.36 0.00 0.00 54.97 56.52 3hb9 s GLU 605 Cb -0.16 -3.73 0.00 0.00 0.26 0.00 0.00 34.13 30.49 3hb9 s GLU 605 CO -0.04 -0.85 0.20 0.00 -0.54 0.00 0.00 175.26 174.03 3hb9 n MET 606 N 6.78 0.00 -3.77 4.30 0.00 -0.88 -3.15 117.12 120.40 3hb9 n MET 606 Ca 0.12 -0.20 -0.10 0.00 0.00 0.00 0.00 57.70 57.53 3hb9 n MET 606 Cb 0.47 -0.33 -0.05 0.00 0.00 0.00 0.00 33.22 33.31 3hb9 n MET 606 CO 0.00 0.00 0.00 -0.46 0.00 0.00 0.00 175.97 175.51 3hb9 s TRP 607 N 0.00 0.01 0.00 3.17 -0.00 -1.24 -4.75 118.94 116.13 3hb9 s TRP 607 Ca 0.00 -0.36 0.00 0.00 -0.00 0.00 0.00 56.10 55.74 3hb9 s TRP 607 Cb 0.00 0.20 0.00 0.00 -0.00 0.00 0.00 33.47 33.67 3hb9 s TRP 607 CO 0.00 -0.77 0.00 0.41 -0.00 0.00 0.00 176.95 176.59 3hb9 n GLY 608 N -0.25 -1.83 7.00 5.86 0.00 -1.26 -2.68 105.19 112.03 3hb9 n GLY 608 Ca -0.12 -1.43 0.00 0.00 0.00 0.00 0.00 46.02 44.48 3hb9 n GLY 608 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hb9 n GLY 609 N 0.00 3.09 0.51 -0.02 0.00 -1.23 -2.48 105.19 105.06 3hb9 n GLY 609 Ca 0.00 -0.18 0.11 0.00 0.00 0.00 0.00 46.02 45.96 3hb9 n GLY 609 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 3hb9 n THR 610 N 0.00 0.00 -0.12 2.61 -1.04 -1.26 -4.57 114.28 109.91 3hb9 n THR 610 Ca 0.00 -0.26 -0.06 0.00 -2.04 0.00 0.00 64.05 61.68 3hb9 n THR 610 Cb 0.00 1.25 0.02 0.00 -1.82 0.00 0.00 70.33 69.78 3hb9 n THR 610 CO 0.00 0.00 0.00 0.71 -0.64 0.00 0.00 175.07 175.14 3hb9 h THR 611 N 2.49 0.96 0.07 12.58 1.35 -1.84 -1.10 112.91 127.43 3hb9 h THR 611 Ca 0.00 -0.13 0.02 0.00 -0.55 0.00 0.00 66.41 65.75 3hb9 h THR 611 Cb 0.76 0.56 -0.03 0.00 -1.73 0.00 0.00 68.15 67.70 3hb9 h THR 611 CO 0.00 0.07 -0.24 0.15 -0.25 0.00 0.00 175.52 175.25 3hb9 h PHE 612 N 0.38 -0.63 0.09 4.73 3.57 -1.80 0.26 116.94 123.54 3hb9 h PHE 612 Ca 0.16 0.02 -0.00 0.00 3.53 0.00 0.00 57.97 61.68 3hb9 h PHE 612 Cb 0.08 0.27 0.00 0.00 2.79 0.00 0.00 35.95 39.09 3hb9 h PHE 612 CO -0.11 -0.33 -0.04 0.22 -2.23 0.00 0.00 178.31 175.82 3hb9 h ASP 613 N -0.41 -0.11 -0.59 0.41 -0.00 -1.84 -2.89 116.42 111.00 3hb9 h ASP 613 Ca 0.04 -0.18 -0.06 0.00 -0.00 0.00 0.00 57.03 56.84 3hb9 h ASP 613 Cb 0.45 0.03 -0.02 0.00 -0.00 0.00 0.00 39.33 39.79 3hb9 h ASP 613 CO -0.16 0.12 0.15 0.58 -0.00 0.00 0.00 179.24 179.92 3hb9 h VAL 614 N -0.33 1.25 -0.07 2.25 2.07 -0.98 0.25 116.25 120.68 3hb9 h VAL 614 Ca -0.01 -0.89 0.03 0.00 0.82 0.00 0.00 66.70 66.65 3hb9 h VAL 614 Cb 0.28 0.71 -0.04 0.00 -1.52 0.00 0.00 31.29 30.71 3hb9 h VAL 614 CO 0.02 0.33 -0.17 0.00 0.02 0.00 0.00 177.57 177.78 3hb9 h ALA 615 N 1.03 -0.14 -0.62 1.67 0.00 -0.54 0.35 119.26 121.02 3hb9 h ALA 615 Ca 0.18 0.03 -0.09 0.00 0.00 0.00 0.00 54.91 55.04 3hb9 h ALA 615 Cb 0.34 0.31 -0.02 0.00 0.00 0.00 0.00 17.79 18.42 3hb9 h ALA 615 CO 0.00 -0.64 0.04 1.88 0.00 0.00 0.00 179.25 180.54 3hb9 h TYR 616 N -0.24 1.15 0.00 0.00 0.99 -1.27 0.15 116.97 117.74 3hb9 h TYR 616 Ca 0.08 -0.18 0.00 0.00 2.00 0.00 0.00 58.73 60.62 3hb9 h TYR 616 Cb 0.34 -0.30 0.00 0.00 1.00 0.00 0.00 36.73 37.77 3hb9 h TYR 616 CO -0.25 0.99 0.00 -1.71 -0.00 0.00 0.00 178.16 177.19 3hb9 n ASN 617 N -4.22 0.00 -0.06 3.88 4.05 0.84 -3.77 115.26 115.99 3hb9 n ASN 617 Ca 0.03 0.41 -0.14 0.00 0.45 0.00 0.00 54.58 55.33 3hb9 n ASN 617 Cb 0.32 -0.42 -0.12 0.00 1.23 0.00 0.00 39.78 40.79 3hb9 n ASN 617 CO 0.00 0.00 0.00 -0.26 -3.05 0.00 0.00 177.26 173.95 3hb9 h PHE 618 N 0.00 0.00 0.00 1.20 -1.00 -1.15 -3.31 116.94 112.69 3hb9 h PHE 618 Ca 0.00 -0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.78 3hb9 h PHE 618 Cb 0.00 -0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.56 3hb9 h PHE 618 CO 0.00 0.91 0.00 1.28 -1.61 0.00 0.00 178.31 178.89 3hb9 n LEU 619 N -4.66 0.00 -4.24 1.54 4.77 -0.90 -4.90 117.00 108.61 3hb9 n LEU 619 Ca -0.10 0.33 -0.30 0.00 -0.03 0.00 0.00 56.01 55.91 3hb9 n LEU 619 Cb 0.44 -0.33 -0.09 0.00 -2.33 0.00 0.00 43.42 41.11 3hb9 n LEU 619 CO 0.34 -0.05 -0.46 0.29 -1.33 0.00 0.00 177.39 176.18 3hb9 n LYS 620 N -1.33 -0.93 -4.12 3.23 4.76 -0.59 -4.82 118.16 114.37 3hb9 n LYS 620 Ca 0.11 0.09 -0.12 0.00 -2.87 0.00 0.00 58.31 55.51 3hb9 n LYS 620 Cb 0.22 -3.42 -0.11 0.00 -1.84 0.00 0.00 35.03 29.88 3hb9 n LYS 620 CO 0.00 0.00 0.00 -1.83 -1.37 0.00 0.00 177.40 174.20 3hb9 s GLU 621 N -7.21 0.69 -0.29 1.97 -1.05 0.41 -4.63 118.70 108.59 3hb9 s GLU 621 Ca 0.01 -1.04 -0.29 0.00 -0.15 0.00 0.00 54.97 53.50 3hb9 s GLU 621 Cb -0.00 -0.29 0.00 0.00 -0.44 0.00 0.00 34.13 33.40 3hb9 s GLU 621 CO 0.96 0.03 1.23 1.21 0.95 0.00 0.00 175.26 179.64 3hb9 s ASN 622 N -2.27 6.78 0.56 0.83 3.04 -1.26 -2.90 114.94 119.73 3hb9 s ASN 622 Ca 0.01 1.22 0.34 0.00 0.04 0.00 0.00 52.86 54.47 3hb9 s ASN 622 Cb -0.03 -2.54 1.57 0.00 -1.54 0.00 0.00 41.25 38.71 3hb9 s ASN 622 CO -0.02 -0.98 2.07 1.55 -3.04 0.00 0.00 177.10 176.68 3hb9 h PRO 623 N 8.82 0.00 -0.27 0.43 0.13 -1.89 -2.70 132.00 136.51 3hb9 h PRO 623 Ca -0.25 0.00 -0.15 0.00 -0.87 0.00 0.00 66.00 64.73 3hb9 h PRO 623 Cb 1.09 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.21 3hb9 h PRO 623 CO 1.03 0.04 -0.46 -1.49 -0.23 0.00 0.00 178.00 176.89 3hb9 h TRP 624 N 0.00 0.85 -0.51 1.56 4.06 -1.97 -1.85 115.95 118.09 3hb9 h TRP 624 Ca -0.00 -0.27 -0.11 0.00 2.06 0.00 0.00 58.89 60.57 3hb9 h TRP 624 Cb 0.40 -0.17 -0.02 0.00 -1.00 0.00 0.00 29.16 28.37 3hb9 h TRP 624 CO 0.00 1.03 -0.11 0.93 -3.56 0.00 0.00 178.44 176.73 3hb9 h GLU 625 N 0.56 0.94 0.20 0.49 5.08 -1.90 -0.27 114.58 119.68 3hb9 h GLU 625 Ca 0.03 -0.33 0.00 0.00 -1.00 0.00 0.00 59.36 58.06 3hb9 h GLU 625 Cb 1.01 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 30.18 3hb9 h GLU 625 CO 0.10 0.99 -0.18 -0.09 -1.00 0.00 0.00 179.01 178.82 3hb9 h ARG 626 N 0.84 -0.39 -0.62 2.33 2.43 -1.42 0.10 114.38 117.65 3hb9 h ARG 626 Ca 0.14 0.03 0.07 0.00 -0.81 0.00 0.00 59.98 59.40 3hb9 h ARG 626 Cb 0.64 0.09 -0.06 0.00 -0.42 0.00 0.00 29.97 30.22 3hb9 h ARG 626 CO 0.04 -0.26 0.31 1.25 -1.51 0.00 0.00 179.97 179.80 3hb9 h LEU 627 N -0.41 0.41 -0.10 3.80 5.85 -1.17 -1.25 115.31 122.45 3hb9 h LEU 627 Ca -0.00 0.05 -0.14 0.00 0.84 0.00 0.00 57.88 58.62 3hb9 h LEU 627 Cb 0.38 -0.03 0.01 0.00 0.37 0.00 0.00 40.66 41.39 3hb9 h LEU 627 CO -0.04 0.26 -0.50 -0.33 -0.34 0.00 0.00 178.44 177.50 3hb9 h GLU 628 N 0.56 0.51 -0.22 1.25 5.08 -0.91 -2.26 114.58 118.59 3hb9 h GLU 628 Ca 0.29 -0.42 -0.04 0.00 -1.00 0.00 0.00 59.36 58.19 3hb9 h GLU 628 Cb 0.25 0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.58 3hb9 h GLU 628 CO -0.22 1.05 -0.04 0.00 -1.00 0.00 0.00 179.01 178.80 3hb9 h ARG 629 N 0.11 0.41 -0.78 2.33 3.08 -0.72 -2.42 114.38 116.39 3hb9 h ARG 629 Ca -0.03 -0.15 0.06 0.00 0.07 0.00 0.00 59.98 59.92 3hb9 h ARG 629 Cb 1.14 -0.03 -0.06 0.00 0.08 0.00 0.00 29.97 31.11 3hb9 h ARG 629 CO 0.10 0.64 0.47 -0.07 -1.07 0.00 0.00 179.97 180.04 3hb9 h LEU 630 N 0.15 0.73 -0.25 3.04 3.38 -1.34 -2.34 115.31 118.69 3hb9 h LEU 630 Ca 0.06 0.02 0.04 0.00 0.09 0.00 0.00 57.88 58.09 3hb9 h LEU 630 Cb 0.48 -0.13 -0.04 0.00 0.09 0.00 0.00 40.66 41.06 3hb9 h LEU 630 CO 0.02 0.47 0.01 -0.09 0.09 0.00 0.00 178.44 178.94 3hb9 h ARG 631 N 0.86 0.09 -0.05 1.13 9.65 -1.17 0.47 114.38 125.37 3hb9 h ARG 631 Ca 0.34 -0.01 -0.08 0.00 -1.10 0.00 0.00 59.98 59.13 3hb9 h ARG 631 Cb 0.16 -0.02 -0.01 0.00 -1.39 0.00 0.00 29.97 28.71 3hb9 h ARG 631 CO -0.17 0.06 -0.35 -0.22 2.80 0.00 0.00 179.97 182.08 3hb9 h LYS 632 N 0.09 0.09 0.02 0.20 3.64 -1.32 -2.98 116.57 116.31 3hb9 h LYS 632 Ca 0.12 -0.03 -0.20 0.00 -1.27 0.00 0.00 60.65 59.26 3hb9 h LYS 632 Cb 0.15 -0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 31.95 3hb9 h LYS 632 CO -0.19 0.44 -0.92 0.00 -2.27 0.00 0.00 179.45 176.50 3hb9 h ALA 633 N 1.56 0.47 -2.66 5.00 0.00 -0.76 -3.39 119.26 119.49 3hb9 h ALA 633 Ca 0.01 -0.76 -0.61 0.00 0.00 0.00 0.00 54.91 53.55 3hb9 h ALA 633 Cb 0.67 -0.08 -0.41 0.00 0.00 0.00 0.00 17.79 17.97 3hb9 h ALA 633 CO 0.05 0.96 -0.68 -0.89 0.00 0.00 0.00 179.25 178.69 3hb9 n ILE 634 N -3.61 1.23 1.18 0.00 5.41 0.16 -4.55 119.36 119.18 3hb9 n ILE 634 Ca -0.03 -4.68 0.11 0.00 1.00 0.00 0.00 62.75 59.14 3hb9 n ILE 634 Cb 0.84 -2.07 0.37 0.00 -0.71 0.00 0.00 39.64 38.08 3hb9 n ILE 634 CO 0.00 0.00 0.00 -0.81 0.00 0.00 0.00 176.55 175.74 3hb9 n PRO 635 N 1.75 1.81 -0.03 0.38 -0.04 -1.19 -4.19 135.00 133.48 3hb9 n PRO 635 Ca 0.24 -1.21 0.03 0.00 -0.04 0.00 0.00 63.50 62.52 3hb9 n PRO 635 Cb 0.40 -1.42 -0.14 0.00 -0.04 0.00 0.00 33.50 32.30 3hb9 n PRO 635 CO 0.00 0.00 0.00 0.27 -0.04 0.00 0.00 175.50 175.73 3hb9 n ASN 636 N 0.44 0.89 -4.69 3.54 6.94 -1.26 -4.71 115.26 116.41 3hb9 n ASN 636 Ca 0.17 0.00 -0.33 0.00 -0.02 0.00 0.00 54.58 54.40 3hb9 n ASN 636 Cb 0.37 1.51 -0.09 0.00 -2.36 0.00 0.00 39.78 39.21 3hb9 n ASN 636 CO 0.00 0.00 0.00 -0.69 -1.03 0.00 0.00 177.26 175.54 3hb9 s VAL 637 N -2.96 4.23 0.33 3.53 1.01 -1.26 -1.82 120.40 123.47 3hb9 s VAL 637 Ca -0.07 -0.53 -0.29 0.00 0.00 0.00 0.00 61.98 61.09 3hb9 s VAL 637 Cb 0.09 -2.87 -0.11 0.00 0.00 0.00 0.00 36.38 33.48 3hb9 s VAL 637 CO 0.72 0.41 1.53 0.18 0.00 0.00 0.00 175.10 177.95 3hb9 n LEU 638 N 1.49 4.50 -4.67 3.92 4.77 -1.24 -4.60 117.00 121.17 3hb9 n LEU 638 Ca -0.15 1.19 -0.37 0.00 -0.03 0.00 0.00 56.01 56.65 3hb9 n LEU 638 Cb 0.53 -1.60 -0.09 0.00 -2.33 0.00 0.00 43.42 39.93 3hb9 n LEU 638 CO 0.33 0.12 -0.13 -0.36 -1.33 0.00 0.00 177.39 176.02 3hb9 s PHE 639 N -0.56 3.33 -0.02 -1.77 0.40 -1.26 -0.49 117.98 117.61 3hb9 s PHE 639 Ca 0.59 0.29 0.04 0.00 -0.60 0.00 0.00 56.93 57.24 3hb9 s PHE 639 Cb -0.49 -2.30 -0.03 0.00 0.51 0.00 0.00 43.02 40.70 3hb9 s PHE 639 CO 0.56 0.07 -0.11 -1.14 0.70 0.00 0.00 175.22 175.29 3hb9 s GLN 640 N 1.06 2.48 0.16 0.44 0.74 0.39 -0.27 119.66 124.66 3hb9 s GLN 640 Ca 0.09 -0.73 0.07 0.00 0.05 0.00 0.00 55.36 54.83 3hb9 s GLN 640 Cb -0.14 -2.41 -0.04 0.00 1.10 0.00 0.00 33.01 31.52 3hb9 s GLN 640 CO 0.05 0.61 -0.14 0.00 -0.55 0.00 0.00 175.29 175.25 3hb9 s MET 641 N -1.10 1.16 -0.10 1.67 0.23 -0.31 -2.07 119.30 118.79 3hb9 s MET 641 Ca 0.14 -1.42 -0.15 0.00 -1.03 0.00 0.00 55.69 53.24 3hb9 s MET 641 Cb -0.11 -0.97 -0.05 0.00 -1.53 0.00 0.00 34.83 32.17 3hb9 s MET 641 CO 0.04 0.17 0.36 -1.17 -2.03 0.00 0.00 175.02 172.39 3hb9 s LEU 642 N -2.90 4.33 -0.12 0.18 2.96 -1.09 -0.83 118.68 121.21 3hb9 s LEU 642 Ca 0.16 0.73 -0.01 0.00 -0.22 0.00 0.00 54.13 54.78 3hb9 s LEU 642 Cb -0.02 -2.50 0.03 0.00 0.50 0.00 0.00 46.19 44.20 3hb9 s LEU 642 CO 0.04 0.17 -0.05 -0.22 -1.32 0.00 0.00 176.35 174.97 3hb9 s LEU 643 N -0.08 1.13 -0.11 -0.68 2.96 0.36 -3.57 118.68 118.68 3hb9 s LEU 643 Ca 0.21 -0.34 -0.30 0.00 -0.22 0.00 0.00 54.13 53.48 3hb9 s LEU 643 Cb -0.15 -0.75 -0.02 0.00 0.50 0.00 0.00 46.19 45.77 3hb9 s LEU 643 CO 0.08 -0.16 1.15 -0.60 -1.32 0.00 0.00 176.35 175.51 3hb9 s ARG 644 N 1.76 4.33 0.38 1.98 3.52 0.48 -2.17 118.95 129.22 3hb9 s ARG 644 Ca 0.04 1.57 0.11 0.00 -0.13 0.00 0.00 55.73 57.32 3hb9 s ARG 644 Cb -0.13 -3.61 0.88 0.00 -1.56 0.00 0.00 34.95 30.53 3hb9 s ARG 644 CO -0.07 -0.50 1.90 0.00 -0.81 0.00 0.00 175.30 175.82 3hb9 h ALA 645 N 7.55 1.90 -0.24 6.12 0.00 -1.37 0.44 119.26 133.67 3hb9 h ALA 645 Ca -0.30 0.00 -0.16 0.00 0.00 0.00 0.00 54.91 54.46 3hb9 h ALA 645 Cb 1.13 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.81 3hb9 h ALA 645 CO 0.91 -0.10 -0.47 0.66 0.00 0.00 0.00 179.25 180.25 3hb9 h SER 646 N 0.61 0.83 0.00 0.00 4.64 -1.82 -3.41 113.55 114.40 3hb9 h SER 646 Ca 0.40 -0.54 -0.09 0.00 -0.47 0.00 0.00 61.79 61.08 3hb9 h SER 646 Cb 0.67 -0.24 -0.16 0.00 -0.31 0.00 0.00 62.40 62.36 3hb9 h SER 646 CO -0.16 1.22 -0.57 -0.46 -0.87 0.00 0.00 176.83 175.99 3hb9 n ASN 647 N -4.14 0.14 0.00 4.97 2.04 -1.02 -4.44 115.26 112.82 3hb9 n ASN 647 Ca -0.05 -1.84 0.00 0.00 -0.44 0.00 0.00 54.58 52.25 3hb9 n ASN 647 Cb 0.58 -0.10 0.00 0.00 -2.53 0.00 0.00 39.78 37.73 3hb9 n ASN 647 CO 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 177.26 176.82 3hb9 n ALA 648 N 0.18 0.00 -1.23 -2.53 0.00 0.15 -0.42 120.51 116.66 3hb9 n ALA 648 Ca -0.04 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.40 3hb9 n ALA 648 Cb 0.83 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.28 3hb9 n ALA 648 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 177.50 179.05 3hb9 n VAL 649 N 0.00 0.00 -0.43 0.00 3.14 -1.26 -0.39 118.33 119.39 3hb9 n VAL 649 Ca 0.00 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.38 3hb9 n VAL 649 Cb 0.00 1.40 0.00 0.00 -1.06 0.00 0.00 33.84 34.18 3hb9 n VAL 649 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 3hb9 n GLY 650 N 0.00 -1.32 0.00 7.55 0.00 0.44 -4.76 105.19 107.11 3hb9 n GLY 650 Ca 0.00 -1.59 0.00 0.00 0.00 0.00 0.00 46.02 44.43 3hb9 n GLY 650 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 173.32 174.90 3hb9 n TYR 651 N -1.15 0.00 -2.18 1.61 0.18 -1.26 -4.98 117.16 109.37 3hb9 n TYR 651 Ca 0.00 0.00 0.00 0.00 1.88 0.00 0.00 57.90 59.78 3hb9 n TYR 651 Cb 0.00 0.00 0.00 0.00 -0.38 0.00 0.00 39.34 38.96 3hb9 n TYR 651 CO 0.00 0.00 0.00 0.36 -2.08 0.00 0.00 176.86 175.14 3hb9 n LYS 652 N -1.80 3.26 -3.73 -3.48 2.85 -1.26 -5.13 118.16 108.87 3hb9 n LYS 652 Ca 0.00 0.00 -0.34 0.00 -1.05 0.00 0.00 58.31 56.92 3hb9 n LYS 652 Cb 0.41 0.00 -0.05 0.00 -0.65 0.00 0.00 35.03 34.74 3hb9 n LYS 652 CO 0.00 0.00 0.00 -0.80 -0.05 0.00 0.00 177.40 176.55 3hb9 s ASN 653 N -0.55 6.50 0.06 -5.58 0.01 -1.26 -4.75 114.94 109.37 3hb9 s ASN 653 Ca 0.00 0.58 0.03 0.00 -0.71 0.00 0.00 52.86 52.76 3hb9 s ASN 653 Cb 0.00 -2.09 -0.03 0.00 0.41 0.00 0.00 41.25 39.54 3hb9 s ASN 653 CO 0.00 0.19 -0.10 -0.31 -1.51 0.00 0.00 177.10 175.37 3hb9 s TYR 654 N -1.41 0.90 0.65 2.20 1.51 -1.26 -5.06 117.35 114.87 3hb9 s TYR 654 Ca 0.32 -0.49 -0.14 0.00 -1.01 0.00 0.00 57.07 55.74 3hb9 s TYR 654 Cb -0.13 -0.52 -0.01 0.00 -0.11 0.00 0.00 41.96 41.19 3hb9 s TYR 654 CO 0.19 -0.03 1.08 -1.25 -1.11 0.00 0.00 175.55 174.44 3hb9 s PRO 655 N -1.69 2.96 0.36 -1.71 0.04 -1.26 -4.52 135.00 129.17 3hb9 s PRO 655 Ca -0.06 1.26 0.15 0.00 0.04 0.00 0.00 61.00 62.39 3hb9 s PRO 655 Cb -0.10 -1.98 1.05 0.00 0.04 0.00 0.00 34.50 33.51 3hb9 s PRO 655 CO 0.01 -1.11 1.71 -0.44 0.04 0.00 0.00 177.00 177.22 3hb9 h ASP 656 N 0.01 0.53 0.72 6.66 5.19 -1.90 -0.28 116.42 127.35 3hb9 h ASP 656 Ca -0.46 0.14 -0.03 0.00 -0.62 0.00 0.00 57.03 56.05 3hb9 h ASP 656 Cb 1.23 0.06 -0.00 0.00 0.18 0.00 0.00 39.33 40.80 3hb9 h ASP 656 CO 0.55 0.01 -0.16 -0.55 -3.12 0.00 0.00 179.24 175.98 3hb9 h ASN 657 N 0.42 0.00 -0.13 6.45 -1.07 -1.97 -1.82 115.58 117.46 3hb9 h ASN 657 Ca 0.67 0.00 -0.10 0.00 0.07 0.00 0.00 56.30 56.94 3hb9 h ASN 657 Cb 1.54 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 37.79 3hb9 h ASN 657 CO -0.45 0.16 -0.31 0.58 0.07 0.00 0.00 177.43 177.48 3hb9 h VAL 658 N 0.00 1.37 -0.59 6.14 2.07 -1.40 -1.88 116.25 121.95 3hb9 h VAL 658 Ca -0.00 -1.59 -0.06 0.00 0.82 0.00 0.00 66.70 65.87 3hb9 h VAL 658 Cb 0.56 2.05 -0.03 0.00 -1.52 0.00 0.00 31.29 32.36 3hb9 h VAL 658 CO 0.02 0.47 0.14 0.40 0.02 0.00 0.00 177.57 178.62 3hb9 h ILE 659 N 0.04 1.24 0.11 4.57 5.03 -1.55 -2.76 117.51 124.20 3hb9 h ILE 659 Ca -0.00 -0.88 -0.01 0.00 -0.12 0.00 0.00 64.86 63.86 3hb9 h ILE 659 Cb 0.91 0.64 0.00 0.00 -3.03 0.00 0.00 36.82 35.34 3hb9 h ILE 659 CO 0.07 0.33 -0.05 0.45 -0.68 0.00 0.00 178.15 178.26 3hb9 h HIS 660 N 0.89 -0.14 -0.71 1.37 3.86 -1.31 -2.30 115.15 116.80 3hb9 h HIS 660 Ca 0.19 -0.00 0.01 0.00 -1.16 0.00 0.00 60.37 59.41 3hb9 h HIS 660 Cb 0.33 0.05 -0.04 0.00 1.06 0.00 0.00 27.41 28.81 3hb9 h HIS 660 CO 0.02 0.01 0.47 -0.22 0.86 0.00 0.00 177.93 179.07 3hb9 h LYS 661 N -0.26 0.93 0.14 2.45 3.64 -1.31 0.73 116.57 122.88 3hb9 h LYS 661 Ca -0.02 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.31 3hb9 h LYS 661 Cb 0.22 -0.21 -0.01 0.00 -0.41 0.00 0.00 32.23 31.81 3hb9 h LYS 661 CO 0.03 0.61 -0.13 0.35 -2.27 0.00 0.00 179.45 178.04 3hb9 h PHE 662 N 0.96 -0.32 -0.83 1.91 3.57 -1.49 -1.54 116.94 119.19 3hb9 h PHE 662 Ca 0.26 0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.75 3hb9 h PHE 662 Cb -0.10 0.12 -0.04 0.00 2.79 0.00 0.00 35.95 38.73 3hb9 h PHE 662 CO -0.03 -0.19 0.45 0.28 -2.23 0.00 0.00 178.31 176.59 3hb9 h VAL 663 N -0.28 1.24 0.00 1.41 2.07 -0.99 -0.16 116.25 119.54 3hb9 h VAL 663 Ca 0.00 -0.61 0.00 0.00 0.82 0.00 0.00 66.70 66.91 3hb9 h VAL 663 Cb 0.27 0.14 0.00 0.00 -1.52 0.00 0.00 31.29 30.17 3hb9 h VAL 663 CO -0.03 0.27 0.00 0.00 0.02 0.00 0.00 177.57 177.84 3hb9 n GLN 664 N -4.39 0.09 -0.06 1.57 10.64 0.21 -1.69 117.38 123.76 3hb9 n GLN 664 Ca 0.08 0.17 -0.04 0.00 -1.83 0.00 0.00 57.00 55.38 3hb9 n GLN 664 Cb 0.10 -1.63 -0.15 0.00 -0.86 0.00 0.00 30.24 27.70 3hb9 n GLN 664 CO 0.00 0.00 0.00 0.39 -1.83 0.00 0.00 177.06 175.62 3hb9 n GLU 665 N -1.80 0.67 0.10 2.61 -0.58 -0.59 -3.56 120.64 117.49 3hb9 n GLU 665 Ca 0.05 0.01 -0.03 0.00 -0.42 0.00 0.00 57.16 56.78 3hb9 n GLU 665 Cb 0.31 -1.58 -0.01 0.00 -0.57 0.00 0.00 31.44 29.59 3hb9 n GLU 665 CO 0.00 0.00 0.00 0.77 -0.48 0.00 0.00 177.13 177.42 3hb9 h SER 666 N 0.00 0.00 -0.20 1.62 0.02 -0.95 -1.69 113.55 112.35 3hb9 h SER 666 Ca -0.36 0.00 -0.20 0.00 -0.84 0.00 0.00 61.79 60.39 3hb9 h SER 666 Cb 1.89 0.00 0.01 0.00 0.14 0.00 0.00 62.40 64.43 3hb9 h SER 666 CO 0.03 0.77 -0.65 0.00 -1.14 0.00 0.00 176.83 175.84 3hb9 h ALA 667 N 1.23 0.35 0.00 3.77 0.00 -1.51 -0.34 119.26 122.76 3hb9 h ALA 667 Ca -0.01 -0.55 -0.04 0.00 0.00 0.00 0.00 54.91 54.31 3hb9 h ALA 667 Cb 1.52 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 19.26 3hb9 h ALA 667 CO 0.10 0.63 -0.19 0.87 0.00 0.00 0.00 179.25 180.66 3hb9 h LYS 668 N 0.54 0.00 0.07 0.00 1.57 -1.60 -3.27 116.57 113.88 3hb9 h LYS 668 Ca -0.02 0.00 -0.32 0.00 -1.87 0.00 0.00 60.65 58.44 3hb9 h LYS 668 Cb 1.27 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 33.55 3hb9 h LYS 668 CO 0.14 0.19 -1.78 0.00 -0.57 0.00 0.00 179.45 177.43 3hb9 h ALA 669 N 1.81 0.56 0.00 3.86 0.00 -1.20 -3.49 119.26 120.80 3hb9 h ALA 669 Ca -0.00 -1.38 0.00 0.00 0.00 0.00 0.00 54.91 53.53 3hb9 h ALA 669 Cb 0.47 0.53 0.00 0.00 0.00 0.00 0.00 17.79 18.79 3hb9 h ALA 669 CO 0.03 1.41 0.00 0.41 0.00 0.00 0.00 179.25 181.09 3hb9 n GLY 670 N 1.74 0.15 3.74 0.00 0.00 -0.78 -4.61 105.19 105.42 3hb9 n GLY 670 Ca -0.22 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.38 3hb9 n GLY 670 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3hb9 s ILE 671 N 0.00 3.15 -0.10 -0.61 1.09 -0.21 -4.47 121.20 120.06 3hb9 s ILE 671 Ca 0.00 0.96 -0.03 0.00 -1.10 0.00 0.00 60.65 60.48 3hb9 s ILE 671 Cb 0.00 -3.61 -0.05 0.00 -1.06 0.00 0.00 42.46 37.74 3hb9 s ILE 671 CO 0.00 0.15 -0.11 0.47 -0.10 0.00 0.00 174.94 175.35 3hb9 n ASP 672 N 2.51 1.65 -4.50 3.58 10.43 0.63 -4.38 116.55 126.48 3hb9 n ASP 672 Ca 0.06 0.06 -0.36 0.00 2.57 0.00 0.00 54.79 57.12 3hb9 n ASP 672 Cb 0.43 -0.24 -0.12 0.00 1.84 0.00 0.00 41.12 43.03 3hb9 n ASP 672 CO 0.00 0.00 0.00 -0.69 -1.07 0.00 0.00 177.20 175.44 3hb9 s VAL 673 N -2.18 4.37 -0.29 2.53 1.01 -0.66 -0.34 120.40 124.84 3hb9 s VAL 673 Ca -0.13 -0.16 -0.05 0.00 0.00 0.00 0.00 61.98 61.63 3hb9 s VAL 673 Cb 0.05 -3.01 0.02 0.00 0.00 0.00 0.00 36.38 33.43 3hb9 s VAL 673 CO 0.19 0.39 0.05 -0.36 0.00 0.00 0.00 175.10 175.36 3hb9 s PHE 674 N 1.16 3.14 -0.65 5.22 0.08 0.33 -1.16 117.98 126.10 3hb9 s PHE 674 Ca 0.04 -1.15 -0.23 0.00 0.12 0.00 0.00 56.93 55.71 3hb9 s PHE 674 Cb -0.14 -2.21 0.07 0.00 -0.57 0.00 0.00 43.02 40.16 3hb9 s PHE 674 CO 0.03 -0.62 0.97 0.50 -0.10 0.00 0.00 175.22 176.00 3hb9 s ARG 675 N 1.45 3.14 -0.30 0.44 3.52 -0.01 -0.47 118.95 126.71 3hb9 s ARG 675 Ca 0.02 -0.75 -0.16 0.00 -0.13 0.00 0.00 55.73 54.71 3hb9 s ARG 675 Cb -0.17 -4.21 -0.02 0.00 -1.56 0.00 0.00 34.95 28.99 3hb9 s ARG 675 CO 0.01 -1.79 0.42 0.42 -0.81 0.00 0.00 175.30 173.54 3hb9 s ILE 676 N 4.12 5.13 0.11 4.11 1.01 -0.41 -0.48 121.20 134.79 3hb9 s ILE 676 Ca 0.23 0.49 0.07 0.00 0.00 0.00 0.00 60.65 61.44 3hb9 s ILE 676 Cb -0.16 -3.79 -0.04 0.00 0.01 0.00 0.00 42.46 38.48 3hb9 s ILE 676 CO 0.11 0.03 -0.18 0.72 0.00 0.00 0.00 174.94 175.62 3hb9 s PHE 677 N 2.16 1.63 -0.02 3.97 -0.71 -0.92 -2.25 117.98 121.84 3hb9 s PHE 677 Ca 0.16 -0.46 0.03 0.00 -1.04 0.00 0.00 56.93 55.62 3hb9 s PHE 677 Cb -0.16 -0.87 -0.03 0.00 -1.21 0.00 0.00 43.02 40.75 3hb9 s PHE 677 CO 0.11 0.19 -0.07 0.34 -1.34 0.00 0.00 175.22 174.45 3hb9 s ASP 678 N -2.10 4.60 0.09 1.98 -1.08 -1.26 -1.01 116.67 117.88 3hb9 s ASP 678 Ca 0.07 -0.12 0.18 0.00 -0.52 0.00 0.00 52.55 52.16 3hb9 s ASP 678 Cb -0.08 -1.08 0.75 0.00 -1.46 0.00 0.00 42.92 41.04 3hb9 s ASP 678 CO 0.04 0.31 1.55 -1.20 0.52 0.00 0.00 175.17 176.39 3hb9 n SER 679 N 1.75 0.23 -0.02 -0.34 7.64 -1.26 -2.15 113.62 119.47 3hb9 n SER 679 Ca -0.16 0.56 0.01 0.00 1.01 0.00 0.00 58.87 60.28 3hb9 n SER 679 Cb 0.53 -0.61 0.01 0.00 -1.01 0.00 0.00 64.21 63.13 3hb9 n SER 679 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 3hb9 n LEU 680 N -1.76 1.47 -3.07 -3.43 4.77 -1.26 -4.28 117.00 109.45 3hb9 n LEU 680 Ca 0.03 -1.54 -0.23 0.00 -0.03 0.00 0.00 56.01 54.24 3hb9 n LEU 680 Cb 0.19 -0.03 0.03 0.00 -2.33 0.00 0.00 43.42 41.29 3hb9 n LEU 680 CO 0.16 0.38 -0.00 0.59 -1.33 0.00 0.00 177.39 177.19 3hb9 n ASN 681 N -0.42 -5.92 -4.47 -1.43 3.02 -0.91 -4.38 115.26 100.74 3hb9 n ASN 681 Ca 0.01 -0.30 -0.43 0.00 -0.03 0.00 0.00 54.58 53.82 3hb9 n ASN 681 Cb 0.35 -4.79 -0.05 0.00 -0.61 0.00 0.00 39.78 34.68 3hb9 n ASN 681 CO 0.00 0.00 0.00 0.86 -2.62 0.00 0.00 177.26 175.50 3hb9 s TRP 682 N -3.16 2.92 0.53 3.10 -0.00 -1.26 -4.92 118.94 116.14 3hb9 s TRP 682 Ca 0.32 -0.36 0.20 0.00 -0.00 0.00 0.00 56.10 56.26 3hb9 s TRP 682 Cb -0.14 -3.83 1.42 0.00 -0.00 0.00 0.00 33.47 30.92 3hb9 s TRP 682 CO 0.40 -1.22 2.16 0.28 -0.00 0.00 0.00 176.95 178.57 3hb9 h VAL 683 N 5.93 0.85 0.00 5.86 2.07 -1.96 -2.35 116.25 126.66 3hb9 h VAL 683 Ca -0.27 -0.08 0.00 0.00 0.82 0.00 0.00 66.70 67.17 3hb9 h VAL 683 Cb 1.08 1.05 0.00 0.00 -1.52 0.00 0.00 31.29 31.90 3hb9 h VAL 683 CO 1.04 0.02 0.00 -0.78 0.02 0.00 0.00 177.57 177.87 3hb9 h ASP 684 N 0.00 0.00 0.64 0.57 3.58 -2.01 -2.88 116.42 116.32 3hb9 h ASP 684 Ca -0.00 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.45 3hb9 h ASP 684 Cb 0.04 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.09 3hb9 h ASP 684 CO 0.00 0.00 -0.65 1.67 -2.88 0.00 0.00 179.24 177.38 3hb9 n GLN 685 N -2.90 0.18 -0.12 0.28 7.27 -0.88 -3.79 117.38 117.40 3hb9 n GLN 685 Ca 0.02 0.04 0.11 0.00 0.07 0.00 0.00 57.00 57.24 3hb9 n GLN 685 Cb 0.33 -1.60 0.17 0.00 2.41 0.00 0.00 30.24 31.55 3hb9 n GLN 685 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 3hb9 n MET 686 N -1.84 2.37 -0.22 3.69 0.00 -1.09 -4.29 117.12 115.74 3hb9 n MET 686 Ca 0.04 -2.12 -0.08 0.00 0.00 0.00 0.00 57.70 55.54 3hb9 n MET 686 Cb 0.40 -1.48 0.03 0.00 0.00 0.00 0.00 33.22 32.17 3hb9 n MET 686 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 175.97 176.84 3hb9 h LYS 687 N 4.39 0.95 -0.04 3.17 1.57 -1.65 -2.43 116.57 122.53 3hb9 h LYS 687 Ca 0.00 -0.20 -0.01 0.00 -1.87 0.00 0.00 60.65 58.58 3hb9 h LYS 687 Cb 0.96 -0.14 -0.00 0.00 0.08 0.00 0.00 32.23 33.13 3hb9 h LYS 687 CO 0.00 0.83 -0.01 0.28 -0.57 0.00 0.00 179.45 179.98 3hb9 h VAL 688 N 0.87 1.29 -0.61 0.50 2.07 -1.83 -2.28 116.25 116.27 3hb9 h VAL 688 Ca 0.20 -0.90 0.01 0.00 0.82 0.00 0.00 66.70 66.83 3hb9 h VAL 688 Cb 0.27 1.83 -0.03 0.00 -1.52 0.00 0.00 31.29 31.83 3hb9 h VAL 688 CO -0.01 0.24 0.40 0.00 0.02 0.00 0.00 177.57 178.22 3hb9 h ALA 689 N 0.65 0.77 -0.39 1.67 0.00 -1.82 -2.72 119.26 117.42 3hb9 h ALA 689 Ca 0.01 -0.04 0.08 0.00 0.00 0.00 0.00 54.91 54.96 3hb9 h ALA 689 Cb 0.39 -0.23 -0.07 0.00 0.00 0.00 0.00 17.79 17.88 3hb9 h ALA 689 CO 0.00 0.18 -0.09 -0.97 0.00 0.00 0.00 179.25 178.38 3hb9 h ASN 690 N 0.80 -0.34 -0.62 0.00 -1.24 -1.39 -2.08 115.58 110.72 3hb9 h ASN 690 Ca 0.23 0.11 0.04 0.00 0.71 0.00 0.00 56.30 57.39 3hb9 h ASN 690 Cb -0.07 0.23 -0.04 0.00 0.73 0.00 0.00 38.32 39.17 3hb9 h ASN 690 CO -0.06 -0.12 0.36 -0.33 -1.29 0.00 0.00 177.43 175.99 3hb9 h GLU 691 N 0.01 0.69 -0.45 6.67 5.08 -1.20 -1.06 114.58 124.32 3hb9 h GLU 691 Ca 0.19 -0.04 -0.06 0.00 -1.00 0.00 0.00 59.36 58.45 3hb9 h GLU 691 Cb 0.28 -0.15 -0.02 0.00 0.50 0.00 0.00 28.75 29.36 3hb9 h GLU 691 CO -0.39 0.45 0.05 0.00 -1.00 0.00 0.00 179.01 178.12 3hb9 h ALA 692 N 1.29 1.24 -0.09 3.43 0.00 -1.12 0.19 119.26 124.20 3hb9 h ALA 692 Ca 0.26 -0.22 -0.16 0.00 0.00 0.00 0.00 54.91 54.79 3hb9 h ALA 692 Cb 0.07 -0.19 0.01 0.00 0.00 0.00 0.00 17.79 17.68 3hb9 h ALA 692 CO -0.13 0.51 -0.56 0.28 0.00 0.00 0.00 179.25 179.36 3hb9 h VAL 693 N 0.67 1.36 -0.51 0.00 2.07 -1.09 -1.93 116.25 116.82 3hb9 h VAL 693 Ca 0.14 -1.88 0.06 0.00 0.82 0.00 0.00 66.70 65.84 3hb9 h VAL 693 Cb 0.35 2.23 -0.05 0.00 -1.52 0.00 0.00 31.29 32.29 3hb9 h VAL 693 CO 0.01 0.57 0.21 1.56 0.02 0.00 0.00 177.57 179.93 3hb9 h GLN 694 N 0.14 0.39 -0.75 1.57 1.08 -0.95 -2.35 115.11 114.25 3hb9 h GLN 694 Ca -0.04 -0.02 -0.01 0.00 -1.45 0.00 0.00 58.65 57.12 3hb9 h GLN 694 Cb 1.21 -0.09 -0.04 0.00 -0.05 0.00 0.00 27.48 28.51 3hb9 h GLN 694 CO 0.11 0.26 0.43 1.49 -0.95 0.00 0.00 178.83 180.17 3hb9 h GLU 695 N 0.40 1.03 0.00 1.46 4.81 -0.93 -2.24 114.58 119.11 3hb9 h GLU 695 Ca 0.24 -0.11 0.00 0.00 -0.13 0.00 0.00 59.36 59.37 3hb9 h GLU 695 Cb 0.23 -0.21 0.00 0.00 0.63 0.00 0.00 28.75 29.41 3hb9 h GLU 695 CO -0.23 0.74 0.00 0.00 -0.73 0.00 0.00 179.01 178.80 3hb9 n ALA 696 N -2.35 2.27 -1.83 2.92 0.00 -0.73 -4.88 120.51 115.92 3hb9 n ALA 696 Ca 0.07 -0.13 -0.07 0.00 0.00 0.00 0.00 53.44 53.31 3hb9 n ALA 696 Cb 0.07 -1.39 -0.01 0.00 0.00 0.00 0.00 19.45 18.12 3hb9 n ALA 696 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3hb9 n GLY 697 N 0.64 0.36 3.82 0.00 0.00 -0.84 -5.01 105.19 104.15 3hb9 n GLY 697 Ca 0.14 -0.63 -0.27 0.00 0.00 0.00 0.00 46.02 45.25 3hb9 n GLY 697 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3hb9 s LYS 698 N -3.78 2.24 -0.16 1.61 -0.14 -0.91 -4.62 119.74 113.98 3hb9 s LYS 698 Ca 0.00 -2.03 -0.24 0.00 -1.36 0.00 0.00 55.97 52.34 3hb9 s LYS 698 Cb 0.00 -1.94 -0.02 0.00 -1.68 0.00 0.00 37.83 34.19 3hb9 s LYS 698 CO 0.00 -0.39 0.78 0.42 -0.76 0.00 0.00 175.35 175.40 3hb9 s ILE 699 N -2.73 4.93 -0.20 2.17 1.01 0.54 -4.48 121.20 122.44 3hb9 s ILE 699 Ca 0.30 1.53 -0.07 0.00 0.00 0.00 0.00 60.65 62.41 3hb9 s ILE 699 Cb 0.01 -4.09 -0.04 0.00 0.01 0.00 0.00 42.46 38.35 3hb9 s ILE 699 CO 0.18 0.07 0.06 -0.55 0.00 0.00 0.00 174.94 174.70 3hb9 s SER 700 N 1.12 5.52 -0.23 3.58 0.15 -1.26 -0.51 113.70 122.07 3hb9 s SER 700 Ca 0.36 0.01 -0.06 0.00 0.70 0.00 0.00 55.95 56.97 3hb9 s SER 700 Cb -0.17 -1.96 -0.02 0.00 -1.71 0.00 0.00 66.02 62.17 3hb9 s SER 700 CO 0.13 0.13 0.02 -1.61 1.20 0.00 0.00 173.24 173.10 3hb9 s GLU 701 N 0.66 3.55 -0.21 5.44 2.02 0.38 -1.19 118.70 129.34 3hb9 s GLU 701 Ca 0.03 -0.54 -0.25 0.00 0.02 0.00 0.00 54.97 54.24 3hb9 s GLU 701 Cb -0.13 -3.18 -0.01 0.00 0.10 0.00 0.00 34.13 30.91 3hb9 s GLU 701 CO 0.02 -0.17 0.83 0.20 0.02 0.00 0.00 175.26 176.16 3hb9 s GLY 702 N 1.49 1.89 -0.12 -1.39 0.00 0.37 -1.28 107.32 108.28 3hb9 s GLY 702 Ca 0.06 -0.07 -0.00 0.00 0.00 0.00 0.00 44.72 44.70 3hb9 s GLY 702 CO 0.01 1.75 -0.11 -1.59 0.00 0.00 0.00 173.10 173.16 3hb9 s THR 703 N 2.57 3.29 -0.30 0.90 2.01 -0.95 0.82 115.64 123.99 3hb9 s THR 703 Ca 0.36 -0.59 -0.08 0.00 0.31 0.00 0.00 61.69 61.69 3hb9 s THR 703 Cb -0.16 -2.38 -0.00 0.00 0.01 0.00 0.00 72.50 69.96 3hb9 s THR 703 CO 0.09 0.53 0.11 -0.63 -0.69 0.00 0.00 174.62 174.03 3hb9 s ILE 704 N 0.12 4.30 -0.12 1.82 1.01 -0.37 -4.60 121.20 123.37 3hb9 s ILE 704 Ca -0.05 -0.50 -0.30 0.00 0.00 0.00 0.00 60.65 59.81 3hb9 s ILE 704 Cb -0.14 -3.18 -0.01 0.00 0.01 0.00 0.00 42.46 39.13 3hb9 s ILE 704 CO 0.04 0.11 1.10 0.00 0.00 0.00 0.00 174.94 176.19 3hb9 s TYR 706 N 2.42 3.80 0.13 0.00 5.04 -1.13 -4.96 117.35 122.66 3hb9 s TYR 706 Ca 0.51 1.54 -0.08 0.00 -2.44 0.00 0.00 57.07 56.59 3hb9 s TYR 706 Cb -0.20 -2.80 -0.01 0.00 0.35 0.00 0.00 41.96 39.30 3hb9 s TYR 706 CO 0.17 0.37 0.23 0.99 -1.34 0.00 0.00 175.55 175.97 3hb9 s THR 707 N -0.47 0.10 0.00 4.34 2.01 -1.26 -4.69 115.64 115.67 3hb9 s THR 707 Ca 0.38 -1.34 0.00 0.00 0.31 0.00 0.00 61.69 61.03 3hb9 s THR 707 Cb -0.21 -1.66 0.00 0.00 0.01 0.00 0.00 72.50 70.64 3hb9 s THR 707 CO 0.24 -0.45 0.00 0.61 -0.69 0.00 0.00 174.62 174.33 3hb9 n GLY 708 N -0.14 0.22 2.97 4.40 0.00 -1.26 -4.79 105.19 106.58 3hb9 n GLY 708 Ca -0.10 -0.91 -0.06 0.00 0.00 0.00 0.00 46.02 44.95 3hb9 n GLY 708 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3hb9 s ASP 709 N -4.00 -0.11 0.61 1.61 3.68 -1.26 -4.88 116.67 112.32 3hb9 s ASP 709 Ca 0.00 -0.21 0.39 0.00 2.13 0.00 0.00 52.55 54.86 3hb9 s ASP 709 Cb 0.00 1.34 1.92 0.00 -1.45 0.00 0.00 42.92 44.73 3hb9 s ASP 709 CO 0.00 -0.34 2.19 0.16 0.13 0.00 0.00 175.17 177.31 3hb9 h ILE 710 N 6.12 0.04 0.00 4.11 3.07 -1.87 0.26 117.51 129.25 3hb9 h ILE 710 Ca -0.07 -0.25 -0.03 0.00 1.55 0.00 0.00 64.86 66.06 3hb9 h ILE 710 Cb 1.14 1.24 -0.00 0.00 -0.27 0.00 0.00 36.82 38.92 3hb9 h ILE 710 CO 0.24 0.01 -0.12 -0.07 -1.05 0.00 0.00 178.15 177.15 3hb9 h LEU 711 N 0.00 0.00 -8.20 0.16 3.38 -1.95 -3.43 115.31 105.27 3hb9 h LEU 711 Ca -0.00 0.00 -0.70 0.00 0.09 0.00 0.00 57.88 57.27 3hb9 h LEU 711 Cb 0.24 0.00 -0.28 0.00 0.09 0.00 0.00 40.66 40.71 3hb9 h LEU 711 CO 0.00 0.12 -0.57 0.21 0.09 0.00 0.00 178.44 178.29 3hb9 s ASN 712 N -6.09 5.42 0.46 -0.43 3.84 0.08 -4.96 114.94 113.26 3hb9 s ASN 712 Ca 0.03 -1.20 0.24 0.00 0.21 0.00 0.00 52.86 52.15 3hb9 s ASN 712 Cb 0.08 -1.91 1.08 0.00 -0.55 0.00 0.00 41.25 39.94 3hb9 s ASN 712 CO 0.64 -0.37 1.90 -0.65 -2.79 0.00 0.00 177.10 175.83 3hb9 h PRO 713 N 8.27 0.00 0.00 0.43 0.11 -1.84 -3.08 132.00 135.90 3hb9 h PRO 713 Ca -0.23 0.00 -0.09 0.00 0.11 0.00 0.00 66.00 65.79 3hb9 h PRO 713 Cb 1.08 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.18 3hb9 h PRO 713 CO 0.64 0.21 -0.42 0.93 -0.21 0.00 0.00 178.00 179.15 3hb9 h GLU 714 N 0.00 0.00 0.64 1.05 3.07 -1.93 -3.38 114.58 114.03 3hb9 h GLU 714 Ca -0.00 0.00 -0.03 0.00 -0.50 0.00 0.00 59.36 58.83 3hb9 h GLU 714 Cb 0.62 0.00 0.01 0.00 -0.84 0.00 0.00 28.75 28.54 3hb9 h GLU 714 CO 0.03 0.42 -0.31 -0.09 -1.40 0.00 0.00 179.01 177.66 3hb9 h ARG 715 N 0.00 -0.82 -3.11 2.33 9.65 -1.85 -3.46 114.38 117.11 3hb9 h ARG 715 Ca -0.00 0.06 -0.18 0.00 -1.10 0.00 0.00 59.98 58.75 3hb9 h ARG 715 Cb 1.11 0.19 -0.27 0.00 -1.39 0.00 0.00 29.97 29.61 3hb9 h ARG 715 CO 0.05 -0.53 -0.46 0.45 2.80 0.00 0.00 179.97 182.29 3hb9 s SER 716 N -4.58 -0.25 -0.12 -3.80 0.15 -1.26 -5.00 113.70 98.85 3hb9 s SER 716 Ca -0.13 0.49 0.17 0.00 0.70 0.00 0.00 55.95 57.18 3hb9 s SER 716 Cb 0.01 0.45 0.68 0.00 -1.71 0.00 0.00 66.02 65.46 3hb9 s SER 716 CO 0.41 -0.11 1.60 -0.46 1.20 0.00 0.00 173.24 175.87 3hb9 n ASN 717 N 3.45 4.64 -0.07 5.45 0.23 -1.26 -4.47 115.26 123.22 3hb9 n ASN 717 Ca -0.18 -2.50 -0.14 0.00 -0.53 0.00 0.00 54.58 51.23 3hb9 n ASN 717 Cb 0.56 -0.56 -0.05 0.00 -2.08 0.00 0.00 39.78 37.66 3hb9 n ASN 717 CO 0.00 0.00 0.00 -0.38 -0.93 0.00 0.00 177.26 175.95 3hb9 n ILE 717 N 0.90 1.02 -2.74 1.53 2.08 -1.26 -4.79 119.36 116.11 3hb9 n ILE 717 Ca 0.25 -0.09 -0.43 0.00 0.56 0.00 0.00 62.75 63.04 3hb9 n ILE 717 Cb 0.88 -1.81 0.01 0.00 -0.75 0.00 0.00 39.64 37.97 3hb9 n ILE 717 CO 0.00 0.00 0.00 -1.22 0.56 0.00 0.00 176.55 175.89 3hb9 n TYR 718 N -3.81 2.47 -2.62 1.39 4.02 -1.26 -4.62 117.16 112.72 3hb9 n TYR 718 Ca -0.25 -2.63 -0.23 0.00 -0.01 0.00 0.00 57.90 54.78 3hb9 n TYR 718 Cb 0.61 -1.45 0.09 0.00 -0.02 0.00 0.00 39.34 38.56 3hb9 n TYR 718 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 176.86 176.84 3hb9 s THR 719 N -2.09 2.27 0.29 -0.72 2.01 -1.26 -4.58 115.64 111.56 3hb9 s THR 719 Ca 0.35 -0.63 -0.03 0.00 0.31 0.00 0.00 61.69 61.69 3hb9 s THR 719 Cb 0.08 -2.64 0.26 0.00 0.01 0.00 0.00 72.50 70.22 3hb9 s THR 719 CO 0.05 0.00 1.95 0.25 -0.69 0.00 0.00 174.62 176.18 3hb9 h LEU 720 N -0.33 0.99 -0.45 4.42 5.85 -1.94 -2.29 115.31 121.56 3hb9 h LEU 720 Ca -0.37 -0.02 0.04 0.00 0.84 0.00 0.00 57.88 58.37 3hb9 h LEU 720 Cb 1.28 -0.24 -0.04 0.00 0.37 0.00 0.00 40.66 42.02 3hb9 h LEU 720 CO 0.44 0.71 0.21 -0.08 -0.34 0.00 0.00 178.44 179.37 3hb9 h GLU 721 N 1.16 0.41 -0.26 1.25 4.57 -1.96 -2.29 114.58 117.47 3hb9 h GLU 721 Ca 0.33 -0.02 0.06 0.00 -1.18 0.00 0.00 59.36 58.54 3hb9 h GLU 721 Cb -0.09 -0.09 -0.05 0.00 -0.16 0.00 0.00 28.75 28.35 3hb9 h GLU 721 CO -0.08 0.27 -0.09 -0.92 -1.18 0.00 0.00 179.01 177.01 3hb9 h TYR 722 N 0.42 -0.21 -0.38 0.92 3.20 -1.68 -1.72 116.97 117.53 3hb9 h TYR 722 Ca 0.20 0.03 -0.12 0.00 3.14 0.00 0.00 58.73 61.98 3hb9 h TYR 722 Cb 0.13 0.13 -0.01 0.00 1.54 0.00 0.00 36.73 38.52 3hb9 h TYR 722 CO -0.11 -0.15 -0.25 1.88 -1.64 0.00 0.00 178.16 177.89 3hb9 h TYR 723 N -0.04 0.87 -0.35 -3.82 -1.99 -1.35 -1.38 116.97 108.92 3hb9 h TYR 723 Ca 0.13 -0.21 -0.00 0.00 2.00 0.00 0.00 58.73 60.65 3hb9 h TYR 723 Cb 0.24 -0.21 -0.02 0.00 2.00 0.00 0.00 36.73 38.75 3hb9 h TYR 723 CO -0.28 0.93 0.20 0.28 -0.00 0.00 0.00 178.16 179.29 3hb9 h VAL 724 N 0.66 1.12 -0.52 -2.88 2.07 -1.20 -1.19 116.25 114.33 3hb9 h VAL 724 Ca 0.09 -0.30 0.02 0.00 0.82 0.00 0.00 66.70 67.33 3hb9 h VAL 724 Cb 0.76 0.70 -0.03 0.00 -1.52 0.00 0.00 31.29 31.20 3hb9 h VAL 724 CO 0.06 0.12 0.31 0.50 0.02 0.00 0.00 177.57 178.59 3hb9 h LYS 725 N 0.44 0.60 -0.34 1.57 1.63 -1.11 -2.14 116.57 117.23 3hb9 h LYS 725 Ca 0.12 -0.04 -0.06 0.00 -0.85 0.00 0.00 60.65 59.82 3hb9 h LYS 725 Cb 0.02 -0.14 -0.01 0.00 -0.60 0.00 0.00 32.23 31.51 3hb9 h LYS 725 CO -0.02 0.40 -0.03 1.25 -3.45 0.00 0.00 179.45 177.59 3hb9 h LEU 726 N 0.62 0.62 -0.89 5.20 5.85 -0.99 -2.06 115.31 123.66 3hb9 h LEU 726 Ca 0.21 -0.33 -0.00 0.00 0.84 0.00 0.00 57.88 58.59 3hb9 h LEU 726 Cb 0.01 -0.17 -0.04 0.00 0.37 0.00 0.00 40.66 40.83 3hb9 h LEU 726 CO -0.09 0.80 0.55 0.00 -0.34 0.00 0.00 178.44 179.37 3hb9 h ALA 727 N 0.84 1.13 -0.08 1.25 0.00 -1.16 -1.82 119.26 119.42 3hb9 h ALA 727 Ca 0.09 -0.09 -0.06 0.00 0.00 0.00 0.00 54.91 54.86 3hb9 h ALA 727 Cb 0.51 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 3hb9 h ALA 727 CO 0.02 0.57 -0.21 0.87 0.00 0.00 0.00 179.25 180.51 3hb9 h LYS 728 N 1.22 0.13 -0.18 0.00 1.57 -1.16 -0.32 116.57 117.82 3hb9 h LYS 728 Ca 0.32 -0.03 -0.20 0.00 -1.87 0.00 0.00 60.65 58.87 3hb9 h LYS 728 Cb -0.08 -0.02 0.01 0.00 0.08 0.00 0.00 32.23 32.22 3hb9 h LYS 728 CO -0.06 0.34 -0.66 1.49 -0.57 0.00 0.00 179.45 179.98 3hb9 h GLU 729 N 0.12 0.76 -0.27 3.15 4.81 -0.96 -3.02 114.58 119.18 3hb9 h GLU 729 Ca 0.02 -0.58 -0.09 0.00 -0.13 0.00 0.00 59.36 58.58 3hb9 h GLU 729 Cb 0.44 0.11 -0.01 0.00 0.63 0.00 0.00 28.75 29.91 3hb9 h GLU 729 CO 0.03 1.20 -0.22 -0.07 -0.73 0.00 0.00 179.01 179.22 3hb9 h LEU 730 N 0.49 0.50 -0.10 1.64 3.38 -0.82 -0.92 115.31 119.48 3hb9 h LEU 730 Ca -0.03 -0.16 -0.00 0.00 0.09 0.00 0.00 57.88 57.78 3hb9 h LEU 730 Cb 1.29 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 41.90 3hb9 h LEU 730 CO 0.14 0.72 0.05 -0.08 0.09 0.00 0.00 178.44 179.37 3hb9 h GLU 731 N 0.44 0.14 0.00 1.13 4.81 -1.09 -2.80 114.58 117.22 3hb9 h GLU 731 Ca 0.07 -0.02 -0.04 0.00 -0.13 0.00 0.00 59.36 59.24 3hb9 h GLU 731 Cb 0.63 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.98 3hb9 h GLU 731 CO 0.05 0.19 -0.18 0.07 -0.73 0.00 0.00 179.01 178.40 3hb9 h ARG 732 N 0.06 0.00 0.00 1.92 0.11 -1.43 -1.99 114.38 113.05 3hb9 h ARG 732 Ca 0.04 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.12 3hb9 h ARG 732 Cb 0.09 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.17 3hb9 h ARG 732 CO -0.01 0.18 0.00 0.39 0.10 0.00 0.00 179.97 180.64 3hb9 n GLU 733 N -3.25 0.23 -0.83 0.08 -0.58 -0.36 -4.90 120.64 111.03 3hb9 n GLU 733 Ca 0.01 0.13 0.00 0.00 -0.42 0.00 0.00 57.16 56.88 3hb9 n GLU 733 Cb 0.47 -1.50 0.00 0.00 -0.57 0.00 0.00 31.44 29.84 3hb9 n GLU 733 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3hb9 n GLY 734 N 0.16 0.71 3.77 0.62 0.00 -0.75 -5.02 105.19 104.67 3hb9 n GLY 734 Ca 0.08 -0.67 -0.39 0.00 0.00 0.00 0.00 46.02 45.04 3hb9 n GLY 734 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3hb9 s PHE 735 N -2.00 3.37 0.07 1.61 0.40 -1.12 -4.97 117.98 115.34 3hb9 s PHE 735 Ca 0.00 1.64 -0.13 0.00 -0.60 0.00 0.00 56.93 57.84 3hb9 s PHE 735 Cb 0.00 -3.30 -0.24 0.00 0.51 0.00 0.00 43.02 40.00 3hb9 s PHE 735 CO 0.00 -0.80 1.18 0.45 0.70 0.00 0.00 175.22 176.74 3hb9 h HIS 736 N 3.25 0.98 -4.18 0.36 3.86 -1.51 -3.45 115.15 114.47 3hb9 h HIS 736 Ca -0.48 -0.56 -0.50 0.00 -1.16 0.00 0.00 60.37 57.67 3hb9 h HIS 736 Cb 1.22 -0.10 -0.27 0.00 1.06 0.00 0.00 27.41 29.31 3hb9 h HIS 736 CO 0.58 1.40 -0.82 0.42 0.86 0.00 0.00 177.93 180.37 3hb9 s ILE 737 N -3.20 1.25 -0.34 2.45 1.01 -0.96 -4.47 121.20 116.94 3hb9 s ILE 737 Ca -0.09 -0.83 -0.18 0.00 0.00 0.00 0.00 60.65 59.55 3hb9 s ILE 737 Cb 0.07 -1.07 -0.01 0.00 0.01 0.00 0.00 42.46 41.46 3hb9 s ILE 737 CO 0.92 0.23 0.51 -0.22 0.00 0.00 0.00 174.94 176.38 3hb9 s LEU 738 N -0.69 4.31 0.08 2.97 2.96 -0.63 -0.48 118.68 127.20 3hb9 s LEU 738 Ca 0.05 0.03 0.02 0.00 -0.22 0.00 0.00 54.13 54.01 3hb9 s LEU 738 Cb -0.07 -2.59 -0.04 0.00 0.50 0.00 0.00 46.19 43.99 3hb9 s LEU 738 CO 0.00 -0.46 0.14 0.00 -1.32 0.00 0.00 176.35 174.72 3hb9 s ALA 739 N 2.38 3.76 -0.29 5.97 0.00 0.24 -0.04 121.76 133.78 3hb9 s ALA 739 Ca 0.19 -0.96 0.01 0.00 0.00 0.00 0.00 51.96 51.20 3hb9 s ALA 739 Cb -0.15 -1.60 0.09 0.00 0.00 0.00 0.00 23.12 21.45 3hb9 s ALA 739 CO 0.13 0.76 0.04 0.42 0.00 0.00 0.00 175.76 177.11 3hb9 s ILE 740 N -1.47 1.33 -0.95 0.00 1.01 -0.68 -1.23 121.20 119.21 3hb9 s ILE 740 Ca 0.32 -1.50 -0.18 0.00 0.00 0.00 0.00 60.65 59.29 3hb9 s ILE 740 Cb -0.12 -1.88 0.15 0.00 0.01 0.00 0.00 42.46 40.61 3hb9 s ILE 740 CO 0.25 -0.47 1.12 -0.75 0.00 0.00 0.00 174.94 175.08 3hb9 s LYS 741 N 1.42 3.66 -1.27 2.79 2.20 -0.78 -1.32 119.74 126.44 3hb9 s LYS 741 Ca 0.05 -1.94 -0.17 0.00 -0.36 0.00 0.00 55.97 53.55 3hb9 s LYS 741 Cb -0.18 -4.87 0.10 0.00 -1.51 0.00 0.00 37.83 31.37 3hb9 s LYS 741 CO -0.15 -1.71 1.65 -3.47 -0.36 0.00 0.00 175.35 171.31 3hb9 n ASP 742 N 6.12 5.02 0.17 1.43 2.03 -0.37 -2.82 116.55 128.13 3hb9 n ASP 742 Ca 0.24 -2.94 0.02 0.00 0.52 0.00 0.00 54.79 52.63 3hb9 n ASP 742 Cb 0.48 -1.69 0.33 0.00 -0.72 0.00 0.00 41.12 39.51 3hb9 n ASP 742 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3hb9 h MET 743 N 7.42 0.03 -0.01 -0.67 -0.00 -1.83 -3.12 114.93 116.75 3hb9 h MET 743 Ca 0.41 -0.01 0.00 0.00 -0.00 0.00 0.00 59.70 60.10 3hb9 h MET 743 Cb 0.87 -0.00 0.00 0.00 -0.00 0.00 0.00 31.60 32.47 3hb9 h MET 743 CO 1.40 0.42 -0.47 0.00 -0.00 0.00 0.00 176.91 178.26 3hb9 n ALA 744 N -2.47 3.55 -2.18 -3.00 0.00 -1.26 -2.85 120.51 112.30 3hb9 n ALA 744 Ca -0.02 -0.54 -0.06 0.00 0.00 0.00 0.00 53.44 52.83 3hb9 n ALA 744 Cb 0.43 -0.93 0.00 0.00 0.00 0.00 0.00 19.45 18.95 3hb9 n ALA 744 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3hb9 n GLY 745 N 1.41 0.19 0.16 0.00 0.00 -1.18 -4.79 105.19 100.98 3hb9 n GLY 745 Ca 0.09 -0.63 0.13 0.00 0.00 0.00 0.00 46.02 45.61 3hb9 n GLY 745 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3hb9 n LEU 746 N -0.90 0.77 -4.55 0.99 4.77 -1.26 -4.68 117.00 112.14 3hb9 n LEU 746 Ca -0.06 -0.13 -0.42 0.00 -0.03 0.00 0.00 56.01 55.37 3hb9 n LEU 746 Cb 0.55 -0.18 -0.01 0.00 -2.33 0.00 0.00 43.42 41.45 3hb9 n LEU 746 CO 0.09 0.15 1.63 -0.22 -1.33 0.00 0.00 177.39 177.71 3hb9 s LEU 747 N -2.64 3.94 0.76 2.23 2.96 -1.26 -4.90 118.68 119.78 3hb9 s LEU 747 Ca 0.21 -2.06 -0.15 0.00 -0.22 0.00 0.00 54.13 51.91 3hb9 s LEU 747 Cb 0.19 -2.54 0.00 0.00 0.50 0.00 0.00 46.19 44.34 3hb9 s LEU 747 CO 0.56 -1.26 0.74 0.29 -1.32 0.00 0.00 176.35 175.36 3hb9 n LYS 748 N 8.15 0.26 -0.04 1.98 5.02 -1.26 -4.63 118.16 127.65 3hb9 n LYS 748 Ca 0.39 0.14 -0.09 0.00 -2.02 0.00 0.00 58.31 56.73 3hb9 n LYS 748 Cb 0.48 -2.04 -0.03 0.00 -0.02 0.00 0.00 35.03 33.43 3hb9 n LYS 748 CO 0.00 0.00 0.00 -1.35 -0.52 0.00 0.00 177.40 175.53 3hb9 h PRO 749 N -0.58 -0.30 -0.45 1.97 0.11 -1.90 0.22 132.00 131.09 3hb9 h PRO 749 Ca -0.46 0.02 -0.02 0.00 0.11 0.00 0.00 66.00 65.65 3hb9 h PRO 749 Cb 1.33 0.07 -0.02 0.00 0.11 0.00 0.00 31.00 32.49 3hb9 h PRO 749 CO 0.43 -0.20 0.20 -0.22 -0.21 0.00 0.00 178.00 178.01 3hb9 h LYS 750 N -0.31 0.66 -0.96 1.05 3.11 -1.94 -2.37 116.57 115.81 3hb9 h LYS 750 Ca 0.12 -0.11 0.16 0.00 -2.81 0.00 0.00 60.65 58.02 3hb9 h LYS 750 Cb 0.50 -0.11 -0.10 0.00 -1.00 0.00 0.00 32.23 31.52 3hb9 h LYS 750 CO -0.39 0.58 0.57 0.00 -2.81 0.00 0.00 179.45 177.39 3hb9 h ALA 751 N 1.05 1.53 -0.49 5.00 0.00 -1.77 0.29 119.26 124.86 3hb9 h ALA 751 Ca 0.15 0.07 -0.07 0.00 0.00 0.00 0.00 54.91 55.07 3hb9 h ALA 751 Cb 0.15 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 3hb9 h ALA 751 CO -0.02 -0.01 0.04 0.00 0.00 0.00 0.00 179.25 179.27 3hb9 h ALA 752 N 1.60 0.65 -0.67 0.00 0.00 -0.53 -0.32 119.26 120.00 3hb9 h ALA 752 Ca 0.53 -0.26 -0.06 0.00 0.00 0.00 0.00 54.91 55.13 3hb9 h ALA 752 Cb 0.75 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 18.33 3hb9 h ALA 752 CO -0.36 0.42 0.19 -0.92 0.00 0.00 0.00 179.25 178.59 3hb9 h TYR 753 N 0.70 1.07 0.73 0.00 3.20 -0.58 -0.39 116.97 121.70 3hb9 h TYR 753 Ca 0.14 -0.10 -0.04 0.00 3.14 0.00 0.00 58.73 61.87 3hb9 h TYR 753 Cb 0.45 -0.31 0.01 0.00 1.54 0.00 0.00 36.73 38.41 3hb9 h TYR 753 CO 0.03 0.86 -0.35 0.93 -1.64 0.00 0.00 178.16 177.99 3hb9 h GLU 754 N 0.99 -0.95 -0.17 1.82 4.39 -0.92 -2.47 114.58 117.27 3hb9 h GLU 754 Ca 0.22 0.06 0.00 0.00 0.34 0.00 0.00 59.36 59.98 3hb9 h GLU 754 Cb 0.30 0.22 -0.01 0.00 -0.10 0.00 0.00 28.75 29.16 3hb9 h GLU 754 CO -0.01 -0.62 0.11 1.25 -1.16 0.00 0.00 179.01 178.59 3hb9 h LEU 755 N -1.21 0.20 -0.51 1.33 5.85 -0.98 -0.71 115.31 119.27 3hb9 h LEU 755 Ca -0.10 -0.01 -0.09 0.00 0.84 0.00 0.00 57.88 58.51 3hb9 h LEU 755 Cb 0.77 -0.05 -0.02 0.00 0.37 0.00 0.00 40.66 41.73 3hb9 h LEU 755 CO 0.17 0.15 -0.05 0.40 -0.34 0.00 0.00 178.44 178.77 3hb9 h ILE 756 N 0.23 1.27 -0.93 4.05 1.08 -1.20 -1.00 117.51 121.01 3hb9 h ILE 756 Ca 0.06 -1.17 0.01 0.00 -0.39 0.00 0.00 64.86 63.37 3hb9 h ILE 756 Cb -0.02 0.98 -0.05 0.00 -3.07 0.00 0.00 36.82 34.67 3hb9 h ILE 756 CO -0.01 0.41 0.60 1.23 -0.69 0.00 0.00 178.15 179.68 3hb9 h GLY 757 N 0.80 1.31 0.87 5.37 0.00 -1.21 -1.50 103.07 108.72 3hb9 h GLY 757 Ca 0.14 -0.51 -0.11 0.00 0.00 0.00 0.00 47.33 46.85 3hb9 h GLY 757 CO 0.04 0.50 -0.32 0.83 0.00 0.00 0.00 176.54 177.58 3hb9 h GLU 758 N 1.26 0.54 -0.33 4.80 4.39 -0.94 -3.26 114.58 121.05 3hb9 h GLU 758 Ca 0.34 -0.34 -0.12 0.00 0.34 0.00 0.00 59.36 59.58 3hb9 h GLU 758 Cb -0.12 0.04 -0.01 0.00 -0.10 0.00 0.00 28.75 28.56 3hb9 h GLU 758 CO -0.07 0.95 -0.28 -0.07 -1.16 0.00 0.00 179.01 178.38 3hb9 h LEU 759 N 0.20 0.71 -1.95 1.33 3.38 -1.05 -0.93 115.31 116.99 3hb9 h LEU 759 Ca 0.01 -0.27 -0.01 0.00 0.09 0.00 0.00 57.88 57.70 3hb9 h LEU 759 Cb 0.91 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 41.47 3hb9 h LEU 759 CO 0.07 0.95 -0.07 0.11 0.09 0.00 0.00 178.44 179.59 3hb9 h LYS 760 N 0.59 0.00 0.00 1.13 1.79 -1.36 0.07 116.57 118.79 3hb9 h LYS 760 Ca 0.07 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.54 3hb9 h LYS 760 Cb 0.77 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.42 3hb9 h LYS 760 CO 0.06 0.07 -1.04 -1.13 -1.08 0.00 0.00 179.45 176.33 3hb9 n SER 761 N -4.29 0.68 -0.06 0.86 3.41 -1.07 -4.45 113.62 108.70 3hb9 n SER 761 Ca -0.03 -0.49 -0.21 0.00 -0.26 0.00 0.00 58.87 57.88 3hb9 n SER 761 Cb 0.15 0.91 -0.12 0.00 -0.26 0.00 0.00 64.21 64.89 3hb9 n SER 761 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3hb9 h ALA 762 N 2.72 0.27 -2.20 7.33 0.00 -0.41 -3.48 119.26 123.49 3hb9 h ALA 762 Ca 0.00 -1.19 -0.58 0.00 0.00 0.00 0.00 54.91 53.14 3hb9 h ALA 762 Cb 0.64 0.65 -0.12 0.00 0.00 0.00 0.00 17.79 18.96 3hb9 h ALA 762 CO 0.00 0.81 -0.70 0.14 0.00 0.00 0.00 179.25 179.50 3hb9 s VAL 763 N -2.41 2.99 -0.98 0.00 -7.23 -0.06 -4.98 120.40 107.72 3hb9 s VAL 763 Ca -0.25 -2.14 0.24 0.00 -1.81 0.00 0.00 61.98 58.02 3hb9 s VAL 763 Cb 0.05 -2.60 -0.05 0.00 0.56 0.00 0.00 36.38 34.34 3hb9 s VAL 763 CO 0.66 -0.38 1.28 -0.67 -0.31 0.00 0.00 175.10 175.68 3hb9 n ASP 765 N -0.77 0.62 -4.77 4.85 -0.08 -1.26 -4.63 116.55 110.51 3hb9 n ASP 765 Ca -0.06 -0.42 -0.39 0.00 -1.51 0.00 0.00 54.79 52.42 3hb9 n ASP 765 Cb 0.60 0.44 -0.01 0.00 2.34 0.00 0.00 41.12 44.48 3hb9 n ASP 765 CO 0.00 0.00 0.00 -0.76 0.12 0.00 0.00 177.20 176.56 3hb9 s LEU 766 N -3.04 4.19 0.22 -2.67 1.02 -1.26 -5.01 118.68 112.13 3hb9 s LEU 766 Ca 0.10 2.47 -0.30 0.00 0.02 0.00 0.00 54.13 56.42 3hb9 s LEU 766 Cb 0.17 -3.98 -0.09 0.00 0.02 0.00 0.00 46.19 42.31 3hb9 s LEU 766 CO 0.74 -0.76 1.17 -2.84 0.02 0.00 0.00 176.35 174.68 3hb9 s PRO 767 N -2.28 4.53 -0.08 1.29 0.02 -1.26 -4.77 135.00 132.44 3hb9 s PRO 767 Ca 0.57 1.87 -0.19 0.00 0.02 0.00 0.00 61.00 63.27 3hb9 s PRO 767 Cb -0.34 -3.22 -0.04 0.00 0.02 0.00 0.00 34.50 30.92 3hb9 s PRO 767 CO 0.43 -0.01 0.53 0.42 -0.33 0.00 0.00 177.00 178.04 3hb9 s ILE 768 N -0.42 5.10 -0.32 2.83 1.01 -1.26 -1.61 121.20 126.54 3hb9 s ILE 768 Ca 0.50 1.08 0.03 0.00 0.00 0.00 0.00 60.65 62.26 3hb9 s ILE 768 Cb -0.33 -3.87 0.09 0.00 0.01 0.00 0.00 42.46 38.36 3hb9 s ILE 768 CO 0.39 0.34 0.03 -2.28 0.00 0.00 0.00 174.94 173.42 3hb9 s HIS 769 N 0.41 3.23 -0.06 3.97 2.46 0.94 -2.27 115.29 123.97 3hb9 s HIS 769 Ca 0.29 -2.60 -0.17 0.00 0.47 0.00 0.00 55.06 53.05 3hb9 s HIS 769 Cb -0.16 -2.49 -0.05 0.00 -0.13 0.00 0.00 32.58 29.75 3hb9 s HIS 769 CO 0.13 -0.91 0.45 -1.17 -2.47 0.00 0.00 174.74 170.77 3hb9 s LEU 770 N 1.09 4.37 -0.07 8.88 2.96 -0.21 -1.68 118.68 134.02 3hb9 s LEU 770 Ca 0.07 0.90 0.03 0.00 -0.22 0.00 0.00 54.13 54.91 3hb9 s LEU 770 Cb -0.19 -2.66 0.01 0.00 0.50 0.00 0.00 46.19 43.86 3hb9 s LEU 770 CO -0.11 0.16 -0.15 -2.28 -1.32 0.00 0.00 176.35 172.65 3hb9 s HIS 771 N -0.20 1.67 0.16 5.38 5.65 -0.43 -1.52 115.29 126.01 3hb9 s HIS 771 Ca 0.25 -0.63 -0.05 0.00 0.25 0.00 0.00 55.06 54.88 3hb9 s HIS 771 Cb -0.16 -1.19 -0.02 0.00 -1.18 0.00 0.00 32.58 30.02 3hb9 s HIS 771 CO 0.12 -0.30 0.18 -0.08 -0.65 0.00 0.00 174.74 174.01 3hb9 s THR 772 N 0.58 0.07 0.07 0.89 -1.32 -1.26 -1.24 115.64 113.44 3hb9 s THR 772 Ca -0.15 -1.68 0.07 0.00 -1.21 0.00 0.00 61.69 58.72 3hb9 s THR 772 Cb -0.16 -2.03 -0.04 0.00 -1.51 0.00 0.00 72.50 68.77 3hb9 s THR 772 CO 0.05 -0.31 -0.12 -1.00 -2.21 0.00 0.00 174.62 171.02 3hb9 s HIS 773 N -4.03 2.70 -0.40 9.09 3.76 -1.23 -4.38 115.29 120.80 3hb9 s HIS 773 Ca 0.23 -0.17 0.06 0.00 -0.15 0.00 0.00 55.06 55.03 3hb9 s HIS 773 Cb 0.05 -1.46 0.50 0.00 1.11 0.00 0.00 32.58 32.78 3hb9 s HIS 773 CO 0.03 0.37 1.47 -3.47 -0.85 0.00 0.00 174.74 172.29 3hb9 n ASP 774 N 1.06 3.86 0.29 1.40 4.64 0.08 -4.53 116.55 123.35 3hb9 n ASP 774 Ca -0.15 -2.85 0.14 0.00 -1.38 0.00 0.00 54.79 50.56 3hb9 n ASP 774 Cb 0.52 -0.68 0.86 0.00 -1.04 0.00 0.00 41.12 40.79 3hb9 n ASP 774 CO 0.00 0.00 0.00 0.00 -0.82 0.00 0.00 177.20 176.38 3hb9 h THR 775 N 1.71 0.61 0.00 5.18 1.03 -0.88 -1.25 112.91 119.31 3hb9 h THR 775 Ca 0.21 0.00 0.00 0.00 -0.01 0.00 0.00 66.41 66.61 3hb9 h THR 775 Cb 1.87 0.99 0.00 0.00 -1.07 0.00 0.00 68.15 69.94 3hb9 h THR 775 CO 0.53 0.00 -0.64 0.77 -0.01 0.00 0.00 175.52 176.17 3hb9 h SER 776 N 0.00 0.00 0.00 0.00 4.64 -1.80 0.11 113.55 116.50 3hb9 h SER 776 Ca 0.00 -0.08 0.00 0.00 -0.47 0.00 0.00 61.79 61.24 3hb9 h SER 776 Cb 0.02 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.11 3hb9 h SER 776 CO -0.00 0.04 0.00 0.61 -0.87 0.00 0.00 176.83 176.61 3hb9 n GLY 777 N 1.23 2.91 1.60 -0.77 0.00 -0.48 -4.42 105.19 105.27 3hb9 n GLY 777 Ca 0.02 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.11 3hb9 n GLY 777 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3hb9 n ASN 778 N 0.00 4.76 -0.07 1.61 5.03 -1.26 -4.54 115.26 120.79 3hb9 n ASN 778 Ca 0.00 -2.65 -0.08 0.00 0.87 0.00 0.00 54.58 52.72 3hb9 n ASN 778 Cb 0.00 -0.62 -0.01 0.00 -1.02 0.00 0.00 39.78 38.13 3hb9 n ASN 778 CO 0.00 0.00 0.00 1.23 -1.83 0.00 0.00 177.26 176.66 3hb9 h GLY 779 N 4.26 0.34 0.90 7.41 0.00 -1.83 -1.44 103.07 112.70 3hb9 h GLY 779 Ca 0.00 -0.06 -0.04 0.00 0.00 0.00 0.00 47.33 47.23 3hb9 h GLY 779 CO 0.34 0.03 0.05 1.41 0.00 0.00 0.00 176.54 178.37 3hb9 h LEU 780 N 0.22 0.51 -0.48 3.11 3.38 -1.96 -1.50 115.31 118.59 3hb9 h LEU 780 Ca 0.12 -0.26 0.06 0.00 0.09 0.00 0.00 57.88 57.88 3hb9 h LEU 780 Cb 0.09 -0.14 -0.05 0.00 0.09 0.00 0.00 40.66 40.65 3hb9 h LEU 780 CO -0.12 0.64 0.18 0.25 0.09 0.00 0.00 178.44 179.48 3hb9 h LEU 781 N 0.35 0.20 -0.18 1.67 6.46 -1.86 -1.38 115.31 120.57 3hb9 h LEU 781 Ca 0.10 0.05 0.05 0.00 -0.12 0.00 0.00 57.88 57.96 3hb9 h LEU 781 Cb 0.36 0.03 -0.05 0.00 -0.73 0.00 0.00 40.66 40.27 3hb9 h LEU 781 CO 0.01 0.14 -0.13 0.74 -0.62 0.00 0.00 178.44 178.58 3hb9 h THR 782 N 0.36 0.62 0.00 1.05 2.02 -1.00 -0.10 112.91 115.86 3hb9 h THR 782 Ca 0.22 0.00 0.01 0.00 0.77 0.00 0.00 66.41 67.42 3hb9 h THR 782 Cb 0.22 0.62 -0.02 0.00 -1.74 0.00 0.00 68.15 67.23 3hb9 h THR 782 CO -0.22 0.00 -0.08 1.88 0.37 0.00 0.00 175.52 177.47 3hb9 h TYR 783 N -0.14 -0.19 -0.65 3.16 0.99 -0.86 0.23 116.97 119.51 3hb9 h TYR 783 Ca 0.11 0.01 0.12 0.00 2.00 0.00 0.00 58.73 60.97 3hb9 h TYR 783 Cb 0.30 0.09 -0.09 0.00 1.00 0.00 0.00 36.73 38.02 3hb9 h TYR 783 CO -0.28 -0.12 0.17 -0.22 -0.00 0.00 0.00 178.16 177.72 3hb9 h LYS 784 N -0.14 0.29 -0.71 4.88 3.11 -1.02 0.55 116.57 123.54 3hb9 h LYS 784 Ca 0.03 -0.02 -0.04 0.00 -2.81 0.00 0.00 60.65 57.81 3hb9 h LYS 784 Cb 0.17 -0.07 -0.03 0.00 -1.00 0.00 0.00 32.23 31.31 3hb9 h LYS 784 CO -0.08 0.20 0.28 1.96 -2.81 0.00 0.00 179.45 178.99 3hb9 h GLN 785 N 0.30 1.07 -0.58 1.90 1.08 -0.47 -1.08 115.11 117.33 3hb9 h GLN 785 Ca 0.35 -0.20 -0.09 0.00 -1.45 0.00 0.00 58.65 57.26 3hb9 h GLN 785 Cb 0.52 -0.17 -0.02 0.00 -0.05 0.00 0.00 27.48 27.76 3hb9 h GLN 785 CO -0.41 0.88 0.02 0.00 -0.95 0.00 0.00 178.83 178.37 3hb9 h ALA 786 N 1.13 0.78 -0.61 3.87 0.00 0.83 -2.69 119.26 122.58 3hb9 h ALA 786 Ca 0.24 -0.29 -0.00 0.00 0.00 0.00 0.00 54.91 54.85 3hb9 h ALA 786 Cb 0.22 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 17.76 3hb9 h ALA 786 CO -0.02 0.60 0.36 0.82 0.00 0.00 0.00 179.25 181.02 3hb9 h ILE 787 N 0.91 1.18 0.00 0.00 2.04 0.34 -1.52 117.51 120.46 3hb9 h ILE 787 Ca 0.17 -0.41 -0.02 0.00 1.00 0.00 0.00 64.86 65.60 3hb9 h ILE 787 Cb 0.52 0.35 -0.00 0.00 -0.74 0.00 0.00 36.82 36.95 3hb9 h ILE 787 CO 0.03 0.19 -0.09 0.44 0.00 0.00 0.00 178.15 178.71 3hb9 h ASP 788 N 0.83 0.00 -0.08 1.72 3.45 -1.11 -1.57 116.42 119.65 3hb9 h ASP 788 Ca 0.22 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.68 3hb9 h ASP 788 Cb -0.01 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 38.76 3hb9 h ASP 788 CO -0.04 0.09 0.00 0.00 -1.57 0.00 0.00 179.24 177.72 3hb9 n ALA 789 N -2.38 2.57 -0.60 3.45 0.00 -0.61 -4.92 120.51 118.01 3hb9 n ALA 789 Ca -0.02 -0.37 0.00 0.00 0.00 0.00 0.00 53.44 53.05 3hb9 n ALA 789 Cb 0.18 -1.20 0.00 0.00 0.00 0.00 0.00 19.45 18.43 3hb9 n ALA 789 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3hb9 n GLY 790 N 1.03 0.89 3.75 0.00 0.00 -0.59 -4.18 105.19 106.09 3hb9 n GLY 790 Ca 0.17 -0.47 -0.35 0.00 0.00 0.00 0.00 46.02 45.36 3hb9 n GLY 790 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3hb9 s VAL 791 N -2.00 2.58 -0.26 1.61 0.11 -0.97 -4.94 120.40 116.53 3hb9 s VAL 791 Ca 0.00 0.34 -0.16 0.00 -2.93 0.00 0.00 61.98 59.22 3hb9 s VAL 791 Cb 0.00 -3.05 -0.14 0.00 -1.53 0.00 0.00 36.38 31.66 3hb9 s VAL 791 CO 0.00 -0.10 -0.20 0.47 -3.33 0.00 0.00 175.10 171.93 3hb9 n ASP 792 N -1.93 1.93 -4.14 3.54 10.43 -0.98 -4.84 116.55 120.57 3hb9 n ASP 792 Ca 0.13 0.36 -0.18 0.00 2.57 0.00 0.00 54.79 57.67 3hb9 n ASP 792 Cb 0.50 -0.86 -0.13 0.00 1.84 0.00 0.00 41.12 42.47 3hb9 n ASP 792 CO 0.00 0.00 0.00 -0.63 -1.07 0.00 0.00 177.20 175.50 3hb9 s ILE 793 N -2.48 1.02 0.09 0.53 1.01 -0.96 -1.30 121.20 119.11 3hb9 s ILE 793 Ca -0.36 -1.11 0.05 0.00 0.00 0.00 0.00 60.65 59.23 3hb9 s ILE 793 Cb 0.12 -0.96 -0.03 0.00 0.01 0.00 0.00 42.46 41.60 3hb9 s ILE 793 CO 0.51 -0.13 -0.12 0.27 0.00 0.00 0.00 174.94 175.47 3hb9 s ILE 794 N -1.06 1.05 -0.24 2.92 -4.36 -0.73 -1.05 121.20 117.72 3hb9 s ILE 794 Ca -0.01 -1.48 -0.12 0.00 -0.26 0.00 0.00 60.65 58.78 3hb9 s ILE 794 Cb -0.09 -1.22 -0.05 0.00 1.25 0.00 0.00 42.46 42.36 3hb9 s ILE 794 CO 0.02 -0.39 0.23 -1.81 0.24 0.00 0.00 174.94 173.23 3hb9 s ASP 795 N -2.11 6.17 0.24 4.36 1.11 -0.57 -0.08 116.67 125.79 3hb9 s ASP 795 Ca 0.02 0.18 0.01 0.00 0.18 0.00 0.00 52.55 52.95 3hb9 s ASP 795 Cb -0.07 -2.14 -0.05 0.00 1.07 0.00 0.00 42.92 41.73 3hb9 s ASP 795 CO 0.02 -0.01 0.07 0.42 1.18 0.00 0.00 175.17 176.85 3hb9 s THR 796 N 1.33 0.62 0.08 -1.27 -4.23 0.31 -4.54 115.64 107.94 3hb9 s THR 796 Ca 0.10 -2.00 0.02 0.00 -1.18 0.00 0.00 61.69 58.63 3hb9 s THR 796 Cb -0.14 -2.52 -0.04 0.00 1.34 0.00 0.00 72.50 71.14 3hb9 s THR 796 CO 0.07 -0.11 -0.07 0.00 -0.54 0.00 0.00 174.62 173.97 3hb9 s ALA 797 N -3.71 0.86 0.38 3.99 0.00 -1.16 -0.14 121.76 121.98 3hb9 s ALA 797 Ca 0.35 -1.22 -0.27 0.00 0.00 0.00 0.00 51.96 50.81 3hb9 s ALA 797 Cb 0.07 0.14 -0.09 0.00 0.00 0.00 0.00 23.12 23.24 3hb9 s ALA 797 CO 0.11 -0.20 1.34 0.14 0.00 0.00 0.00 175.76 177.16 3hb9 s VAL 798 N -3.18 2.51 0.24 0.00 -7.23 -1.26 -1.15 120.40 110.33 3hb9 s VAL 798 Ca 0.07 0.48 -0.09 0.00 -1.81 0.00 0.00 61.98 60.63 3hb9 s VAL 798 Cb 0.02 -3.29 0.37 0.00 0.56 0.00 0.00 36.38 34.04 3hb9 s VAL 798 CO -0.04 0.09 1.42 0.00 -0.31 0.00 0.00 175.10 176.26 3hb9 n ALA 799 N 0.35 0.14 0.30 1.32 0.00 -1.26 0.66 120.51 122.02 3hb9 n ALA 799 Ca 0.02 0.98 0.04 0.00 0.00 0.00 0.00 53.44 54.48 3hb9 n ALA 799 Cb 0.42 -0.55 0.17 0.00 0.00 0.00 0.00 19.45 19.49 3hb9 n ALA 799 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 3hb9 n SER 800 N -5.45 0.00 -0.40 0.00 3.41 -1.26 -1.31 113.62 108.61 3hb9 n SER 800 Ca 0.13 0.41 0.07 0.00 -0.26 0.00 0.00 58.87 59.22 3hb9 n SER 800 Cb 0.43 -0.44 0.12 0.00 -0.26 0.00 0.00 64.21 64.06 3hb9 n SER 800 CO 0.00 0.00 0.00 0.23 -0.16 0.00 0.00 175.04 175.11 3hb9 n MET 801 N -1.44 0.97 -4.13 4.33 2.00 0.21 -4.77 117.12 114.29 3hb9 n MET 801 Ca 0.02 -2.36 -0.28 0.00 0.00 0.00 0.00 57.70 55.08 3hb9 n MET 801 Cb 0.08 -1.19 -0.04 0.00 0.00 0.00 0.00 33.22 32.08 3hb9 n MET 801 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 175.97 174.84 3hb9 n SER 802 N -0.91 3.02 -0.04 7.83 3.41 -0.43 -4.67 113.62 121.83 3hb9 n SER 802 Ca 0.13 -2.93 0.00 0.00 -0.26 0.00 0.00 58.87 55.81 3hb9 n SER 802 Cb 0.71 0.17 -0.00 0.00 -0.26 0.00 0.00 64.21 64.83 3hb9 n SER 802 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3hb9 n GLY 803 N -0.84 -2.25 7.00 5.00 0.00 0.52 -4.81 105.19 109.81 3hb9 n GLY 803 Ca -0.12 -1.47 0.00 0.00 0.00 0.00 0.00 46.02 44.43 3hb9 n GLY 803 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3hb9 n LEU 804 N -2.34 0.00 0.00 0.99 4.77 -1.20 -1.47 117.00 117.75 3hb9 n LEU 804 Ca -0.00 0.00 0.04 0.00 -0.03 0.00 0.00 56.01 56.02 3hb9 n LEU 804 Cb 0.02 0.00 0.22 0.00 -2.33 0.00 0.00 43.42 41.33 3hb9 n LEU 804 CO 0.00 0.00 0.60 0.35 -1.33 0.00 0.00 177.39 177.01 3hb9 n THR 805 N 0.00 0.94 -1.97 -5.08 -2.24 -1.26 -0.27 114.28 104.40 3hb9 n THR 805 Ca 0.00 0.24 0.00 0.00 -2.27 0.00 0.00 64.05 62.02 3hb9 n THR 805 Cb 0.00 -1.08 0.00 0.00 -2.10 0.00 0.00 70.33 67.15 3hb9 n THR 805 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 3hb9 n SER 806 N -1.34 0.00 -4.86 3.42 2.88 -0.54 -4.66 113.62 108.52 3hb9 n SER 806 Ca 0.04 -0.98 -0.31 0.00 -1.33 0.00 0.00 58.87 56.29 3hb9 n SER 806 Cb 0.08 0.00 0.04 0.00 -0.75 0.00 0.00 64.21 63.58 3hb9 n SER 806 CO 0.00 0.00 0.00 -1.10 -1.23 0.00 0.00 175.04 172.71 3hb9 s GLN 807 N -2.42 3.07 0.76 -1.46 -1.52 -1.26 -0.74 119.66 116.08 3hb9 s GLN 807 Ca 0.00 0.65 -0.15 0.00 -1.95 0.00 0.00 55.36 53.92 3hb9 s GLN 807 Cb 0.00 -2.03 0.05 0.00 -0.22 0.00 0.00 33.01 30.82 3hb9 s GLN 807 CO 0.00 -0.93 1.22 -2.14 -0.25 0.00 0.00 175.29 173.19 3hb9 s PRO 808 N -5.23 1.93 0.15 2.91 0.02 -1.26 -0.35 135.00 133.16 3hb9 s PRO 808 Ca 0.57 1.81 -0.31 0.00 0.02 0.00 0.00 61.00 63.09 3hb9 s PRO 808 Cb -0.12 -1.80 -0.09 0.00 0.02 0.00 0.00 34.50 32.51 3hb9 s PRO 808 CO 0.53 -2.01 1.54 0.45 -0.33 0.00 0.00 177.00 177.19 3hb9 s SER 809 N -2.00 6.63 0.12 2.53 0.15 -1.26 -2.97 113.70 116.91 3hb9 s SER 809 Ca 0.75 2.55 -0.15 0.00 0.70 0.00 0.00 55.95 59.80 3hb9 s SER 809 Cb -0.30 -2.59 -0.02 0.00 -1.71 0.00 0.00 66.02 61.40 3hb9 s SER 809 CO 0.47 -0.80 1.57 0.00 1.20 0.00 0.00 173.24 175.68 3hb9 h ALA 810 N 6.96 0.54 -0.69 5.45 0.00 -1.46 -2.95 119.26 127.10 3hb9 h ALA 810 Ca -0.42 -0.27 0.01 0.00 0.00 0.00 0.00 54.91 54.23 3hb9 h ALA 810 Cb 1.20 -0.15 -0.04 0.00 0.00 0.00 0.00 17.79 18.81 3hb9 h ALA 810 CO 0.91 0.33 0.46 -0.91 0.00 0.00 0.00 179.25 180.03 3hb9 h ASN 811 N 0.54 0.78 -0.27 0.00 -0.26 -1.92 -2.45 115.58 112.00 3hb9 h ASN 811 Ca 0.11 -0.02 -0.10 0.00 -0.56 0.00 0.00 56.30 55.74 3hb9 h ASN 811 Cb 0.49 -0.19 -0.01 0.00 -1.06 0.00 0.00 38.32 37.55 3hb9 h ASN 811 CO 0.02 0.56 -0.21 0.28 -1.06 0.00 0.00 177.43 177.03 3hb9 h SER 812 N 0.93 0.65 -0.86 5.81 0.02 -1.95 -3.10 113.55 115.05 3hb9 h SER 812 Ca 0.26 -0.45 0.01 0.00 -0.84 0.00 0.00 61.79 60.77 3hb9 h SER 812 Cb -0.09 -0.18 -0.04 0.00 0.14 0.00 0.00 62.40 62.23 3hb9 h SER 812 CO -0.06 0.96 0.57 0.25 -1.14 0.00 0.00 176.83 177.41 3hb9 h LEU 813 N 0.35 0.98 -0.57 5.07 5.85 -1.40 -0.53 115.31 125.06 3hb9 h LEU 813 Ca 0.05 -0.02 0.07 0.00 0.84 0.00 0.00 57.88 58.82 3hb9 h LEU 813 Cb 0.75 -0.24 -0.06 0.00 0.37 0.00 0.00 40.66 41.48 3hb9 h LEU 813 CO 0.05 0.71 0.24 0.22 -0.34 0.00 0.00 178.44 179.33 3hb9 h TYR 814 N 1.16 0.43 0.00 1.25 3.20 -1.36 -1.24 116.97 120.41 3hb9 h TYR 814 Ca 0.32 0.03 -0.19 0.00 3.14 0.00 0.00 58.73 62.02 3hb9 h TYR 814 Cb -0.13 -0.11 -0.03 0.00 1.54 0.00 0.00 36.73 38.01 3hb9 h TYR 814 CO -0.00 0.16 -0.99 1.88 -1.64 0.00 0.00 178.16 177.57 3hb9 h TYR 815 N 0.45 0.00 -0.39 -3.82 -1.99 -1.56 -3.27 116.97 106.39 3hb9 h TYR 815 Ca 0.27 0.00 0.03 0.00 2.00 0.00 0.00 58.73 61.03 3hb9 h TYR 815 Cb 0.27 0.00 -0.02 0.00 2.00 0.00 0.00 36.73 38.98 3hb9 h TYR 815 CO -0.14 0.86 0.26 0.00 -0.00 0.00 0.00 178.16 179.14 3hb9 h ALA 816 N 1.14 1.84 0.00 3.88 0.00 -0.47 -2.34 119.26 123.32 3hb9 h ALA 816 Ca -0.05 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.84 3hb9 h ALA 816 Cb 1.70 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 19.37 3hb9 h ALA 816 CO 0.10 0.11 -0.17 1.28 0.00 0.00 0.00 179.25 180.58 3hb9 n LEU 817 N -4.48 0.22 -4.66 0.00 4.77 -0.52 -4.88 117.00 107.44 3hb9 n LEU 817 Ca 0.04 0.35 -0.52 0.00 -0.03 0.00 0.00 56.01 55.85 3hb9 n LEU 817 Cb 0.15 -0.41 -0.06 0.00 -2.33 0.00 0.00 43.42 40.78 3hb9 n LEU 817 CO 0.35 0.02 1.19 0.59 -1.33 0.00 0.00 177.39 178.21 3hb9 n ASN 818 N -1.57 2.47 0.00 -1.43 5.03 -0.88 -1.23 115.26 117.64 3hb9 n ASN 818 Ca 0.06 1.07 0.00 0.00 0.87 0.00 0.00 54.58 56.59 3hb9 n ASN 818 Cb 0.35 -1.25 0.00 0.00 -1.02 0.00 0.00 39.78 37.85 3hb9 n ASN 818 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 3hb9 n GLY 819 N 3.51 0.55 3.90 7.41 0.00 -1.26 -5.07 105.19 114.23 3hb9 n GLY 819 Ca 0.21 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.95 3hb9 n GLY 819 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3hb9 s PHE 820 N -2.19 3.42 -2.00 1.61 0.40 -0.37 -5.01 117.98 113.84 3hb9 s PHE 820 Ca 0.00 0.13 0.15 0.00 -0.60 0.00 0.00 56.93 56.61 3hb9 s PHE 820 Cb 0.00 -1.66 0.90 0.00 0.51 0.00 0.00 43.02 42.77 3hb9 s PHE 820 CO 0.00 0.54 1.31 -0.35 0.70 0.00 0.00 175.22 177.42 3hb9 n PRO 821 N -0.20 0.49 -4.19 0.24 -0.04 -1.26 -4.56 135.00 125.47 3hb9 n PRO 821 Ca -0.07 0.00 -0.22 0.00 -0.04 0.00 0.00 63.50 63.18 3hb9 n PRO 821 Cb 0.53 -1.48 -0.17 0.00 -0.04 0.00 0.00 33.50 32.34 3hb9 n PRO 821 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 3hb9 s ARG 822 N -2.00 1.02 0.30 0.54 0.52 -1.26 -5.05 118.95 113.02 3hb9 s ARG 822 Ca 0.23 -0.15 0.08 0.00 -0.52 0.00 0.00 55.73 55.36 3hb9 s ARG 822 Cb 0.10 -1.01 -0.04 0.00 0.52 0.00 0.00 34.95 34.53 3hb9 s ARG 822 CO 0.17 -0.09 0.12 -1.01 0.02 0.00 0.00 175.30 174.51 3hb9 s HIS 823 N 1.01 2.80 -0.26 -0.53 3.76 -1.26 -4.92 115.29 115.88 3hb9 s HIS 823 Ca -0.09 -0.27 -0.20 0.00 -0.15 0.00 0.00 55.06 54.35 3hb9 s HIS 823 Cb -0.14 -1.46 -0.02 0.00 1.11 0.00 0.00 32.58 32.06 3hb9 s HIS 823 CO -0.00 0.45 0.60 -1.17 -0.85 0.00 0.00 174.74 173.77 3hb9 s LEU 824 N -3.80 4.07 -1.03 0.89 2.96 -1.26 -1.29 118.68 119.22 3hb9 s LEU 824 Ca 0.35 0.61 -0.23 0.00 -0.22 0.00 0.00 54.13 54.64 3hb9 s LEU 824 Cb -0.05 -2.80 0.01 0.00 0.50 0.00 0.00 46.19 43.84 3hb9 s LEU 824 CO 0.23 -0.37 1.70 -0.60 -1.32 0.00 0.00 176.35 175.99 3hb9 s ARG 825 N 2.48 3.18 0.20 1.98 6.06 -0.56 -4.86 118.95 127.42 3hb9 s ARG 825 Ca 0.25 -0.94 -0.22 0.00 -2.50 0.00 0.00 55.73 52.31 3hb9 s ARG 825 Cb -0.15 -5.27 0.07 0.00 0.06 0.00 0.00 34.95 29.66 3hb9 s ARG 825 CO 0.09 -2.78 0.98 -0.08 -2.50 0.00 0.00 175.30 171.01 3hb9 s THR 826 N 7.20 0.00 -0.31 4.11 -1.32 -1.26 -4.52 115.64 119.54 3hb9 s THR 826 Ca 0.57 -0.67 -0.07 0.00 -1.21 0.00 0.00 61.69 60.32 3hb9 s THR 826 Cb -0.02 -2.58 0.02 0.00 -1.51 0.00 0.00 72.50 68.41 3hb9 s THR 826 CO -0.03 0.00 0.09 -0.62 -2.21 0.00 0.00 174.62 171.86 3hb9 s ASP 827 N -3.21 5.21 0.04 8.08 3.68 -1.25 -5.00 116.67 124.21 3hb9 s ASP 827 Ca 0.18 -0.86 -0.22 0.00 2.13 0.00 0.00 52.55 53.77 3hb9 s ASP 827 Cb -0.02 -1.88 -0.15 0.00 -1.45 0.00 0.00 42.92 39.41 3hb9 s ASP 827 CO 0.05 -0.24 1.42 0.40 0.13 0.00 0.00 175.17 176.93 3hb9 h ILE 828 N 5.97 1.29 -0.84 4.11 5.03 -1.97 -1.51 117.51 129.58 3hb9 h ILE 828 Ca -0.28 -0.95 0.15 0.00 -0.12 0.00 0.00 64.86 63.66 3hb9 h ILE 828 Cb 1.11 1.72 -0.06 0.00 -3.03 0.00 0.00 36.82 36.55 3hb9 h ILE 828 CO 0.61 0.27 0.55 -0.08 -0.68 0.00 0.00 178.15 178.82 3hb9 h GLU 829 N -0.13 0.56 -0.09 2.37 4.81 -2.00 -0.48 114.58 119.63 3hb9 h GLU 829 Ca 0.03 -0.03 -0.11 0.00 -0.13 0.00 0.00 59.36 59.11 3hb9 h GLU 829 Cb 0.43 -0.13 0.00 0.00 0.63 0.00 0.00 28.75 29.69 3hb9 h GLU 829 CO 0.01 0.37 -0.37 0.78 -0.73 0.00 0.00 179.01 179.07 3hb9 h GLY 830 N 0.58 0.44 0.09 1.92 0.00 -1.92 -2.57 103.07 101.62 3hb9 h GLY 830 Ca 0.42 -0.61 0.16 0.00 0.00 0.00 0.00 47.33 47.30 3hb9 h GLY 830 CO -0.17 0.55 0.38 -0.33 0.00 0.00 0.00 176.54 176.96 3hb9 h MET 831 N -0.05 0.49 -0.20 4.80 2.86 -0.12 0.46 114.93 123.17 3hb9 h MET 831 Ca -0.02 -0.03 -0.04 0.00 -2.06 0.00 0.00 59.70 57.54 3hb9 h MET 831 Cb 1.02 -0.11 -0.01 0.00 0.06 0.00 0.00 31.60 32.56 3hb9 h MET 831 CO 0.08 0.32 -0.04 0.93 1.06 0.00 0.00 176.91 179.26 3hb9 h GLU 832 N 0.50 0.39 -0.88 1.72 4.39 -1.20 -0.10 114.58 119.40 3hb9 h GLU 832 Ca 0.47 -0.14 0.00 0.00 0.34 0.00 0.00 59.36 60.03 3hb9 h GLU 832 Cb 0.74 -0.02 -0.04 0.00 -0.10 0.00 0.00 28.75 29.32 3hb9 h GLU 832 CO -0.42 0.63 0.57 1.03 -1.16 0.00 0.00 179.01 179.66 3hb9 h SER 833 N 0.11 1.02 -0.24 1.42 0.87 -0.83 -0.20 113.55 115.71 3hb9 h SER 833 Ca 0.05 -0.04 -0.10 0.00 -1.23 0.00 0.00 61.79 60.47 3hb9 h SER 833 Cb 0.48 -0.26 -0.00 0.00 -0.44 0.00 0.00 62.40 62.18 3hb9 h SER 833 CO 0.02 0.76 -0.26 -0.07 -0.53 0.00 0.00 176.83 176.75 3hb9 h LEU 834 N 1.20 0.64 -0.34 2.23 3.38 -0.08 -2.70 115.31 119.64 3hb9 h LEU 834 Ca 0.32 -0.48 0.06 0.00 0.09 0.00 0.00 57.88 57.87 3hb9 h LEU 834 Cb -0.11 -0.18 -0.05 0.00 0.09 0.00 0.00 40.66 40.40 3hb9 h LEU 834 CO -0.07 0.99 -0.01 -1.28 0.09 0.00 0.00 178.44 178.17 3hb9 h SER 835 N 0.30 -0.16 -0.56 -0.43 0.87 -0.45 0.18 113.55 113.30 3hb9 h SER 835 Ca 0.03 0.08 0.03 0.00 -1.23 0.00 0.00 61.79 60.70 3hb9 h SER 835 Cb 0.82 0.14 -0.04 0.00 -0.44 0.00 0.00 62.40 62.89 3hb9 h SER 835 CO 0.06 -0.04 0.34 0.45 -0.53 0.00 0.00 176.83 177.11 3hb9 h HIS 836 N 0.08 0.63 -0.23 2.24 3.86 -1.09 0.25 115.15 120.90 3hb9 h HIS 836 Ca 0.16 0.02 0.04 0.00 -1.16 0.00 0.00 60.37 59.43 3hb9 h HIS 836 Cb 0.23 -0.20 -0.04 0.00 1.06 0.00 0.00 27.41 28.46 3hb9 h HIS 836 CO -0.25 0.36 -0.00 -0.92 0.86 0.00 0.00 177.93 177.98 3hb9 h TYR 837 N 0.67 -0.02 0.00 2.45 3.20 -1.01 -2.51 116.97 119.75 3hb9 h TYR 837 Ca 0.22 0.02 -0.03 0.00 3.14 0.00 0.00 58.73 62.08 3hb9 h TYR 837 Cb 0.02 0.04 -0.00 0.00 1.54 0.00 0.00 36.73 38.33 3hb9 h TYR 837 CO -0.06 -0.04 -0.14 -1.49 -1.64 0.00 0.00 178.16 174.79 3hb9 h TRP 838 N 0.07 0.00 -0.59 -3.82 4.06 -0.55 -2.60 115.95 112.51 3hb9 h TRP 838 Ca 0.11 0.00 0.04 0.00 2.06 0.00 0.00 58.89 61.10 3hb9 h TRP 838 Cb 0.14 0.00 -0.05 0.00 -1.00 0.00 0.00 29.16 28.25 3hb9 h TRP 838 CO -0.19 0.14 0.33 0.77 -3.56 0.00 0.00 178.44 175.93 3hb9 h SER 839 N 0.00 0.50 0.00 -3.49 0.02 -0.49 -1.18 113.55 108.91 3hb9 h SER 839 Ca -0.00 0.02 -0.00 0.00 -0.84 0.00 0.00 61.79 60.97 3hb9 h SER 839 Cb 0.68 -0.08 0.00 0.00 0.14 0.00 0.00 62.40 63.14 3hb9 h SER 839 CO 0.02 0.34 -0.00 0.74 -1.14 0.00 0.00 176.83 176.79 3hb9 h THR 840 N 0.63 1.54 -0.42 -2.27 2.02 -1.42 -3.27 112.91 109.72 3hb9 h THR 840 Ca 0.25 -1.61 -0.01 0.00 0.77 0.00 0.00 66.41 65.81 3hb9 h THR 840 Cb 0.11 2.63 -0.02 0.00 -1.74 0.00 0.00 68.15 69.13 3hb9 h THR 840 CO -0.15 0.42 0.21 0.58 0.37 0.00 0.00 175.52 176.95 3hb9 h VAL 841 N -0.69 1.14 -0.68 3.16 2.07 -1.48 -1.80 116.25 117.97 3hb9 h VAL 841 Ca -0.00 -0.40 0.04 0.00 0.82 0.00 0.00 66.70 67.16 3hb9 h VAL 841 Cb 0.69 0.60 -0.04 0.00 -1.52 0.00 0.00 31.29 31.02 3hb9 h VAL 841 CO 0.00 0.17 0.45 -0.09 0.02 0.00 0.00 177.57 178.11 3hb9 h ARG 842 N 0.59 0.76 -0.29 1.57 2.43 -1.28 -2.24 114.38 115.91 3hb9 h ARG 842 Ca 0.15 -0.05 0.04 0.00 -0.81 0.00 0.00 59.98 59.31 3hb9 h ARG 842 Cb 0.06 -0.17 -0.02 0.00 -0.42 0.00 0.00 29.97 29.42 3hb9 h ARG 842 CO -0.02 0.50 0.20 1.15 -1.51 0.00 0.00 179.97 180.29 3hb9 h THR 843 N 0.79 0.98 -0.03 0.20 2.02 -1.37 -0.37 112.91 115.12 3hb9 h THR 843 Ca 0.28 -0.08 0.01 0.00 0.77 0.00 0.00 66.41 67.38 3hb9 h THR 843 Cb 0.11 0.72 -0.00 0.00 -1.74 0.00 0.00 68.15 67.25 3hb9 h THR 843 CO -0.08 0.04 0.03 1.88 0.37 0.00 0.00 175.52 177.76 3hb9 h TYR 844 N 0.23 0.00 -0.71 3.16 0.99 -1.47 -2.95 116.97 116.23 3hb9 h TYR 844 Ca 0.13 0.00 -0.44 0.00 2.00 0.00 0.00 58.73 60.41 3hb9 h TYR 844 Cb 0.21 0.00 -0.25 0.00 1.00 0.00 0.00 36.73 37.69 3hb9 h TYR 844 CO -0.00 0.00 0.15 0.66 -0.00 0.00 0.00 178.16 178.97 3hb9 n TYR 845 N -3.97 2.32 0.26 4.88 4.02 -0.15 -4.75 117.16 119.77 3hb9 n TYR 845 Ca -0.02 -2.15 0.12 0.00 -0.01 0.00 0.00 57.90 55.84 3hb9 n TYR 845 Cb 0.12 -0.79 0.70 0.00 -0.02 0.00 0.00 39.34 39.35 3hb9 n TYR 845 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 176.86 176.51 3hb9 h SER 846 N 1.49 0.00 0.57 7.72 4.64 -1.60 -2.44 113.55 123.93 3hb9 h SER 846 Ca 0.43 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.75 3hb9 h SER 846 Cb 1.64 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.73 3hb9 h SER 846 CO 0.90 0.13 0.00 0.47 -0.87 0.00 0.00 176.83 177.46 3hb9 n ASP 847 N -3.70 0.00 -0.13 4.97 8.00 -1.26 -3.30 116.55 121.13 3hb9 n ASP 847 Ca -0.02 -0.12 0.01 0.00 0.71 0.00 0.00 54.79 55.37 3hb9 n ASP 847 Cb 0.24 -0.29 0.03 0.00 -0.02 0.00 0.00 41.12 41.08 3hb9 n ASP 847 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 3hb9 n PHE 848 N -1.29 0.07 -1.86 1.24 3.01 -0.92 -4.98 117.46 112.73 3hb9 n PHE 848 Ca 0.14 -0.32 -0.41 0.00 1.01 0.00 0.00 57.45 57.86 3hb9 n PHE 848 Cb 0.24 -0.03 -0.01 0.00 -0.01 0.00 0.00 39.48 39.67 3hb9 n PHE 848 CO 0.00 0.00 0.00 -1.21 1.01 0.00 0.00 176.76 176.56 3hb9 s GLU 849 N -0.72 4.16 0.52 -1.08 0.41 -1.21 -3.79 118.70 116.99 3hb9 s GLU 849 Ca 0.04 2.50 -0.21 0.00 -0.41 0.00 0.00 54.97 56.90 3hb9 s GLU 849 Cb 0.03 -3.01 -0.06 0.00 -1.78 0.00 0.00 34.13 29.31 3hb9 s GLU 849 CO 0.03 -0.51 1.19 0.45 -0.49 0.00 0.00 175.26 175.94 3hb9 s SER 852 N 0.03 5.71 0.00 -0.19 0.15 -1.10 -4.93 113.70 113.38 3hb9 s SER 852 Ca 0.56 2.36 0.16 0.00 0.70 0.00 0.00 55.95 59.73 3hb9 s SER 852 Cb -0.46 -2.60 0.90 0.00 -1.71 0.00 0.00 66.02 62.15 3hb9 s SER 852 CO 0.56 -1.23 1.59 -0.90 1.20 0.00 0.00 173.24 174.45 3hb9 n ASP 853 N -1.00 0.27 -4.63 5.45 5.68 -1.26 -4.77 116.55 116.30 3hb9 n ASP 853 Ca 0.10 -1.55 -0.42 0.00 -0.50 0.00 0.00 54.79 52.42 3hb9 n ASP 853 Cb 0.49 -0.02 -0.03 0.00 -1.14 0.00 0.00 41.12 40.41 3hb9 n ASP 853 CO 0.00 0.00 0.00 -0.63 -1.33 0.00 0.00 177.20 175.24 3hb9 s ILE 854 N -1.96 4.64 -0.02 2.12 1.01 -1.26 -4.88 121.20 120.85 3hb9 s ILE 854 Ca 0.25 1.47 0.08 0.00 0.00 0.00 0.00 60.65 62.45 3hb9 s ILE 854 Cb 0.12 -4.30 -0.12 0.00 0.01 0.00 0.00 42.46 38.18 3hb9 s ILE 854 CO 0.19 -0.38 0.15 0.29 0.00 0.00 0.00 174.94 175.19 3hb9 n LYS 855 N 6.57 0.58 -4.38 2.79 4.01 -1.26 -5.00 118.16 121.46 3hb9 n LYS 855 Ca 0.08 -0.06 -0.26 0.00 -0.51 0.00 0.00 58.31 57.56 3hb9 n LYS 855 Cb 0.48 -1.18 -0.12 0.00 -0.51 0.00 0.00 35.03 33.69 3hb9 n LYS 855 CO 0.00 0.00 0.00 -1.12 -1.11 0.00 0.00 177.40 175.17 3hb9 s SER 856 N -3.03 3.12 0.52 4.39 0.01 -1.26 -5.07 113.70 112.38 3hb9 s SER 856 Ca -0.03 -0.83 -0.23 0.00 1.31 0.00 0.00 55.95 56.18 3hb9 s SER 856 Cb 0.05 -0.21 -0.06 0.00 0.21 0.00 0.00 66.02 66.00 3hb9 s SER 856 CO 0.32 0.08 1.32 -0.81 0.41 0.00 0.00 173.24 174.57 3hb9 n PRO 857 N 0.46 1.74 -3.92 12.44 -0.04 -1.26 -5.01 135.00 139.40 3hb9 n PRO 857 Ca -0.14 0.63 -0.30 0.00 -0.04 0.00 0.00 63.50 63.65 3hb9 n PRO 857 Cb 0.55 -2.52 -0.16 0.00 -0.04 0.00 0.00 33.50 31.34 3hb9 n PRO 857 CO 0.00 0.00 0.00 1.21 -0.04 0.00 0.00 175.50 176.67 3hb9 s ASN 858 N -0.82 3.68 0.02 3.54 3.04 0.38 -4.98 114.94 119.80 3hb9 s ASN 858 Ca 0.69 -1.10 0.25 0.00 0.04 0.00 0.00 52.86 52.74 3hb9 s ASN 858 Cb -0.44 -1.11 0.50 0.00 -1.54 0.00 0.00 41.25 38.66 3hb9 s ASN 858 CO 0.51 -0.23 1.41 0.35 -3.04 0.00 0.00 177.10 176.10 3hb9 n THR 859 N 4.72 0.07 0.30 -5.21 -2.24 -1.26 -3.84 114.28 106.81 3hb9 n THR 859 Ca -0.12 -0.06 0.18 0.00 -2.27 0.00 0.00 64.05 61.79 3hb9 n THR 859 Cb 0.45 0.14 0.90 0.00 -2.10 0.00 0.00 70.33 69.72 3hb9 n THR 859 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 3hb9 h GLU 860 N 0.00 0.00 -0.19 -0.78 5.08 -1.97 -2.28 114.58 114.44 3hb9 h GLU 860 Ca 0.00 0.00 0.06 0.00 -1.00 0.00 0.00 59.36 58.42 3hb9 h GLU 860 Cb 0.55 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.79 3hb9 h GLU 860 CO 0.00 0.00 0.25 -0.84 -1.00 0.00 0.00 179.01 177.42 3hb9 h ILE 861 N 0.00 0.38 0.00 3.13 3.07 -1.95 0.13 117.51 122.26 3hb9 h ILE 861 Ca 0.00 0.00 0.00 0.00 1.55 0.00 0.00 64.86 66.41 3hb9 h ILE 861 Cb 0.19 0.80 0.00 0.00 -0.27 0.00 0.00 36.82 37.54 3hb9 h ILE 861 CO 0.00 0.00 0.00 -1.22 -1.05 0.00 0.00 178.15 175.88 3hb9 n TYR 862 N -3.65 0.01 -0.08 0.16 0.53 -0.86 -0.61 117.16 112.66 3hb9 n TYR 862 Ca 0.02 0.00 -0.16 0.00 -1.02 0.00 0.00 57.90 56.74 3hb9 n TYR 862 Cb 0.37 -0.51 -0.06 0.00 -1.03 0.00 0.00 39.34 38.12 3hb9 n TYR 862 CO 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 176.86 175.84 3hb9 n GLN 863 N -1.51 0.33 0.04 -0.72 0.00 0.39 -4.84 117.38 111.08 3hb9 n GLN 863 Ca 0.04 0.14 -0.05 0.00 0.00 0.00 0.00 57.00 57.13 3hb9 n GLN 863 Cb 0.19 -1.08 -0.10 0.00 0.00 0.00 0.00 30.24 29.25 3hb9 n GLN 863 CO 0.00 0.00 0.00 1.12 0.00 0.00 0.00 177.06 178.18 3hb9 h HIS 864 N -0.50 0.00 -2.19 2.61 2.07 -1.47 -3.45 115.15 112.22 3hb9 h HIS 864 Ca -0.39 0.00 -0.26 0.00 -2.85 0.00 0.00 60.37 56.87 3hb9 h HIS 864 Cb 1.36 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.34 3hb9 h HIS 864 CO -0.04 0.87 -0.35 0.39 -3.07 0.00 0.00 177.93 175.72 3hb9 n GLU 865 N -3.16 -1.59 -2.47 5.12 1.02 0.22 -4.55 120.64 115.23 3hb9 n GLU 865 Ca -0.07 0.63 -0.42 0.00 -0.02 0.00 0.00 57.16 57.28 3hb9 n GLU 865 Cb 0.93 -4.86 -0.03 0.00 -0.02 0.00 0.00 31.44 27.47 3hb9 n GLU 865 CO 0.00 0.00 0.00 -1.64 1.18 0.00 0.00 177.13 176.67 3hb9 s MET 866 N -4.82 4.41 0.59 3.49 -1.94 -1.26 -4.90 119.30 114.86 3hb9 s MET 866 Ca 0.05 1.69 -0.16 0.00 -1.71 0.00 0.00 55.69 55.56 3hb9 s MET 866 Cb -0.02 -3.46 -0.04 0.00 2.01 0.00 0.00 34.83 33.32 3hb9 s MET 866 CO 0.06 -0.33 1.05 -1.25 -0.01 0.00 0.00 175.02 174.54 3hb9 s PRO 867 N 1.61 3.39 0.00 2.03 0.04 -1.26 -4.77 135.00 136.04 3hb9 s PRO 867 Ca 0.57 1.16 0.00 0.00 0.04 0.00 0.00 61.00 62.77 3hb9 s PRO 867 Cb -0.26 -2.05 0.00 0.00 0.04 0.00 0.00 34.50 32.23 3hb9 s PRO 867 CO 0.26 -0.75 0.00 0.41 0.04 0.00 0.00 177.00 176.96 3hb9 n GLY 868 N -1.09 2.09 1.45 0.56 0.00 -1.13 -0.22 105.19 106.84 3hb9 n GLY 868 Ca 0.08 0.02 0.00 0.00 0.00 0.00 0.00 46.02 46.12 3hb9 n GLY 868 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hb9 n GLY 869 N 0.00 2.66 0.11 -0.02 0.00 -1.26 -4.43 105.19 102.25 3hb9 n GLY 869 Ca 0.00 -0.59 0.09 0.00 0.00 0.00 0.00 46.02 45.52 3hb9 n GLY 869 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 3hb9 n GLN 870 N 0.19 0.11 0.00 1.61 0.00 0.69 -0.14 117.38 119.85 3hb9 n GLN 870 Ca 0.21 0.54 0.13 0.00 -0.00 0.00 0.00 57.00 57.88 3hb9 n GLN 870 Cb 0.92 -1.82 0.38 0.00 0.00 0.00 0.00 30.24 29.72 3hb9 n GLN 870 CO 0.00 0.00 0.00 2.48 0.00 0.00 0.00 177.06 179.54 3hb9 n TYR 871 N -2.05 0.00 -0.12 3.69 0.18 -1.26 -2.90 117.16 114.71 3hb9 n TYR 871 Ca -0.00 0.00 -0.24 0.00 1.88 0.00 0.00 57.90 59.54 3hb9 n TYR 871 Cb 0.08 -0.03 -0.11 0.00 -0.38 0.00 0.00 39.34 38.90 3hb9 n TYR 871 CO 0.00 0.00 0.00 0.43 -2.08 0.00 0.00 176.86 175.21 3hb9 n SER 872 N 0.11 1.89 -0.21 9.48 7.64 0.80 -3.66 113.62 129.67 3hb9 n SER 872 Ca 0.16 0.40 0.01 0.00 1.01 0.00 0.00 58.87 60.44 3hb9 n SER 872 Cb 0.40 -0.92 0.12 0.00 -1.01 0.00 0.00 64.21 62.80 3hb9 n SER 872 CO 0.00 0.00 0.00 0.78 -3.01 0.00 0.00 175.04 172.81 3hb9 h ASN 873 N -1.00 0.23 -0.01 6.43 2.35 -1.62 0.16 115.58 122.12 3hb9 h ASN 873 Ca -0.46 0.08 -0.09 0.00 -0.55 0.00 0.00 56.30 55.28 3hb9 h ASN 873 Cb 1.40 0.07 -0.01 0.00 0.05 0.00 0.00 38.32 39.82 3hb9 h ASN 873 CO -0.28 0.13 -0.24 0.25 -1.65 0.00 0.00 177.43 175.63 3hb9 h LEU 874 N 0.41 0.42 -0.42 1.61 5.85 -1.74 0.84 115.31 122.28 3hb9 h LEU 874 Ca 0.32 -0.14 -0.18 0.00 0.84 0.00 0.00 57.88 58.73 3hb9 h LEU 874 Cb 0.42 -0.11 -0.01 0.00 0.37 0.00 0.00 40.66 41.33 3hb9 h LEU 874 CO -0.32 0.67 -0.74 -1.28 -0.34 0.00 0.00 178.44 176.42 3hb9 h SER 875 N 0.37 0.41 -0.47 1.25 0.87 -1.38 0.26 113.55 114.86 3hb9 h SER 875 Ca 0.06 -0.28 -0.10 0.00 -1.23 0.00 0.00 61.79 60.24 3hb9 h SER 875 Cb 0.63 -0.12 -0.02 0.00 -0.44 0.00 0.00 62.40 62.46 3hb9 h SER 875 CO 0.05 1.01 -0.09 1.56 -0.53 0.00 0.00 176.83 178.82 3hb9 h GLN 876 N 0.23 0.90 -0.10 2.24 4.20 -0.35 -2.46 115.11 119.77 3hb9 h GLN 876 Ca -0.03 -0.34 -0.18 0.00 0.06 0.00 0.00 58.65 58.17 3hb9 h GLN 876 Cb 1.31 -0.06 -0.00 0.00 0.30 0.00 0.00 27.48 29.03 3hb9 h GLN 876 CO 0.12 0.98 -0.68 0.37 -0.67 0.00 0.00 178.83 178.95 3hb9 h GLN 877 N 0.75 0.44 -0.36 1.46 4.15 -0.75 -2.16 115.11 118.64 3hb9 h GLN 877 Ca 0.12 -0.34 -0.12 0.00 0.77 0.00 0.00 58.65 59.08 3hb9 h GLN 877 Cb 0.64 0.06 -0.01 0.00 0.21 0.00 0.00 27.48 28.38 3hb9 h GLN 877 CO 0.04 0.96 -0.27 0.00 -1.93 0.00 0.00 178.83 177.64 3hb9 h ALA 878 N 0.95 0.85 -0.48 3.38 0.00 -0.96 -2.29 119.26 120.71 3hb9 h ALA 878 Ca -0.02 -0.39 -0.05 0.00 0.00 0.00 0.00 54.91 54.45 3hb9 h ALA 878 Cb 1.25 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.88 3hb9 h ALA 878 CO 0.12 0.63 0.10 0.87 0.00 0.00 0.00 179.25 180.97 3hb9 h LYS 879 N 0.64 0.79 0.00 0.00 1.57 -1.39 0.43 116.57 118.61 3hb9 h LYS 879 Ca 0.08 -0.20 0.00 0.00 -1.87 0.00 0.00 60.65 58.66 3hb9 h LYS 879 Cb 0.78 -0.10 0.00 0.00 0.08 0.00 0.00 32.23 33.00 3hb9 h LYS 879 CO 0.06 0.78 0.00 0.45 -0.57 0.00 0.00 179.45 180.18 3hb9 n SER 880 N -4.45 0.37 -0.58 0.86 2.88 -0.82 -1.36 113.62 110.52 3hb9 n SER 880 Ca 0.01 0.63 0.06 0.00 -1.33 0.00 0.00 58.87 58.24 3hb9 n SER 880 Cb 0.24 -0.70 0.12 0.00 -0.75 0.00 0.00 64.21 63.12 3hb9 n SER 880 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 3hb9 n LEU 881 N -1.96 2.60 -0.91 2.46 4.77 -0.88 -4.99 117.00 118.09 3hb9 n LEU 881 Ca 0.01 -1.67 -0.10 0.00 -0.03 0.00 0.00 56.01 54.22 3hb9 n LEU 881 Cb 0.11 -0.16 -0.02 0.00 -2.33 0.00 0.00 43.42 41.02 3hb9 n LEU 881 CO 0.11 0.61 -0.11 0.61 -1.33 0.00 0.00 177.39 177.28 3hb9 n GLY 882 N 0.56 0.55 1.42 -0.72 0.00 -0.47 -4.91 105.19 101.61 3hb9 n GLY 882 Ca 0.10 -0.54 -0.06 0.00 0.00 0.00 0.00 46.02 45.51 3hb9 n GLY 882 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3hb9 n LEU 883 N -1.23 4.81 0.20 0.99 4.77 0.15 -4.71 117.00 121.97 3hb9 n LEU 883 Ca -0.10 -3.58 0.04 0.00 -0.03 0.00 0.00 56.01 52.34 3hb9 n LEU 883 Cb 0.45 -0.67 0.41 0.00 -2.33 0.00 0.00 43.42 41.28 3hb9 n LEU 883 CO 0.14 1.09 0.76 1.23 -1.33 0.00 0.00 177.39 179.28 3hb9 h GLY 884 N 1.28 0.00 0.55 -0.72 0.00 -1.83 -2.34 103.07 100.01 3hb9 h GLY 884 Ca 0.28 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.61 3hb9 h GLY 884 CO 0.54 0.00 -0.28 1.18 0.00 0.00 0.00 176.54 177.98 3hb9 n GLU 885 N -4.02 0.61 -0.56 4.80 4.71 -1.26 -4.12 120.64 120.80 3hb9 n GLU 885 Ca -0.02 -0.33 0.05 0.00 -0.01 0.00 0.00 57.16 56.85 3hb9 n GLU 885 Cb 0.38 -1.49 0.20 0.00 -1.01 0.00 0.00 31.44 29.52 3hb9 n GLU 885 CO 0.00 0.00 0.00 0.54 0.09 0.00 0.00 177.13 177.76 3hb9 n ARG 886 N -0.90 1.59 0.24 3.49 1.74 -0.89 -4.75 116.66 117.17 3hb9 n ARG 886 Ca 0.11 -3.21 0.12 0.00 -0.77 0.00 0.00 57.85 54.10 3hb9 n ARG 886 Cb 0.33 -1.63 0.52 0.00 -1.02 0.00 0.00 32.46 30.67 3hb9 n ARG 886 CO 0.00 0.00 0.00 0.35 -1.52 0.00 0.00 177.63 176.46 3hb9 h PHE 887 N 0.89 0.00 -0.02 -1.55 3.57 -1.68 -1.89 116.94 116.27 3hb9 h PHE 887 Ca 0.02 0.00 -0.06 0.00 3.53 0.00 0.00 57.97 61.47 3hb9 h PHE 887 Cb 1.07 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 39.81 3hb9 h PHE 887 CO 0.70 0.16 -0.25 0.38 -2.23 0.00 0.00 178.31 177.07 3hb9 h ASP 888 N 0.00 0.03 0.81 0.41 2.03 -1.91 -1.62 116.42 116.17 3hb9 h ASP 888 Ca -0.00 -0.01 -0.13 0.00 -0.73 0.00 0.00 57.03 56.16 3hb9 h ASP 888 Cb 0.67 -0.01 -0.02 0.00 -0.83 0.00 0.00 39.33 39.15 3hb9 h ASP 888 CO 0.02 0.29 -0.62 -0.33 -1.03 0.00 0.00 179.24 177.57 3hb9 h GLU 889 N 0.03 0.00 0.06 4.15 5.08 -1.72 -2.86 114.58 119.32 3hb9 h GLU 889 Ca 0.00 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3hb9 h GLU 889 Cb 0.47 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.72 3hb9 h GLU 889 CO 0.03 0.62 -0.03 0.28 -1.00 0.00 0.00 179.01 178.92 3hb9 h VAL 890 N 0.00 1.27 -0.78 3.13 2.07 -1.20 -1.19 116.25 119.55 3hb9 h VAL 890 Ca -0.01 -1.25 0.15 0.00 0.82 0.00 0.00 66.70 66.42 3hb9 h VAL 890 Cb 1.19 2.08 -0.05 0.00 -1.52 0.00 0.00 31.29 32.99 3hb9 h VAL 890 CO 0.08 0.31 0.52 0.11 0.02 0.00 0.00 177.57 178.61 3hb9 h LYS 891 N -0.65 0.42 -0.01 1.57 1.57 -1.41 0.55 116.57 118.62 3hb9 h LYS 891 Ca -0.01 -0.03 -0.00 0.00 -1.87 0.00 0.00 60.65 58.74 3hb9 h LYS 891 Cb 0.56 -0.10 -0.00 0.00 0.08 0.00 0.00 32.23 32.77 3hb9 h LYS 891 CO 0.01 0.28 -0.01 0.22 -0.57 0.00 0.00 179.45 179.38 3hb9 h ASP 892 N 0.44 0.02 -0.81 0.86 3.58 -1.46 -3.15 116.42 115.89 3hb9 h ASP 892 Ca 0.39 -0.50 -0.02 0.00 0.42 0.00 0.00 57.03 57.31 3hb9 h ASP 892 Cb 0.88 -0.01 -0.04 0.00 1.72 0.00 0.00 39.33 41.88 3hb9 h ASP 892 CO -0.13 0.52 0.43 -0.03 -2.88 0.00 0.00 179.24 177.15 3hb9 h MET 893 N -0.48 1.15 -0.27 0.28 4.05 -0.49 -2.32 114.93 116.86 3hb9 h MET 893 Ca 0.00 -0.14 0.06 0.00 -0.28 0.00 0.00 59.70 59.34 3hb9 h MET 893 Cb 0.51 -0.22 -0.07 0.00 -0.80 0.00 0.00 31.60 31.03 3hb9 h MET 893 CO 0.00 0.86 -0.19 -0.92 0.23 0.00 0.00 176.91 176.90 3hb9 h TYR 894 N 1.15 -0.48 -0.81 1.39 3.20 -0.98 0.60 116.97 121.05 3hb9 h TYR 894 Ca 0.29 0.03 0.04 0.00 3.14 0.00 0.00 58.73 62.24 3hb9 h TYR 894 Cb 0.06 0.25 -0.05 0.00 1.54 0.00 0.00 36.73 38.54 3hb9 h TYR 894 CO 0.01 -0.26 0.53 -0.09 -1.64 0.00 0.00 178.16 176.71 3hb9 h ARG 895 N -0.17 0.93 0.04 1.82 2.43 -1.41 -1.90 114.38 116.12 3hb9 h ARG 895 Ca 0.15 -0.06 -0.26 0.00 -0.81 0.00 0.00 59.98 59.00 3hb9 h ARG 895 Cb 0.39 -0.21 0.01 0.00 -0.42 0.00 0.00 29.97 29.75 3hb9 h ARG 895 CO -0.37 0.62 -1.08 0.00 -1.51 0.00 0.00 179.97 177.63 3hb9 h ARG 896 N 0.96 0.54 -0.49 0.20 3.08 -0.76 -3.19 114.38 114.71 3hb9 h ARG 896 Ca 0.33 -0.63 -0.03 0.00 0.07 0.00 0.00 59.98 59.71 3hb9 h ARG 896 Cb 0.10 0.19 -0.02 0.00 0.08 0.00 0.00 29.97 30.32 3hb9 h ARG 896 CO -0.10 1.25 0.18 0.28 -1.07 0.00 0.00 179.97 180.51 3hb9 h VAL 897 N 0.28 1.19 -0.41 2.04 2.07 0.56 0.13 116.25 122.10 3hb9 h VAL 897 Ca -0.13 -0.60 0.03 0.00 0.82 0.00 0.00 66.70 66.82 3hb9 h VAL 897 Cb 1.73 0.62 -0.03 0.00 -1.52 0.00 0.00 31.29 32.09 3hb9 h VAL 897 CO 0.20 0.23 0.22 -1.13 0.02 0.00 0.00 177.57 177.11 3hb9 h ASN 898 N 0.70 0.33 0.77 0.57 -0.73 -1.38 -1.44 115.58 114.41 3hb9 h ASN 898 Ca 0.17 0.01 -0.15 0.00 1.87 0.00 0.00 56.30 58.20 3hb9 h ASN 898 Cb 0.16 -0.05 -0.02 0.00 0.27 0.00 0.00 38.32 38.68 3hb9 h ASN 898 CO -0.01 0.24 -0.71 -0.26 -0.37 0.00 0.00 177.43 176.31 3hb9 h PHE 899 N 0.44 0.00 -0.21 0.67 0.05 -1.41 0.80 116.94 117.29 3hb9 h PHE 899 Ca 0.17 0.00 -0.02 0.00 3.82 0.00 0.00 57.97 61.94 3hb9 h PHE 899 Cb 0.06 0.00 -0.01 0.00 2.00 0.00 0.00 35.95 37.99 3hb9 h PHE 899 CO -0.09 0.71 0.03 1.25 -0.18 0.00 0.00 178.31 180.04 3hb9 h LEU 900 N 0.00 0.27 -1.64 1.54 5.85 -0.49 -2.30 115.31 118.54 3hb9 h LEU 900 Ca -0.01 -0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.69 3hb9 h LEU 900 Cb 1.29 -0.07 0.00 0.00 0.37 0.00 0.00 40.66 42.25 3hb9 h LEU 900 CO 0.09 0.29 0.00 0.49 -0.34 0.00 0.00 178.44 178.97 3hb9 n PHE 901 N -4.40 0.44 -0.82 1.25 3.01 -0.57 -4.91 117.46 111.47 3hb9 n PHE 901 Ca 0.00 -0.22 0.00 0.00 1.01 0.00 0.00 57.45 58.24 3hb9 n PHE 901 Cb 0.16 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.63 3hb9 n PHE 901 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3hb9 n GLY 902 N 1.27 1.08 2.73 1.37 0.00 -0.86 -4.68 105.19 106.10 3hb9 n GLY 902 Ca 0.17 -0.45 -0.01 0.00 0.00 0.00 0.00 46.02 45.73 3hb9 n GLY 902 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 3hb9 n ASP 903 N 0.95 -6.81 -4.55 1.61 4.64 0.25 -4.71 116.55 107.93 3hb9 n ASP 903 Ca 0.00 1.37 -0.25 0.00 -1.38 0.00 0.00 54.79 54.54 3hb9 n ASP 903 Cb 0.17 -5.11 -0.10 0.00 -1.04 0.00 0.00 41.12 35.05 3hb9 n ASP 903 CO 0.00 0.00 0.00 0.27 -0.82 0.00 0.00 177.20 176.65 3hb9 s ILE 904 N -1.44 2.52 -0.03 5.18 -4.36 -1.25 -4.87 121.20 116.94 3hb9 s ILE 904 Ca -0.04 -2.19 -0.30 0.00 -0.26 0.00 0.00 60.65 57.85 3hb9 s ILE 904 Cb 0.00 -2.59 -0.04 0.00 1.25 0.00 0.00 42.46 41.08 3hb9 s ILE 904 CO 0.74 -0.28 1.31 -0.69 0.24 0.00 0.00 174.94 176.25 3hb9 s VAL 905 N -2.53 3.99 -0.64 8.37 1.01 -1.26 -5.00 120.40 124.33 3hb9 s VAL 905 Ca 0.32 1.33 -0.05 0.00 0.00 0.00 0.00 61.98 63.58 3hb9 s VAL 905 Cb -0.01 -3.86 0.17 0.00 0.00 0.00 0.00 36.38 32.67 3hb9 s VAL 905 CO 0.17 -0.01 0.48 -0.54 0.00 0.00 0.00 175.10 175.20 3hb9 s LYS 906 N 2.38 2.71 0.30 2.72 1.02 -1.26 -4.61 119.74 123.00 3hb9 s LYS 906 Ca 0.60 -2.44 0.03 0.00 0.02 0.00 0.00 55.97 54.18 3hb9 s LYS 906 Cb -0.28 -3.86 -0.06 0.00 -0.52 0.00 0.00 37.83 33.12 3hb9 s LYS 906 CO 0.24 -1.19 0.06 0.08 -0.92 0.00 0.00 175.35 173.62 3hb9 s VAL 907 N 0.12 1.01 0.01 3.17 1.01 -1.26 -4.54 120.40 119.91 3hb9 s VAL 907 Ca 0.16 -2.01 -0.37 0.00 0.00 0.00 0.00 61.98 59.76 3hb9 s VAL 907 Cb -0.19 -2.70 -0.16 0.00 0.00 0.00 0.00 36.38 33.33 3hb9 s VAL 907 CO -0.04 -0.04 1.44 0.41 0.00 0.00 0.00 175.10 176.86 3hb9 n THR 908 N -0.59 0.07 -0.74 3.92 -1.04 -1.26 0.10 114.28 114.74 3hb9 n THR 908 Ca -0.02 -0.01 0.08 0.00 -2.04 0.00 0.00 64.05 62.06 3hb9 n THR 908 Cb 0.66 -0.93 0.32 0.00 -1.82 0.00 0.00 70.33 68.56 3hb9 n THR 908 CO 0.00 0.00 0.00 -0.81 -0.64 0.00 0.00 175.07 173.62 3hb9 n PRO 909 N 3.19 3.67 0.15 -2.82 -0.04 -1.26 -4.71 135.00 133.17 3hb9 n PRO 909 Ca 0.20 -2.84 0.01 0.00 -0.04 0.00 0.00 63.50 60.84 3hb9 n PRO 909 Cb 0.18 -1.89 0.22 0.00 -0.04 0.00 0.00 33.50 31.97 3hb9 n PRO 909 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 3hb9 h SER 910 N 3.14 0.00 0.29 3.54 4.64 0.36 -2.95 113.55 122.57 3hb9 h SER 910 Ca 0.00 0.00 -0.12 0.00 -0.47 0.00 0.00 61.79 61.20 3hb9 h SER 910 Cb 1.48 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.56 3hb9 h SER 910 CO 0.26 0.54 -0.47 0.77 -0.87 0.00 0.00 176.83 177.06 3hb9 h SER 911 N 0.00 0.23 -0.62 4.97 4.64 -1.62 -1.89 113.55 119.26 3hb9 h SER 911 Ca -0.01 -0.11 -0.03 0.00 -0.47 0.00 0.00 61.79 61.18 3hb9 h SER 911 Cb 1.04 -0.06 -0.03 0.00 -0.31 0.00 0.00 62.40 63.04 3hb9 h SER 911 CO 0.07 0.67 0.26 0.50 -0.87 0.00 0.00 176.83 177.45 3hb9 h LYS 912 N 0.17 0.92 0.22 4.77 3.64 -1.79 0.99 116.57 125.48 3hb9 h LYS 912 Ca 0.01 -0.16 -0.01 0.00 -1.27 0.00 0.00 60.65 59.22 3hb9 h LYS 912 Cb 0.90 -0.15 -0.01 0.00 -0.41 0.00 0.00 32.23 32.56 3hb9 h LYS 912 CO 0.07 0.77 -0.14 0.28 -2.27 0.00 0.00 179.45 178.15 3hb9 h VAL 913 N 0.86 0.69 -0.93 2.00 2.07 -1.33 0.31 116.25 119.92 3hb9 h VAL 913 Ca 0.21 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.73 3hb9 h VAL 913 Cb 0.19 0.69 -0.05 0.00 -1.52 0.00 0.00 31.29 30.60 3hb9 h VAL 913 CO -0.02 0.00 0.58 0.58 0.02 0.00 0.00 177.57 178.73 3hb9 h VAL 914 N -0.36 1.25 0.14 2.57 2.07 -1.30 -2.00 116.25 118.62 3hb9 h VAL 914 Ca -0.02 -0.51 -0.01 0.00 0.82 0.00 0.00 66.70 66.98 3hb9 h VAL 914 Cb 0.31 -0.08 0.00 0.00 -1.52 0.00 0.00 31.29 30.00 3hb9 h VAL 914 CO 0.01 0.25 -0.07 1.23 0.02 0.00 0.00 177.57 179.02 3hb9 h GLY 915 N 1.28 -0.20 1.01 2.17 0.00 -0.37 -2.07 103.07 104.89 3hb9 h GLY 915 Ca 0.34 0.07 -0.02 0.00 0.00 0.00 0.00 47.33 47.72 3hb9 h GLY 915 CO -0.07 -0.07 0.37 -0.55 0.00 0.00 0.00 176.54 176.22 3hb9 h ASP 916 N -0.27 0.94 -0.48 0.19 3.45 -0.22 -1.52 116.42 118.51 3hb9 h ASP 916 Ca -0.02 -0.12 -0.10 0.00 0.43 0.00 0.00 57.03 57.22 3hb9 h ASP 916 Cb 0.21 -0.24 -0.02 0.00 -0.56 0.00 0.00 39.33 38.72 3hb9 h ASP 916 CO 0.03 0.79 -0.06 0.24 -1.57 0.00 0.00 179.24 178.67 3hb9 h MET 917 N 1.02 0.94 -0.73 3.56 2.86 -1.38 -0.56 114.93 120.63 3hb9 h MET 917 Ca 0.25 -0.31 -0.05 0.00 -2.06 0.00 0.00 59.70 57.54 3hb9 h MET 917 Cb 0.08 -0.08 -0.03 0.00 0.06 0.00 0.00 31.60 31.63 3hb9 h MET 917 CO -0.04 0.97 0.28 0.00 1.06 0.00 0.00 176.91 179.18 3hb9 h ALA 918 N 1.07 1.11 -0.04 6.32 0.00 -0.98 0.32 119.26 127.06 3hb9 h ALA 918 Ca 0.15 -0.19 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 3hb9 h ALA 918 Cb 0.59 -0.29 -0.00 0.00 0.00 0.00 0.00 17.79 18.09 3hb9 h ALA 918 CO 0.04 0.63 -0.01 -0.07 0.00 0.00 0.00 179.25 179.84 3hb9 h LEU 919 N 1.07 0.07 -1.11 0.00 4.07 -1.12 -2.49 115.31 115.81 3hb9 h LEU 919 Ca 0.24 -0.36 -0.02 0.00 0.08 0.00 0.00 57.88 57.83 3hb9 h LEU 919 Cb 0.22 -0.02 -0.03 0.00 1.08 0.00 0.00 40.66 41.91 3hb9 h LEU 919 CO -0.02 0.41 0.35 0.22 -1.08 0.00 0.00 178.44 178.32 3hb9 h TYR 920 N -0.28 0.97 -0.03 1.13 3.20 -0.89 -0.50 116.97 120.57 3hb9 h TYR 920 Ca 0.01 -0.03 -0.18 0.00 3.14 0.00 0.00 58.73 61.67 3hb9 h TYR 920 Cb 0.38 -0.31 -0.01 0.00 1.54 0.00 0.00 36.73 38.33 3hb9 h TYR 920 CO 0.05 0.69 -0.78 1.98 -1.64 0.00 0.00 178.16 178.46 3hb9 h MET 921 N 0.98 0.25 0.05 1.82 4.05 -0.38 -1.77 114.93 119.93 3hb9 h MET 921 Ca 0.24 -0.23 -0.00 0.00 -0.28 0.00 0.00 59.70 59.43 3hb9 h MET 921 Cb 0.07 0.06 0.00 0.00 -0.80 0.00 0.00 31.60 30.92 3hb9 h MET 921 CO -0.04 0.91 -0.02 0.28 0.23 0.00 0.00 176.91 178.27 3hb9 h VAL 922 N 0.16 1.31 -0.92 -5.77 2.07 -1.29 0.25 116.25 112.06 3hb9 h VAL 922 Ca -0.03 -1.44 0.11 0.00 0.82 0.00 0.00 66.70 66.16 3hb9 h VAL 922 Cb 1.36 2.22 -0.08 0.00 -1.52 0.00 0.00 31.29 33.27 3hb9 h VAL 922 CO 0.12 0.35 0.55 -0.61 0.02 0.00 0.00 177.57 178.00 3hb9 h GLN 923 N -0.73 0.86 -0.52 1.57 4.15 -1.11 -1.80 115.11 117.53 3hb9 h GLN 923 Ca -0.01 -0.05 0.00 0.00 0.77 0.00 0.00 58.65 59.36 3hb9 h GLN 923 Cb 0.62 -0.19 0.00 0.00 0.21 0.00 0.00 27.48 28.12 3hb9 h GLN 923 CO 0.01 0.57 0.00 0.09 -1.93 0.00 0.00 178.83 177.57 3hb9 n ASN 924 N -4.69 3.65 -3.51 -0.69 4.13 -0.67 -5.00 115.26 108.48 3hb9 n ASN 924 Ca 0.17 -2.00 -0.25 0.00 1.68 0.00 0.00 54.58 54.18 3hb9 n ASN 924 Cb 0.33 -0.34 0.05 0.00 -1.54 0.00 0.00 39.78 38.28 3hb9 n ASN 924 CO 0.00 0.00 0.00 0.47 0.28 0.00 0.00 177.26 178.01 3hb9 n ASP 925 N 1.56 -5.65 -4.72 6.41 8.00 -0.68 -5.01 116.55 116.47 3hb9 n ASP 925 Ca 0.21 -0.89 -0.34 0.00 0.71 0.00 0.00 54.79 54.48 3hb9 n ASP 925 Cb 0.62 -4.13 -0.09 0.00 -0.02 0.00 0.00 41.12 37.50 3hb9 n ASP 925 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 3hb9 s LEU 926 N -6.06 3.70 0.00 0.64 2.01 0.82 -5.03 118.68 114.75 3hb9 s LEU 926 Ca 0.45 0.14 -0.01 0.00 0.01 0.00 0.00 54.13 54.72 3hb9 s LEU 926 Cb -0.12 -1.97 0.14 0.00 0.01 0.00 0.00 46.19 44.25 3hb9 s LEU 926 CO 0.81 0.34 0.97 0.47 1.01 0.00 0.00 176.35 179.95 3hb9 n ASP 927 N 1.78 1.20 0.25 2.29 9.92 -1.26 -4.78 116.55 125.95 3hb9 n ASP 927 Ca -0.17 -2.04 0.15 0.00 -0.53 0.00 0.00 54.79 52.20 3hb9 n ASP 927 Cb 0.53 -0.64 0.44 0.00 -0.64 0.00 0.00 41.12 40.81 3hb9 n ASP 927 CO 0.00 0.00 0.00 -0.33 0.13 0.00 0.00 177.20 177.00 3hb9 h GLU 928 N 0.00 0.00 0.07 -1.24 3.07 -2.00 -2.81 114.58 111.67 3hb9 h GLU 928 Ca -0.32 0.00 -0.33 0.00 -0.50 0.00 0.00 59.36 58.21 3hb9 h GLU 928 Cb 1.16 0.00 -0.03 0.00 -0.84 0.00 0.00 28.75 29.04 3hb9 h GLU 928 CO 0.33 0.00 -1.86 0.94 -1.40 0.00 0.00 179.01 177.02 3hb9 n GLN 929 N -3.08 0.70 -0.36 2.33 -0.06 -1.26 -4.30 117.38 111.35 3hb9 n GLN 929 Ca 0.02 0.28 -0.02 0.00 -2.00 0.00 0.00 57.00 55.28 3hb9 n GLN 929 Cb 0.41 -1.75 0.10 0.00 -4.06 0.00 0.00 30.24 24.94 3hb9 n GLN 929 CO 0.00 0.00 0.00 0.77 -0.20 0.00 0.00 177.06 177.63 3hb9 h SER 930 N 0.04 1.09 0.17 1.69 0.02 -1.92 -2.84 113.55 111.79 3hb9 h SER 930 Ca -0.36 -0.03 -0.01 0.00 -0.84 0.00 0.00 61.79 60.56 3hb9 h SER 930 Cb 2.03 -0.27 -0.00 0.00 0.14 0.00 0.00 62.40 64.30 3hb9 h SER 930 CO 0.08 0.78 -0.04 -0.37 -1.14 0.00 0.00 176.83 176.15 3hb9 h VAL 931 N 1.28 0.39 0.03 2.27 -1.51 -1.68 -3.09 116.25 113.94 3hb9 h VAL 931 Ca 0.35 -0.19 -0.38 0.00 -1.23 0.00 0.00 66.70 65.25 3hb9 h VAL 931 Cb -0.14 1.13 -0.05 0.00 -2.13 0.00 0.00 31.29 30.10 3hb9 h VAL 931 CO -0.08 0.04 -2.30 2.30 -1.23 0.00 0.00 177.57 176.29 3hb9 n ILE 932 N -3.56 1.58 0.43 7.19 -5.35 -1.14 -3.72 119.36 114.79 3hb9 n ILE 932 Ca -0.02 -0.55 -0.19 0.00 -0.27 0.00 0.00 62.75 61.71 3hb9 n ILE 932 Cb 0.14 -1.58 -0.09 0.00 -1.74 0.00 0.00 39.64 36.37 3hb9 n ILE 932 CO 0.00 0.00 0.00 0.74 -1.76 0.00 0.00 176.55 175.53 3hb9 h THR 933 N -0.11 0.13 -1.25 7.28 2.02 -1.42 -2.82 112.91 116.74 3hb9 h THR 933 Ca -0.54 0.00 -0.66 0.00 0.77 0.00 0.00 66.41 65.98 3hb9 h THR 933 Cb 1.89 0.13 -0.34 0.00 -1.74 0.00 0.00 68.15 68.09 3hb9 h THR 933 CO -0.08 0.00 0.27 -0.90 0.37 0.00 0.00 175.52 175.19 3hb9 n ASP 934 N -5.59 6.56 0.06 4.18 5.75 -1.20 -4.71 116.55 121.59 3hb9 n ASP 934 Ca -0.15 -3.78 0.13 0.00 -0.01 0.00 0.00 54.79 50.98 3hb9 n ASP 934 Cb 0.46 -0.77 0.34 0.00 -1.03 0.00 0.00 41.12 40.12 3hb9 n ASP 934 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3hb9 n GLY 935 N -0.72 -1.52 0.00 6.12 0.00 -1.06 -3.67 105.19 104.35 3hb9 n GLY 935 Ca 0.53 -0.15 0.15 0.00 0.00 0.00 0.00 46.02 46.54 3hb9 n GLY 935 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 3hb9 n TYR 936 N -1.99 0.00 -0.24 1.61 4.02 -1.26 -3.38 117.16 115.91 3hb9 n TYR 936 Ca 0.05 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.94 3hb9 n TYR 936 Cb 0.41 -0.23 0.01 0.00 -0.02 0.00 0.00 39.34 39.51 3hb9 n TYR 936 CO 0.00 0.00 0.00 0.36 -1.01 0.00 0.00 176.86 176.21 3hb9 n LYS 937 N -1.22 2.38 0.05 -0.72 2.85 -1.24 -4.83 118.16 115.43 3hb9 n LYS 937 Ca 0.16 -1.37 -0.22 0.00 -1.05 0.00 0.00 58.31 55.83 3hb9 n LYS 937 Cb 0.22 -0.93 -0.15 0.00 -0.65 0.00 0.00 35.03 33.52 3hb9 n LYS 937 CO 0.00 0.00 0.00 -0.07 -0.05 0.00 0.00 177.40 177.28 3hb9 h LEU 938 N 0.00 0.54 -2.25 -5.58 3.38 -1.69 -3.50 115.31 106.22 3hb9 h LEU 938 Ca 0.00 -0.89 0.00 0.00 0.09 0.00 0.00 57.88 57.08 3hb9 h LEU 938 Cb 0.62 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 41.19 3hb9 h LEU 938 CO 0.00 1.77 -0.72 -0.67 0.09 0.00 0.00 178.44 178.91 3hb9 n ASP 939 N -3.54 -7.68 -4.80 -0.43 4.64 -1.26 -5.01 116.55 98.46 3hb9 n ASP 939 Ca -0.26 0.96 -0.31 0.00 -1.38 0.00 0.00 54.79 53.81 3hb9 n ASP 939 Cb 1.07 -5.14 0.07 0.00 -1.04 0.00 0.00 41.12 36.08 3hb9 n ASP 939 CO 0.00 0.00 0.00 -0.36 -0.82 0.00 0.00 177.20 176.02 3hb9 s PHE 940 N -2.01 2.87 0.52 -0.67 0.40 -1.26 -5.00 117.98 112.83 3hb9 s PHE 940 Ca 0.11 1.39 -0.22 0.00 -0.60 0.00 0.00 56.93 57.61 3hb9 s PHE 940 Cb -0.03 -2.99 -0.06 0.00 0.51 0.00 0.00 43.02 40.46 3hb9 s PHE 940 CO 0.74 -1.56 1.34 -2.14 0.70 0.00 0.00 175.22 174.30 3hb9 s PRO 941 N -5.02 3.30 0.25 0.24 0.02 -1.26 -4.86 135.00 127.67 3hb9 s PRO 941 Ca 0.60 2.19 -0.03 0.00 0.02 0.00 0.00 61.00 63.78 3hb9 s PRO 941 Cb -0.15 -2.33 0.45 0.00 0.02 0.00 0.00 34.50 32.49 3hb9 s PRO 941 CO 0.55 -1.05 1.81 0.93 -0.33 0.00 0.00 177.00 178.91 3hb9 h GLU 942 N 1.65 0.78 -0.01 5.54 4.39 -2.00 -2.16 114.58 122.78 3hb9 h GLU 942 Ca -0.51 -0.05 -0.03 0.00 0.34 0.00 0.00 59.36 59.12 3hb9 h GLU 942 Cb 1.29 -0.18 -0.00 0.00 -0.10 0.00 0.00 28.75 29.76 3hb9 h GLU 942 CO 0.58 0.52 -0.14 0.66 -1.16 0.00 0.00 179.01 179.47 3hb9 h SER 943 N 0.80 0.01 0.64 1.42 4.64 -1.97 -1.46 113.55 117.63 3hb9 h SER 943 Ca 0.43 -0.00 -0.27 0.00 -0.47 0.00 0.00 61.79 61.48 3hb9 h SER 943 Cb 0.43 -0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.47 3hb9 h SER 943 CO -0.27 0.15 -1.49 1.62 -0.87 0.00 0.00 176.83 175.97 3hb9 h VAL 944 N 0.01 1.11 -0.30 0.95 3.04 -1.71 -1.94 116.25 117.42 3hb9 h VAL 944 Ca 0.00 -2.92 -0.14 0.00 -1.01 0.00 0.00 66.70 62.63 3hb9 h VAL 944 Cb 0.25 2.55 -0.01 0.00 -2.01 0.00 0.00 31.29 32.08 3hb9 h VAL 944 CO 0.02 0.64 -0.40 -0.37 -1.01 0.00 0.00 177.57 176.45 3hb9 h VAL 945 N 0.00 1.29 -0.47 1.51 -1.51 -1.32 -2.15 116.25 113.60 3hb9 h VAL 945 Ca -0.20 -1.57 -0.07 0.00 -1.23 0.00 0.00 66.70 63.63 3hb9 h VAL 945 Cb 1.94 1.49 -0.02 0.00 -2.13 0.00 0.00 31.29 32.57 3hb9 h VAL 945 CO 0.10 0.51 0.02 -1.28 -1.23 0.00 0.00 177.57 175.68 3hb9 h SER 946 N 0.58 0.74 -0.55 4.19 0.87 -1.32 -2.07 113.55 115.99 3hb9 h SER 946 Ca 0.05 -0.17 -0.09 0.00 -1.23 0.00 0.00 61.79 60.35 3hb9 h SER 946 Cb 0.94 -0.20 -0.02 0.00 -0.44 0.00 0.00 62.40 62.68 3hb9 h SER 946 CO 0.09 0.80 -0.02 0.15 -0.53 0.00 0.00 176.83 177.31 3hb9 h PHE 947 N 0.73 1.09 0.00 2.24 3.04 -1.23 -2.71 116.94 120.09 3hb9 h PHE 947 Ca 0.15 -0.20 0.00 0.00 3.98 0.00 0.00 57.97 61.90 3hb9 h PHE 947 Cb 0.42 -0.28 0.00 0.00 2.56 0.00 0.00 35.95 38.65 3hb9 h PHE 947 CO 0.02 0.99 0.00 1.19 -2.02 0.00 0.00 178.31 178.49 3hb9 n PHE 948 N -4.23 0.16 1.55 0.41 3.01 -0.82 -1.78 117.46 115.77 3hb9 n PHE 948 Ca 0.02 0.05 0.14 0.00 1.01 0.00 0.00 57.45 58.67 3hb9 n PHE 948 Cb 0.35 -0.58 0.66 0.00 -0.01 0.00 0.00 39.48 39.90 3hb9 n PHE 948 CO 0.00 0.00 0.00 1.63 1.01 0.00 0.00 176.76 179.40 3hb9 n LYS 949 N -1.63 0.97 -1.16 -1.08 5.02 -0.80 -4.80 118.16 114.68 3hb9 n LYS 949 Ca 0.06 -0.35 -0.06 0.00 -2.02 0.00 0.00 58.31 55.95 3hb9 n LYS 949 Cb 0.32 -1.49 -0.02 0.00 -0.02 0.00 0.00 35.03 33.81 3hb9 n LYS 949 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3hb9 n GLY 950 N 1.20 0.80 0.15 0.72 0.00 -0.73 -0.82 105.19 106.50 3hb9 n GLY 950 Ca 0.17 -0.53 0.13 0.00 0.00 0.00 0.00 46.02 45.79 3hb9 n GLY 950 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3hb9 h GLU 951 N 0.16 0.00 0.00 1.61 5.08 -1.68 -1.73 114.58 118.02 3hb9 h GLU 951 Ca -0.11 0.00 -0.11 0.00 -1.00 0.00 0.00 59.36 58.13 3hb9 h GLU 951 Cb 0.46 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.68 3hb9 h GLU 951 CO 0.17 0.00 -1.82 -0.89 -1.00 0.00 0.00 179.01 175.47 3hb9 n ILE 952 N -2.36 0.62 0.00 3.13 2.08 -1.26 -4.81 119.36 116.76 3hb9 n ILE 952 Ca 0.02 -0.62 0.00 0.00 0.56 0.00 0.00 62.75 62.71 3hb9 n ILE 952 Cb 0.24 -0.30 0.00 0.00 -0.75 0.00 0.00 39.64 38.84 3hb9 n ILE 952 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 3hb9 n GLY 953 N 1.38 0.92 3.67 7.39 0.00 -0.65 -4.88 105.19 113.01 3hb9 n GLY 953 Ca -0.11 -2.08 -0.36 0.00 0.00 0.00 0.00 46.02 43.48 3hb9 n GLY 953 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3hb9 s GLN 954 N -1.07 4.08 0.64 1.61 -1.52 -1.26 -4.56 119.66 117.57 3hb9 s GLN 954 Ca 0.00 -0.27 -0.16 0.00 -1.95 0.00 0.00 55.36 52.98 3hb9 s GLN 954 Cb 0.00 -3.49 -0.01 0.00 -0.22 0.00 0.00 33.01 29.29 3hb9 s GLN 954 CO 0.00 0.12 1.12 -2.14 -0.25 0.00 0.00 175.29 174.14 3hb9 s PRO 955 N 0.88 2.89 0.23 2.91 0.02 -1.26 -4.70 135.00 135.97 3hb9 s PRO 955 Ca 0.07 1.46 -0.12 0.00 0.02 0.00 0.00 61.00 62.43 3hb9 s PRO 955 Cb -0.13 -1.96 0.29 0.00 0.02 0.00 0.00 34.50 32.72 3hb9 s PRO 955 CO 0.03 -1.19 1.61 0.28 -0.33 0.00 0.00 177.00 177.39 3hb9 h VAL 956 N 0.28 0.27 -0.00 3.83 2.07 -1.91 0.13 116.25 120.92 3hb9 h VAL 956 Ca -0.48 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.04 3hb9 h VAL 956 Cb 1.25 0.27 0.00 0.00 -1.52 0.00 0.00 31.29 31.29 3hb9 h VAL 956 CO 0.54 0.00 -0.25 0.59 0.02 0.00 0.00 177.57 178.47 3hb9 n ASN 957 N -5.48 0.28 0.00 0.57 4.13 -1.26 -5.06 115.26 108.44 3hb9 n ASN 957 Ca 0.10 0.05 0.00 0.00 1.68 0.00 0.00 54.58 56.41 3hb9 n ASN 957 Cb 0.37 -0.10 0.00 0.00 -1.54 0.00 0.00 39.78 38.51 3hb9 n ASN 957 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 3hb9 n GLY 958 N 1.48 -0.29 3.47 7.41 0.00 0.44 -4.95 105.19 112.75 3hb9 n GLY 958 Ca 0.07 -1.38 -0.27 0.00 0.00 0.00 0.00 46.02 44.44 3hb9 n GLY 958 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3hb9 s PHE 959 N 0.00 2.41 -0.09 1.61 0.40 -1.26 -4.52 117.98 116.53 3hb9 s PHE 959 Ca 0.00 -0.31 -0.30 0.00 -0.60 0.00 0.00 56.93 55.72 3hb9 s PHE 959 Cb 0.00 -1.19 -0.03 0.00 0.51 0.00 0.00 43.02 42.30 3hb9 s PHE 959 CO 0.00 0.50 1.33 1.21 0.70 0.00 0.00 175.22 178.96 3hb9 s ASN 960 N -2.69 6.91 0.22 1.36 2.47 -1.26 -4.94 114.94 117.01 3hb9 s ASN 960 Ca 0.22 1.89 -0.08 0.00 0.42 0.00 0.00 52.86 55.31 3hb9 s ASN 960 Cb -0.08 -2.55 0.28 0.00 -1.45 0.00 0.00 41.25 37.45 3hb9 s ASN 960 CO 0.11 -0.73 1.82 0.11 -3.72 0.00 0.00 177.10 174.69 3hb9 h LYS 961 N 8.12 0.75 -0.08 0.43 1.57 -1.99 0.12 116.57 125.50 3hb9 h LYS 961 Ca -0.33 -0.05 -0.24 0.00 -1.87 0.00 0.00 60.65 58.16 3hb9 h LYS 961 Cb 1.14 -0.17 0.02 0.00 0.08 0.00 0.00 32.23 33.30 3hb9 h LYS 961 CO 0.93 0.50 -0.91 -0.44 -0.57 0.00 0.00 179.45 178.96 3hb9 h ASP 962 N 0.78 0.93 -0.14 0.86 3.32 -2.00 -2.53 116.42 117.65 3hb9 h ASP 962 Ca 0.33 -0.68 -0.12 0.00 0.02 0.00 0.00 57.03 56.58 3hb9 h ASP 962 Cb 0.20 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 39.46 3hb9 h ASP 962 CO -0.19 1.48 -0.30 0.25 -1.72 0.00 0.00 179.24 178.77 3hb9 h LEU 963 N 0.47 0.63 -0.29 1.55 5.85 -1.91 -2.82 115.31 118.79 3hb9 h LEU 963 Ca -0.09 -0.24 -0.02 0.00 0.84 0.00 0.00 57.88 58.37 3hb9 h LEU 963 Cb 1.55 -0.18 -0.01 0.00 0.37 0.00 0.00 40.66 42.39 3hb9 h LEU 963 CO 0.18 0.90 0.12 -0.61 -0.34 0.00 0.00 178.44 178.69 3hb9 h GLN 964 N 0.53 0.44 -0.17 1.25 4.15 -0.78 -2.93 115.11 117.60 3hb9 h GLN 964 Ca 0.07 -0.07 -0.06 0.00 0.77 0.00 0.00 58.65 59.35 3hb9 h GLN 964 Cb 0.78 -0.07 -0.01 0.00 0.21 0.00 0.00 27.48 28.38 3hb9 h GLN 964 CO 0.06 0.44 -0.16 0.00 -1.93 0.00 0.00 178.83 177.25 3hb9 h ALA 965 N 0.97 1.42 0.00 3.38 0.00 -1.35 -1.69 119.26 121.99 3hb9 h ALA 965 Ca 0.10 -0.24 -0.15 0.00 0.00 0.00 0.00 54.91 54.62 3hb9 h ALA 965 Cb 0.16 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 3hb9 h ALA 965 CO -0.01 0.41 -0.72 -0.39 0.00 0.00 0.00 179.25 178.54 3hb9 h VAL 966 N 0.26 1.24 0.17 0.00 -1.51 -1.49 -2.95 116.25 111.98 3hb9 h VAL 966 Ca 0.05 -2.75 -0.27 0.00 -1.23 0.00 0.00 66.70 62.50 3hb9 h VAL 966 Cb 0.44 2.61 0.02 0.00 -2.13 0.00 0.00 31.29 32.23 3hb9 h VAL 966 CO 0.03 0.71 -1.28 0.40 -1.23 0.00 0.00 177.57 176.20 3hb9 h ILE 967 N 0.00 1.25 -0.01 7.19 2.04 -1.30 -3.37 117.51 123.31 3hb9 h ILE 967 Ca -0.01 -2.54 -0.18 0.00 1.00 0.00 0.00 64.86 63.13 3hb9 h ILE 967 Cb 1.55 2.98 -0.01 0.00 -0.74 0.00 0.00 36.82 40.60 3hb9 h ILE 967 CO 0.09 0.76 -0.82 -0.07 0.00 0.00 0.00 178.15 178.12 3hb9 h LEU 968 N -0.15 0.22 -2.56 1.44 3.38 -1.44 -3.46 115.31 112.73 3hb9 h LEU 968 Ca -0.24 -0.17 -0.40 0.00 0.09 0.00 0.00 57.88 57.16 3hb9 h LEU 968 Cb 1.88 -0.07 0.09 0.00 0.09 0.00 0.00 40.66 42.65 3hb9 h LEU 968 CO 0.17 0.94 -0.89 0.29 0.09 0.00 0.00 178.44 179.04 3hb9 n LYS 969 N -3.69 -2.64 -2.79 1.13 5.02 -1.11 -3.50 118.16 110.58 3hb9 n LYS 969 Ca -0.03 0.58 -0.07 0.00 -2.02 0.00 0.00 58.31 56.77 3hb9 n LYS 969 Cb 0.77 -4.79 0.03 0.00 -0.02 0.00 0.00 35.03 31.01 3hb9 n LYS 969 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3hb9 n GLY 970 N -1.58 0.42 3.44 0.72 0.00 -1.26 -5.06 105.19 101.87 3hb9 n GLY 970 Ca -0.16 -0.36 -0.28 0.00 0.00 0.00 0.00 46.02 45.21 3hb9 n GLY 970 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3hb9 s GLN 971 N -5.26 1.58 -0.16 1.61 0.74 -1.23 -5.09 119.66 111.85 3hb9 s GLN 971 Ca 0.16 -1.34 -0.29 0.00 0.05 0.00 0.00 55.36 53.94 3hb9 s GLN 971 Cb -0.07 -1.97 -0.04 0.00 1.10 0.00 0.00 33.01 32.04 3hb9 s GLN 971 CO 0.24 0.45 1.65 -1.21 -0.55 0.00 0.00 175.29 175.86 3hb9 s GLU 972 N -2.27 3.92 -0.10 1.67 0.41 -1.26 -4.98 118.70 116.09 3hb9 s GLU 972 Ca 0.17 1.87 -0.21 0.00 -0.41 0.00 0.00 54.97 56.39 3hb9 s GLU 972 Cb -0.10 -4.03 -0.04 0.00 -1.78 0.00 0.00 34.13 28.19 3hb9 s GLU 972 CO 0.09 -1.15 0.60 0.00 -0.49 0.00 0.00 175.26 174.31 3hb9 s ALA 973 N 4.88 3.41 0.38 5.21 0.00 -1.26 -4.87 121.76 129.51 3hb9 s ALA 973 Ca 0.73 -0.03 -0.26 0.00 0.00 0.00 0.00 51.96 52.40 3hb9 s ALA 973 Cb -0.28 -2.83 -0.09 0.00 0.00 0.00 0.00 23.12 19.92 3hb9 s ALA 973 CO 0.29 -0.10 1.17 -0.51 0.00 0.00 0.00 175.76 176.61 3hb9 s LEU 974 N 0.83 4.25 -0.03 0.00 1.43 0.00 -5.00 118.68 120.16 3hb9 s LEU 974 Ca 0.32 2.36 -0.01 0.00 -1.03 0.00 0.00 54.13 55.77 3hb9 s LEU 974 Cb -0.16 -3.95 -0.01 0.00 0.03 0.00 0.00 46.19 42.10 3hb9 s LEU 974 CO 0.14 -0.59 0.11 0.74 0.23 0.00 0.00 176.35 176.98 3hb9 h THR 975 N 2.48 0.00 -3.67 5.49 2.02 -1.95 -3.44 112.91 113.83 3hb9 h THR 975 Ca -0.48 -0.32 0.00 0.00 0.77 0.00 0.00 66.41 66.37 3hb9 h THR 975 Cb 1.23 0.00 0.00 0.00 -1.74 0.00 0.00 68.15 67.64 3hb9 h THR 975 CO 0.63 0.00 0.00 0.00 0.37 0.00 0.00 175.52 176.52 3hb9 n ALA 976 N -2.27 0.00 -1.55 6.16 0.00 -1.26 -5.00 120.51 116.59 3hb9 n ALA 976 Ca -0.01 0.00 -0.59 0.00 0.00 0.00 0.00 53.44 52.84 3hb9 n ALA 976 Cb 0.02 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.39 3hb9 n ALA 976 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 3hb9 n ARG 977 N -0.64 0.19 -0.09 0.00 0.63 -1.26 -4.82 116.66 110.67 3hb9 n ARG 977 Ca 0.00 0.07 0.26 0.00 -0.92 0.00 0.00 57.85 57.26 3hb9 n ARG 977 Cb 0.00 -1.59 0.72 0.00 0.45 0.00 0.00 32.46 32.03 3hb9 n ARG 977 CO 0.00 0.00 0.00 -1.35 -2.51 0.00 0.00 177.63 173.77 3hb9 h PRO 978 N 3.62 0.00 0.02 -0.14 0.11 -1.87 -2.74 132.00 130.99 3hb9 h PRO 978 Ca -0.49 0.00 -0.22 0.00 0.11 0.00 0.00 66.00 65.40 3hb9 h PRO 978 Cb 1.41 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.51 3hb9 h PRO 978 CO 0.72 0.00 -0.95 0.78 -0.21 0.00 0.00 178.00 178.34 3hb9 h GLY 979 N 0.00 0.31 1.06 -0.55 0.00 -1.88 -3.32 103.07 98.69 3hb9 h GLY 979 Ca 0.35 -0.58 0.00 0.00 0.00 0.00 0.00 47.33 47.11 3hb9 h GLY 979 CO -0.00 0.51 0.00 -1.84 0.00 0.00 0.00 176.54 175.20 3hb9 n GLU 980 N -3.66 0.79 0.13 4.80 0.28 -1.03 -2.29 120.64 119.65 3hb9 n GLU 980 Ca -0.05 0.01 -0.24 0.00 -0.16 0.00 0.00 57.16 56.71 3hb9 n GLU 980 Cb 0.85 -1.50 -0.16 0.00 1.43 0.00 0.00 31.44 32.06 3hb9 n GLU 980 CO 0.00 0.00 0.00 1.88 -0.16 0.00 0.00 177.13 178.85 3hb9 h TYR 981 N 0.00 0.92 -4.13 -1.84 -1.99 -1.72 -3.48 116.97 104.73 3hb9 h TYR 981 Ca 0.00 -0.67 -0.48 0.00 2.00 0.00 0.00 58.73 59.58 3hb9 h TYR 981 Cb 0.03 -0.04 0.05 0.00 2.00 0.00 0.00 36.73 38.77 3hb9 h TYR 981 CO 0.00 1.60 0.39 -0.51 -0.00 0.00 0.00 178.16 179.63 3hb9 s LEU 982 N -7.52 3.67 0.26 3.88 1.02 -0.97 -5.04 118.68 113.98 3hb9 s LEU 982 Ca -0.11 1.89 -0.26 0.00 0.02 0.00 0.00 54.13 55.67 3hb9 s LEU 982 Cb 0.04 -4.55 -0.09 0.00 0.02 0.00 0.00 46.19 41.61 3hb9 s LEU 982 CO 0.92 -1.00 0.89 -1.61 0.02 0.00 0.00 176.35 175.57 3hb9 s GLU 983 N -3.65 4.61 0.28 1.70 0.41 -1.26 -4.84 118.70 115.95 3hb9 s GLU 983 Ca 0.66 1.28 -0.30 0.00 -0.41 0.00 0.00 54.97 56.20 3hb9 s GLU 983 Cb -0.17 -3.02 -0.13 0.00 -1.78 0.00 0.00 34.13 29.03 3hb9 s GLU 983 CO 0.29 0.41 1.29 -2.30 -0.49 0.00 0.00 175.26 174.46 3hb9 n PRO 984 N 1.00 1.91 -2.51 0.39 -0.02 -1.26 -4.73 135.00 129.79 3hb9 n PRO 984 Ca -0.01 0.68 -0.42 0.00 -2.02 0.00 0.00 63.50 61.73 3hb9 n PRO 984 Cb 0.49 -2.25 -0.03 0.00 -0.02 0.00 0.00 33.50 31.68 3hb9 n PRO 984 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 3hb9 s VAL 985 N -0.56 4.18 -0.84 -1.45 1.01 -1.26 -4.97 120.40 116.49 3hb9 s VAL 985 Ca 0.63 1.63 -0.25 0.00 0.00 0.00 0.00 61.98 63.99 3hb9 s VAL 985 Cb -0.64 -4.05 0.03 0.00 0.00 0.00 0.00 36.38 31.72 3hb9 s VAL 985 CO 0.56 0.17 1.40 -0.62 0.00 0.00 0.00 175.10 176.60 3hb9 s ASP 986 N 0.74 6.21 0.35 3.32 3.68 -1.26 -4.85 116.67 124.86 3hb9 s ASP 986 Ca 0.55 -0.79 0.12 0.00 2.13 0.00 0.00 52.55 54.55 3hb9 s ASP 986 Cb -0.28 -2.56 0.66 0.00 -1.45 0.00 0.00 42.92 39.29 3hb9 s ASP 986 CO 0.30 -1.77 1.80 -0.26 0.13 0.00 0.00 175.17 175.36 3hb9 h PHE 987 N 10.23 0.04 -0.39 -5.34 -1.00 -1.99 -2.45 116.94 116.04 3hb9 h PHE 987 Ca -0.09 -0.01 -0.10 0.00 2.81 0.00 0.00 57.97 60.59 3hb9 h PHE 987 Cb 1.04 -0.01 -0.02 0.00 3.61 0.00 0.00 35.95 40.57 3hb9 h PHE 987 CO 1.18 0.42 -0.15 0.93 -1.61 0.00 0.00 178.31 179.09 3hb9 h GLU 988 N 0.03 0.71 0.00 1.51 4.39 -1.99 0.20 114.58 119.44 3hb9 h GLU 988 Ca 0.00 -0.25 -0.12 0.00 0.34 0.00 0.00 59.36 59.33 3hb9 h GLU 988 Cb 0.71 -0.05 -0.02 0.00 -0.10 0.00 0.00 28.75 29.29 3hb9 h GLU 988 CO 0.05 0.83 -0.57 0.87 -1.16 0.00 0.00 179.01 179.03 3hb9 h LYS 989 N 0.64 0.00 -0.14 2.33 1.57 -1.92 -1.66 116.57 117.39 3hb9 h LYS 989 Ca 0.10 0.00 -0.21 0.00 -1.87 0.00 0.00 60.65 58.68 3hb9 h LYS 989 Cb 0.61 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.93 3hb9 h LYS 989 CO 0.04 0.57 -0.74 0.28 -0.57 0.00 0.00 179.45 179.04 3hb9 h VAL 990 N 0.00 1.31 -0.11 0.50 2.07 -1.09 -2.84 116.25 116.09 3hb9 h VAL 990 Ca -0.01 -1.99 0.04 0.00 0.82 0.00 0.00 66.70 65.56 3hb9 h VAL 990 Cb 1.05 1.98 -0.05 0.00 -1.52 0.00 0.00 31.29 32.75 3hb9 h VAL 990 CO 0.07 0.62 -0.19 -0.09 0.02 0.00 0.00 177.57 178.01 3hb9 h ARG 991 N 0.47 -0.24 -0.73 1.57 9.65 -0.49 -2.87 114.38 121.74 3hb9 h ARG 991 Ca -0.04 0.02 0.16 0.00 -1.10 0.00 0.00 59.98 59.02 3hb9 h ARG 991 Cb 1.35 0.05 -0.11 0.00 -1.39 0.00 0.00 29.97 29.87 3hb9 h ARG 991 CO 0.15 -0.16 0.15 0.93 2.80 0.00 0.00 179.97 183.84 3hb9 h GLU 992 N -0.25 0.23 0.03 0.20 5.08 -1.23 -1.89 114.58 116.75 3hb9 h GLU 992 Ca 0.09 -0.01 -0.00 0.00 -1.00 0.00 0.00 59.36 58.44 3hb9 h GLU 992 Cb 0.38 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.58 3hb9 h GLU 992 CO -0.26 0.15 -0.01 1.25 -1.00 0.00 0.00 179.01 179.14 3hb9 h LEU 993 N 0.24 -0.03 -0.63 1.33 5.85 -1.29 -2.01 115.31 118.77 3hb9 h LEU 993 Ca 0.41 -0.25 -0.10 0.00 0.84 0.00 0.00 57.88 58.78 3hb9 h LEU 993 Cb 0.71 0.01 -0.02 0.00 0.37 0.00 0.00 40.66 41.73 3hb9 h LEU 993 CO -0.53 0.24 -0.00 -0.07 -0.34 0.00 0.00 178.44 177.73 3hb9 h LEU 994 N -0.30 1.05 -0.75 2.25 3.38 -1.35 -0.40 115.31 119.20 3hb9 h LEU 994 Ca -0.00 -0.30 0.03 0.00 0.09 0.00 0.00 57.88 57.70 3hb9 h LEU 994 Cb 0.28 -0.28 -0.05 0.00 0.09 0.00 0.00 40.66 40.70 3hb9 h LEU 994 CO 0.01 1.10 0.47 -0.33 0.09 0.00 0.00 178.44 179.78 3hb9 h GLU 995 N 0.98 0.89 0.00 1.13 4.39 -1.34 0.93 114.58 121.56 3hb9 h GLU 995 Ca 0.17 -0.05 -0.08 0.00 0.34 0.00 0.00 59.36 59.74 3hb9 h GLU 995 Cb 0.56 -0.20 -0.01 0.00 -0.10 0.00 0.00 28.75 29.00 3hb9 h GLU 995 CO 0.03 0.59 -0.37 1.49 -1.16 0.00 0.00 179.01 179.58 3hb9 h GLU 996 N 0.91 0.00 0.00 2.33 4.22 -1.04 -3.33 114.58 117.67 3hb9 h GLU 996 Ca 0.30 0.00 -0.00 0.00 0.08 0.00 0.00 59.36 59.74 3hb9 h GLU 996 Cb 0.04 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.29 3hb9 h GLU 996 CO -0.12 0.37 -0.05 0.93 -2.18 0.00 0.00 179.01 177.97 3hb9 h GLU 997 N 0.00 0.00 -7.68 1.92 5.08 -0.65 -3.48 114.58 109.78 3hb9 h GLU 997 Ca -0.00 0.00 -0.43 0.00 -1.00 0.00 0.00 59.36 57.92 3hb9 h GLU 997 Cb 1.10 0.00 0.18 0.00 0.50 0.00 0.00 28.75 30.53 3hb9 h GLU 997 CO 0.05 0.22 0.32 -0.65 -1.00 0.00 0.00 179.01 177.94 3hb9 s GLN 998 N -1.73 -0.13 0.26 2.33 -0.21 0.28 -4.96 119.66 115.50 3hb9 s GLN 998 Ca -0.05 -0.32 -0.02 0.00 0.02 0.00 0.00 55.36 54.98 3hb9 s GLN 998 Cb -0.00 -1.75 0.44 0.00 1.00 0.00 0.00 33.01 32.70 3hb9 s GLN 998 CO 0.16 -2.94 1.83 -0.56 -2.12 0.00 0.00 175.29 171.66 3hb9 h GLN 999 N -2.02 0.91 0.00 2.91 -0.00 -1.86 -3.46 115.11 111.59 3hb9 h GLN 999 Ca -0.44 -0.05 0.00 0.00 -0.00 0.00 0.00 58.65 58.15 3hb9 h GLN 999 Cb 1.25 -0.21 0.00 0.00 -0.00 0.00 0.00 27.48 28.52 3hb9 h GLN 999 CO 0.35 0.60 0.00 0.41 -0.00 0.00 0.00 178.83 180.19 3hb9 n GLY 1000N -1.34 0.00 0.00 0.06 0.00 -1.26 -5.00 105.19 97.66 3hb9 n GLY 1000Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.17 3hb9 n GLY 1000CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3hb9 n PRO 1001N 0.00 0.00 -1.66 1.61 -0.05 -1.26 -5.03 135.00 128.62 3hb9 n PRO 1001Ca 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 63.50 63.45 3hb9 n PRO 1001Cb 0.00 -0.15 0.00 0.00 -0.05 0.00 0.00 33.50 33.30 3hb9 n PRO 1001CO 0.00 0.00 0.00 0.28 -0.05 0.00 0.00 175.50 175.73 3hb9 n VAL 1002N -1.15 -8.69 -2.61 0.52 0.31 -1.26 -5.00 118.33 100.46 3hb9 n VAL 1002Ca 0.00 1.90 -0.23 0.00 -0.01 0.00 0.00 64.34 66.00 3hb9 n VAL 1002Cb 0.00 -4.56 0.04 0.00 -0.91 0.00 0.00 33.84 28.40 3hb9 n VAL 1002CO 0.00 0.00 0.00 0.28 -1.32 0.00 0.00 176.83 175.79 3hb9 s THR 1003N -0.33 3.03 0.17 2.52 -1.32 -1.26 -4.99 115.64 113.46 3hb9 s THR 1003Ca 0.00 -0.47 -0.14 0.00 -1.21 0.00 0.00 61.69 59.87 3hb9 s THR 1003Cb 0.00 -3.17 0.07 0.00 -1.51 0.00 0.00 72.50 67.89 3hb9 s THR 1003CO 0.00 -0.14 1.83 -0.33 -2.21 0.00 0.00 174.62 173.77 3hb9 h GLU 1004N -0.01 0.71 0.00 7.08 4.39 -2.02 -2.41 114.58 122.32 3hb9 h GLU 1004Ca -0.44 -0.05 -0.01 0.00 0.34 0.00 0.00 59.36 59.21 3hb9 h GLU 1004Cb 1.28 -0.16 -0.00 0.00 -0.10 0.00 0.00 28.75 29.78 3hb9 h GLU 1004CO 0.56 0.48 -0.03 1.96 -1.16 0.00 0.00 179.01 180.83 3hb9 h GLN 1005N 0.72 0.00 -0.55 2.33 4.20 -1.98 -1.34 115.11 118.50 3hb9 h GLN 1005Ca 0.20 0.00 -0.04 0.00 0.06 0.00 0.00 58.65 58.86 3hb9 h GLN 1005Cb -0.07 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 27.69 3hb9 h GLN 1005CO -0.04 0.03 0.17 -0.44 -0.67 0.00 0.00 178.83 177.88 3hb9 h ASP 1006N 0.00 0.80 0.39 1.46 3.32 -1.82 -2.86 116.42 117.71 3hb9 h ASP 1006Ca -0.00 -0.21 -0.02 0.00 0.02 0.00 0.00 57.03 56.82 3hb9 h ASP 1006Cb 0.11 -0.21 0.00 0.00 0.22 0.00 0.00 39.33 39.45 3hb9 h ASP 1006CO 0.00 0.80 -0.19 0.40 -1.72 0.00 0.00 179.24 178.53 3hb9 h ILE 1007N 0.77 0.62 -0.15 0.35 2.04 -1.24 -2.31 117.51 117.59 3hb9 h ILE 1007Ca 0.18 -0.16 -0.05 0.00 1.00 0.00 0.00 64.86 65.83 3hb9 h ILE 1007Cb 0.28 0.71 -0.01 0.00 -0.74 0.00 0.00 36.82 37.06 3hb9 h ILE 1007CO -0.01 0.03 -0.15 0.16 0.00 0.00 0.00 178.15 178.19 3hb9 h ILE 1008N -0.61 1.19 -0.62 -0.67 -2.65 -1.66 -2.19 117.51 110.30 3hb9 h ILE 1008Ca -0.05 -0.83 -0.03 0.00 1.03 0.00 0.00 64.86 64.97 3hb9 h ILE 1008Cb 0.45 1.24 -0.03 0.00 -2.05 0.00 0.00 36.82 36.43 3hb9 h ILE 1008CO 0.09 0.26 0.26 0.28 0.03 0.00 0.00 178.15 179.06 3hb9 h SER 1009N 0.23 0.85 -0.18 2.16 0.02 -1.38 -0.78 113.55 114.47 3hb9 h SER 1009Ca 0.04 -0.16 -0.04 0.00 -0.84 0.00 0.00 61.79 60.79 3hb9 h SER 1009Cb 0.40 -0.22 -0.01 0.00 0.14 0.00 0.00 62.40 62.72 3hb9 h SER 1009CO 0.02 0.78 -0.04 0.22 -1.14 0.00 0.00 176.83 176.68 3hb9 h TYR 1010N 0.87 0.38 -0.17 3.45 3.20 -1.16 -0.82 116.97 122.72 3hb9 h TYR 1010Ca 0.21 -0.08 0.02 0.00 3.14 0.00 0.00 58.73 62.02 3hb9 h TYR 1010Cb 0.19 -0.09 -0.02 0.00 1.54 0.00 0.00 36.73 38.35 3hb9 h TYR 1010CO 0.01 0.59 0.04 0.28 -1.64 0.00 0.00 178.16 177.45 3hb9 h VAL 1011N 0.06 0.94 -0.42 1.81 2.07 -1.32 -1.20 116.25 118.18 3hb9 h VAL 1011Ca 0.05 -0.04 -0.08 0.00 0.82 0.00 0.00 66.70 67.45 3hb9 h VAL 1011Cb 0.47 0.81 -0.01 0.00 -1.52 0.00 0.00 31.29 31.03 3hb9 h VAL 1011CO 0.02 0.02 -0.03 -0.07 0.02 0.00 0.00 177.57 177.52 3hb9 h LEU 1012N 0.12 0.76 -6.56 2.57 3.38 -1.15 -3.39 115.31 111.05 3hb9 h LEU 1012Ca 0.08 -0.33 -0.59 0.00 0.09 0.00 0.00 57.88 57.13 3hb9 h LEU 1012Cb 0.06 -0.21 -0.39 0.00 0.09 0.00 0.00 40.66 40.22 3hb9 h LEU 1012CO -0.09 0.91 -0.88 -0.31 0.09 0.00 0.00 178.44 178.15 3hb9 s TYR 1013N -4.93 1.22 0.03 1.13 1.51 -0.32 -4.45 117.35 111.55 3hb9 s TYR 1013Ca -0.13 -2.16 -0.24 0.00 -1.01 0.00 0.00 57.07 53.54 3hb9 s TYR 1013Cb 0.10 -1.14 -0.13 0.00 -0.11 0.00 0.00 41.96 40.69 3hb9 s TYR 1013CO 0.81 -0.80 1.32 -1.35 -1.11 0.00 0.00 175.55 174.41 3hb9 h PRO 1014N 6.21 -0.82 -0.77 -1.71 0.11 -1.42 -1.25 132.00 132.35 3hb9 h PRO 1014Ca 0.16 0.06 0.01 0.00 0.11 0.00 0.00 66.00 66.33 3hb9 h PRO 1014Cb 0.92 0.19 -0.04 0.00 0.11 0.00 0.00 31.00 32.18 3hb9 h PRO 1014CO 0.37 -0.54 0.51 0.87 -0.21 0.00 0.00 178.00 178.99 3hb9 h LYS 1015N -0.87 1.01 -0.60 1.05 6.56 -1.96 -2.47 116.57 119.29 3hb9 h LYS 1015Ca -0.09 -0.06 -0.05 0.00 -1.06 0.00 0.00 60.65 59.39 3hb9 h LYS 1015Cb 0.65 -0.23 -0.03 0.00 -0.57 0.00 0.00 32.23 32.06 3hb9 h LYS 1015CO 0.14 0.67 0.18 0.28 -2.06 0.00 0.00 179.45 178.66 3hb9 h VAL 1016N 1.04 1.24 -0.28 0.50 2.07 -1.96 -1.86 116.25 116.99 3hb9 h VAL 1016Ca 0.28 -0.84 -0.04 0.00 0.82 0.00 0.00 66.70 66.92 3hb9 h VAL 1016Cb -0.12 0.66 -0.01 0.00 -1.52 0.00 0.00 31.29 30.30 3hb9 h VAL 1016CO -0.06 0.32 0.03 0.22 0.02 0.00 0.00 177.57 178.10 3hb9 h TYR 1017N 0.85 0.51 -0.40 1.57 3.20 -0.97 -1.00 116.97 120.72 3hb9 h TYR 1017Ca 0.19 -0.08 0.01 0.00 3.14 0.00 0.00 58.73 62.00 3hb9 h TYR 1017Cb 0.30 -0.14 -0.03 0.00 1.54 0.00 0.00 36.73 38.41 3hb9 h TYR 1017CO 0.02 0.59 0.24 0.93 -1.64 0.00 0.00 178.16 178.30 3hb9 h GLU 1018N 0.29 0.47 0.00 1.82 4.39 -1.37 0.76 114.58 120.93 3hb9 h GLU 1018Ca 0.08 -0.03 -0.04 0.00 0.34 0.00 0.00 59.36 59.72 3hb9 h GLU 1018Cb 0.37 -0.11 -0.01 0.00 -0.10 0.00 0.00 28.75 28.90 3hb9 h GLU 1018CO 0.01 0.31 -0.17 1.96 -1.16 0.00 0.00 179.01 179.96 3hb9 h GLN 1019N 0.49 0.00 -0.13 2.33 4.20 -1.23 0.13 115.11 120.89 3hb9 h GLN 1019Ca 0.16 0.00 -0.15 0.00 0.06 0.00 0.00 58.65 58.72 3hb9 h GLN 1019Cb -0.01 0.00 0.01 0.00 0.30 0.00 0.00 27.48 27.78 3hb9 h GLN 1019CO -0.07 0.17 -0.49 -0.92 -0.67 0.00 0.00 178.83 176.86 3hb9 h TYR 1020N 0.00 0.74 -0.24 2.96 3.20 -0.41 -2.09 116.97 121.12 3hb9 h TYR 1020Ca -0.00 -0.31 -0.03 0.00 3.14 0.00 0.00 58.73 61.53 3hb9 h TYR 1020Cb 0.44 -0.12 -0.01 0.00 1.54 0.00 0.00 36.73 38.57 3hb9 h TYR 1020CO 0.00 1.08 0.01 0.82 -1.64 0.00 0.00 178.16 178.44 3hb9 h ILE 1021N 0.18 1.15 -0.15 1.81 1.08 -0.04 0.19 117.51 121.73 3hb9 h ILE 1021Ca -0.02 -0.56 -0.03 0.00 -0.39 0.00 0.00 64.86 63.85 3hb9 h ILE 1021Cb 1.12 0.95 -0.00 0.00 -3.07 0.00 0.00 36.82 35.82 3hb9 h ILE 1021CO 0.10 0.19 -0.05 1.56 -0.69 0.00 0.00 178.15 179.27 3hb9 h GLN 1022N 0.35 0.29 -0.41 2.37 1.08 -0.78 -1.99 115.11 116.02 3hb9 h GLN 1022Ca 0.08 -0.12 -0.03 0.00 -1.45 0.00 0.00 58.65 57.14 3hb9 h GLN 1022Cb 0.22 -0.01 -0.02 0.00 -0.05 0.00 0.00 27.48 27.62 3hb9 h GLN 1022CO 0.00 0.59 0.15 1.15 -0.95 0.00 0.00 178.83 179.77 3hb9 h THR 1023N -0.03 1.20 -0.64 -0.54 2.02 -0.95 -2.39 112.91 111.59 3hb9 h THR 1023Ca 0.04 -0.65 0.08 0.00 0.77 0.00 0.00 66.41 66.65 3hb9 h THR 1023Cb 0.48 0.85 -0.06 0.00 -1.74 0.00 0.00 68.15 67.68 3hb9 h THR 1023CO 0.02 0.23 0.30 -0.09 0.37 0.00 0.00 175.52 176.35 3hb9 h ARG 1024N 0.52 0.52 0.00 6.66 2.43 -0.67 0.18 114.38 124.02 3hb9 h ARG 1024Ca 0.14 -0.03 -0.02 0.00 -0.81 0.00 0.00 59.98 59.26 3hb9 h ARG 1024Cb 0.21 -0.12 -0.00 0.00 -0.42 0.00 0.00 29.97 29.64 3hb9 h ARG 1024CO -0.01 0.34 -0.08 -0.91 -1.51 0.00 0.00 179.97 177.80 3hb9 h ASN 1025N 0.53 0.00 0.03 -3.80 -0.26 -1.01 0.54 115.58 111.61 3hb9 h ASN 1025Ca 0.31 0.00 -0.39 0.00 -0.56 0.00 0.00 56.30 55.66 3hb9 h ASN 1025Cb 0.31 0.00 -0.05 0.00 -1.06 0.00 0.00 38.32 37.51 3hb9 h ASN 1025CO -0.25 0.08 -2.31 1.67 -1.06 0.00 0.00 177.43 175.56 3hb9 n GLN 1026N -3.66 0.67 0.00 0.81 7.27 -0.59 -4.71 117.38 117.17 3hb9 n GLN 1026Ca -0.02 0.21 0.01 0.00 0.07 0.00 0.00 57.00 57.27 3hb9 n GLN 1026Cb 0.20 -1.58 0.00 0.00 2.41 0.00 0.00 30.24 31.27 3hb9 n GLN 1026CO 0.00 0.00 0.00 0.66 0.07 0.00 0.00 177.06 177.79 3hb9 n TYR 1027N -3.49 0.00 -4.27 3.69 0.53 0.53 -4.73 117.16 109.43 3hb9 n TYR 1027Ca -0.43 0.00 0.00 0.00 -1.02 0.00 0.00 57.90 56.45 3hb9 n TYR 1027Cb 0.98 0.00 0.00 0.00 -1.03 0.00 0.00 39.34 39.29 3hb9 n TYR 1027CO 0.00 0.00 0.00 0.41 -1.02 0.00 0.00 176.86 176.25 3hb9 n GLY 1028N 0.37 -0.63 3.55 2.72 0.00 0.18 -3.98 105.19 107.41 3hb9 n GLY 1028Ca 0.01 -1.13 -0.38 0.00 0.00 0.00 0.00 46.02 44.52 3hb9 n GLY 1028CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 3hb9 s ASN 1029N -4.00 5.88 0.35 1.61 3.04 -1.26 -4.50 114.94 116.06 3hb9 s ASN 1029Ca 0.00 -0.51 0.17 0.00 0.04 0.00 0.00 52.86 52.56 3hb9 s ASN 1029Cb 0.00 -2.55 0.61 0.00 -1.54 0.00 0.00 41.25 37.76 3hb9 s ASN 1029CO 0.00 -2.02 1.71 -0.07 -3.04 0.00 0.00 177.10 173.68 3hb9 h LEU 1030N 14.45 0.00 -1.41 3.21 3.38 -1.82 -3.25 115.31 129.87 3hb9 h LEU 1030Ca -0.12 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.85 3hb9 h LEU 1030Cb 1.06 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.81 3hb9 h LEU 1030CO 1.29 0.43 0.02 -1.54 0.09 0.00 0.00 178.44 178.73 3hb9 n SER 1031N -3.60 0.55 0.11 -0.43 3.41 -1.26 -2.06 113.62 110.35 3hb9 n SER 1031Ca -0.00 0.75 0.04 0.00 -0.26 0.00 0.00 58.87 59.39 3hb9 n SER 1031Cb 0.53 -0.81 0.01 0.00 -0.26 0.00 0.00 64.21 63.67 3hb9 n SER 1031CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 3hb9 h LEU 1032N 0.00 0.00-10.15 1.04 3.38 -1.92 -3.36 115.31 104.31 3hb9 h LEU 1032Ca 0.00 0.00 -0.52 0.00 0.09 0.00 0.00 57.88 57.45 3hb9 h LEU 1032Cb 0.04 0.00 0.12 0.00 0.09 0.00 0.00 40.66 40.91 3hb9 h LEU 1032CO 0.00 0.42 0.42 -0.76 0.09 0.00 0.00 178.44 178.61 3hb9 s LEU 1033N -6.13 3.50 0.44 1.67 1.43 -0.87 -4.57 118.68 114.15 3hb9 s LEU 1033Ca 0.02 2.26 -0.22 0.00 -1.03 0.00 0.00 54.13 55.15 3hb9 s LEU 1033Cb 0.08 -4.58 -0.08 0.00 0.03 0.00 0.00 46.19 41.63 3hb9 s LEU 1033CO 0.76 -1.76 1.07 1.51 0.23 0.00 0.00 176.35 178.16 3hb9 s ASP 1034N -1.99 6.48 0.17 2.29 -4.77 -1.26 -4.82 116.67 112.77 3hb9 s ASP 1034Ca 0.73 2.06 -0.20 0.00 -3.30 0.00 0.00 52.55 51.84 3hb9 s ASP 1034Cb -0.27 -2.58 0.09 0.00 -1.09 0.00 0.00 42.92 39.07 3hb9 s ASP 1034CO 0.38 -0.69 1.62 0.74 0.70 0.00 0.00 175.17 177.92 3hb9 h THR 1035N 1.90 0.33 -0.73 2.11 2.02 -1.96 0.79 112.91 117.38 3hb9 h THR 1035Ca -0.49 0.00 0.14 0.00 0.77 0.00 0.00 66.41 66.83 3hb9 h THR 1035Cb 1.22 0.33 -0.09 0.00 -1.74 0.00 0.00 68.15 67.87 3hb9 h THR 1035CO 0.61 0.00 0.27 -0.65 0.37 0.00 0.00 175.52 176.11 3hb9 h PRO 1036N -0.18 0.39 -0.20 6.66 0.11 -1.93 -0.65 132.00 136.20 3hb9 h PRO 1036Ca 0.19 -0.02 -0.16 0.00 0.11 0.00 0.00 66.00 66.12 3hb9 h PRO 1036Cb 0.48 -0.09 -0.01 0.00 0.11 0.00 0.00 31.00 31.50 3hb9 h PRO 1036CO -0.51 0.26 -0.53 1.15 -0.21 0.00 0.00 178.00 178.16 3hb9 h THR 1037N 0.40 1.31 -0.51 -1.15 2.02 -1.57 -0.93 112.91 112.50 3hb9 h THR 1037Ca 0.40 -1.77 0.02 0.00 0.77 0.00 0.00 66.41 65.83 3hb9 h THR 1037Cb 0.60 1.73 -0.03 0.00 -1.74 0.00 0.00 68.15 68.72 3hb9 h THR 1037CO -0.41 0.55 0.34 0.15 0.37 0.00 0.00 175.52 176.52 3hb9 h PHE 1038N 0.45 0.60 0.00 3.16 3.57 -0.04 -0.75 116.94 123.94 3hb9 h PHE 1038Ca 0.01 0.01 -0.23 0.00 3.53 0.00 0.00 57.97 61.30 3hb9 h PHE 1038Cb 1.08 -0.20 -0.04 0.00 2.79 0.00 0.00 35.95 39.57 3hb9 h PHE 1038CO 0.05 0.37 -1.96 1.19 -2.23 0.00 0.00 178.31 175.72 3hb9 n PHE 1039N -4.47 0.39 0.00 0.41 0.99 -0.33 -4.70 117.46 109.75 3hb9 n PHE 1039Ca 0.05 0.13 0.00 0.00 -0.00 0.00 0.00 57.45 57.63 3hb9 n PHE 1039Cb 0.09 -0.95 0.00 0.00 -1.00 0.00 0.00 39.48 37.62 3hb9 n PHE 1039CO 0.00 0.00 0.00 1.19 -0.00 0.00 0.00 176.76 177.95 3hb9 n PHE 1040N -2.72 0.00 -0.49 1.38 3.01 -0.36 -4.39 117.46 113.88 3hb9 n PHE 1040Ca -0.19 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.27 3hb9 n PHE 1040Cb 0.94 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 40.41 3hb9 n PHE 1040CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3hb9 n GLY 1041N 1.02 0.62 2.93 1.37 0.00 -0.29 -4.28 105.19 106.56 3hb9 n GLY 1041Ca 0.00 -0.67 -0.11 0.00 0.00 0.00 0.00 46.02 45.24 3hb9 n GLY 1041CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3hb9 s MET 1042N 0.00 0.19 0.80 1.61 -1.94 -1.26 -4.48 119.30 114.21 3hb9 s MET 1042Ca 0.00 -0.31 -0.11 0.00 -1.71 0.00 0.00 55.69 53.56 3hb9 s MET 1042Cb 0.00 0.00 0.08 0.00 2.01 0.00 0.00 34.83 36.92 3hb9 s MET 1042CO 0.00 -0.01 1.16 1.03 -0.01 0.00 0.00 175.02 177.19 3hb9 s ARG 1043N -0.71 1.96 0.09 2.03 0.52 -1.26 -4.93 118.95 116.65 3hb9 s ARG 1043Ca -0.07 0.06 -0.31 0.00 -0.52 0.00 0.00 55.73 54.89 3hb9 s ARG 1043Cb -0.05 -1.97 -0.08 0.00 0.52 0.00 0.00 34.95 33.37 3hb9 s ARG 1043CO -0.00 -1.58 1.49 -0.80 0.02 0.00 0.00 175.30 174.42 3hb9 s ASN 1044N -4.58 6.73 0.00 0.23 0.02 -1.26 -3.14 114.94 112.95 3hb9 s ASN 1044Ca 0.62 2.37 0.00 0.00 -1.02 0.00 0.00 52.86 54.83 3hb9 s ASN 1044Cb -0.11 -2.58 0.00 0.00 0.02 0.00 0.00 41.25 38.58 3hb9 s ASN 1044CO 0.49 -0.75 0.00 0.61 0.02 0.00 0.00 177.10 177.46 3hb9 n GLY 1045N 3.69 2.54 3.76 0.66 0.00 0.13 -5.02 105.19 110.95 3hb9 n GLY 1045Ca 0.13 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.78 3hb9 n GLY 1045CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3hb9 s GLU 1046N -0.24 3.20 -0.12 1.61 2.12 -1.19 -4.81 118.70 119.28 3hb9 s GLU 1046Ca 0.00 1.93 0.01 0.00 0.36 0.00 0.00 54.97 57.27 3hb9 s GLU 1046Cb 0.00 -2.13 0.02 0.00 0.26 0.00 0.00 34.13 32.28 3hb9 s GLU 1046CO 0.00 -1.05 -0.14 0.99 -0.54 0.00 0.00 175.26 174.52 3hb9 s THR 1047N -1.50 1.42 -0.07 -1.70 2.01 -1.26 -2.56 115.64 111.98 3hb9 s THR 1047Ca 0.73 -0.58 0.02 0.00 0.31 0.00 0.00 61.69 62.17 3hb9 s THR 1047Cb -0.33 -1.33 -0.02 0.00 0.01 0.00 0.00 72.50 70.83 3hb9 s THR 1047CO 0.37 0.43 -0.12 -0.69 -0.69 0.00 0.00 174.62 173.92 3hb9 s VAL 1048N 1.18 3.21 -0.23 3.82 1.01 -0.14 -4.97 120.40 124.28 3hb9 s VAL 1048Ca -0.03 -0.66 -0.08 0.00 0.00 0.00 0.00 61.98 61.21 3hb9 s VAL 1048Cb -0.14 -2.29 -0.04 0.00 0.00 0.00 0.00 36.38 33.91 3hb9 s VAL 1048CO -0.04 0.58 0.10 -1.61 0.00 0.00 0.00 175.10 174.12 3hb9 s GLU 1049N -0.54 3.87 -0.33 2.72 2.02 -1.26 -1.23 118.70 123.95 3hb9 s GLU 1049Ca 0.08 -0.38 -0.07 0.00 0.02 0.00 0.00 54.97 54.62 3hb9 s GLU 1049Cb -0.12 -3.36 0.03 0.00 0.10 0.00 0.00 34.13 30.79 3hb9 s GLU 1049CO 0.02 0.01 0.10 0.42 0.02 0.00 0.00 175.26 175.83 3hb9 s ILE 1050N 1.11 3.83 -0.45 -1.63 1.01 0.70 -4.90 121.20 120.87 3hb9 s ILE 1050Ca 0.05 -1.05 -0.29 0.00 0.00 0.00 0.00 60.65 59.36 3hb9 s ILE 1050Cb -0.14 -3.13 0.03 0.00 0.01 0.00 0.00 42.46 39.22 3hb9 s ILE 1050CO 0.04 -0.13 1.14 -0.70 0.00 0.00 0.00 174.94 175.28 3hb9 s GLU 1051N 1.42 3.78 -0.16 2.79 2.56 -1.26 -0.70 118.70 127.13 3hb9 s GLU 1051Ca -0.01 0.68 -0.14 0.00 0.00 0.00 0.00 54.97 55.50 3hb9 s GLU 1051Cb -0.19 -3.88 -0.11 0.00 2.00 0.00 0.00 34.13 31.95 3hb9 s GLU 1051CO 0.03 -1.30 0.11 0.82 -0.56 0.00 0.00 175.26 174.36 3hb9 h ILE 1052N 6.15 0.54 -3.57 -3.70 2.04 -1.90 -3.48 117.51 113.59 3hb9 h ILE 1052Ca -0.23 -1.56 -0.05 0.00 1.00 0.00 0.00 64.86 64.02 3hb9 h ILE 1052Cb 1.06 1.18 -0.10 0.00 -0.74 0.00 0.00 36.82 38.23 3hb9 h ILE 1052CO 1.11 0.18 -0.10 -0.62 0.00 0.00 0.00 178.15 178.73 3hb9 s ASP 1053N -6.13 -0.12 -0.49 1.72 3.68 -0.98 -5.07 116.67 109.28 3hb9 s ASP 1053Ca -0.17 -0.81 -0.46 0.00 2.13 0.00 0.00 52.55 53.24 3hb9 s ASP 1053Cb 0.02 0.57 -0.20 0.00 -1.45 0.00 0.00 42.92 41.87 3hb9 s ASP 1053CO 0.36 -1.10 1.73 1.17 0.13 0.00 0.00 175.17 177.47 3hb9 n LYS 1054N -0.35 0.05 0.00 4.34 4.81 -1.26 -2.11 118.16 123.63 3hb9 n LYS 1054Ca -0.04 0.02 0.00 0.00 -0.87 0.00 0.00 58.31 57.41 3hb9 n LYS 1054Cb 0.62 -1.53 0.00 0.00 0.02 0.00 0.00 35.03 34.14 3hb9 n LYS 1054CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3hb9 n GLY 1055N 4.82 1.76 3.70 3.14 0.00 -1.26 -4.96 105.19 112.40 3hb9 n GLY 1055Ca 0.36 -0.15 -0.42 0.00 0.00 0.00 0.00 46.02 45.82 3hb9 n GLY 1055CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3hb9 s LYS 1056N 0.00 4.46 0.06 1.61 -2.85 -0.90 -5.03 119.74 117.10 3hb9 s LYS 1056Ca 0.00 1.59 -0.13 0.00 -1.00 0.00 0.00 55.97 56.43 3hb9 s LYS 1056Cb 0.00 -3.45 0.02 0.00 -2.06 0.00 0.00 37.83 32.34 3hb9 s LYS 1056CO 0.00 -0.23 0.29 -0.98 0.10 0.00 0.00 175.35 174.53 3hb9 s ARG 1057N 1.37 0.84 -0.19 1.78 1.70 -1.26 -2.33 118.95 120.87 3hb9 s ARG 1057Ca 0.55 -0.62 -0.13 0.00 -0.47 0.00 0.00 55.73 55.06 3hb9 s ARG 1057Cb -0.24 0.36 -0.05 0.00 -0.57 0.00 0.00 34.95 34.45 3hb9 s ARG 1057CO 0.26 -0.28 0.25 -0.51 -1.08 0.00 0.00 175.30 173.95 3hb9 s LEU 1058N -2.31 4.20 -0.27 -1.89 1.43 0.12 -4.95 118.68 115.01 3hb9 s LEU 1058Ca -0.02 0.39 -0.05 0.00 -1.03 0.00 0.00 54.13 53.42 3hb9 s LEU 1058Cb 0.01 -2.29 0.01 0.00 0.03 0.00 0.00 46.19 43.95 3hb9 s LEU 1058CO -0.06 0.08 0.02 -0.63 0.23 0.00 0.00 176.35 175.99 3hb9 s ILE 1059N 0.67 3.52 -0.07 -0.59 -1.09 -1.26 -0.22 121.20 122.16 3hb9 s ILE 1059Ca 0.14 -0.81 0.05 0.00 -2.23 0.00 0.00 60.65 57.79 3hb9 s ILE 1059Cb -0.13 -2.80 -0.01 0.00 -1.58 0.00 0.00 42.46 37.95 3hb9 s ILE 1059CO 0.03 0.14 -0.23 -0.63 -1.23 0.00 0.00 174.94 173.02 3hb9 s ILE 1060N 1.43 1.93 -0.11 2.92 1.01 -0.36 -2.01 121.20 126.01 3hb9 s ILE 1060Ca 0.02 -0.98 0.02 0.00 0.00 0.00 0.00 60.65 59.71 3hb9 s ILE 1060Cb -0.17 -1.64 0.01 0.00 0.01 0.00 0.00 42.46 40.67 3hb9 s ILE 1060CO -0.00 0.54 -0.17 -0.75 0.00 0.00 0.00 174.94 174.55 3hb9 s LYS 1061N 0.01 2.42 -0.40 2.79 2.20 0.42 -0.97 119.74 126.22 3hb9 s LYS 1061Ca -0.08 -0.64 -0.21 0.00 -0.36 0.00 0.00 55.97 54.69 3hb9 s LYS 1061Cb -0.14 -2.00 0.01 0.00 -1.51 0.00 0.00 37.83 34.19 3hb9 s LYS 1061CO 0.05 -0.03 0.65 -1.17 -0.36 0.00 0.00 175.35 174.49 3hb9 s LEU 1062N 0.87 4.35 -0.19 5.43 0.20 -1.06 -1.00 118.68 127.28 3hb9 s LEU 1062Ca -0.08 -0.06 -0.23 0.00 0.69 0.00 0.00 54.13 54.45 3hb9 s LEU 1062Cb -0.15 -2.78 -0.20 0.00 -0.43 0.00 0.00 46.19 42.63 3hb9 s LEU 1062CO -0.00 -0.69 0.32 -0.33 -0.29 0.00 0.00 176.35 175.35 3hb9 h GLU 1063N 8.66 0.00 -1.97 1.98 5.08 -1.35 0.38 114.58 127.37 3hb9 h GLU 1063Ca -0.26 0.00 0.01 0.00 -1.00 0.00 0.00 59.36 58.11 3hb9 h GLU 1063Cb 1.10 0.00 -0.19 0.00 0.50 0.00 0.00 28.75 30.16 3hb9 h GLU 1063CO 0.87 0.95 0.35 -0.08 -1.00 0.00 0.00 179.01 180.10 3hb9 s THR 1064N -2.32 0.00 -0.08 1.13 -1.32 -1.22 -4.18 115.64 107.65 3hb9 s THR 1064Ca -0.26 0.00 0.01 0.00 -1.21 0.00 0.00 61.69 60.23 3hb9 s THR 1064Cb 0.04 -1.00 -0.03 0.00 -1.51 0.00 0.00 72.50 70.00 3hb9 s THR 1064CO 0.59 0.00 -0.09 -0.63 -2.21 0.00 0.00 174.62 172.28 3hb9 s ILE 1065N -1.59 3.47 0.88 5.08 1.09 -1.26 -0.52 121.20 128.34 3hb9 s ILE 1065Ca -0.05 -0.56 -0.13 0.00 -1.10 0.00 0.00 60.65 58.81 3hb9 s ILE 1065Cb -0.00 -2.42 0.12 0.00 -1.06 0.00 0.00 42.46 39.10 3hb9 s ILE 1065CO 0.03 0.58 1.19 -0.94 -0.10 0.00 0.00 174.94 175.70 3hb9 s SER 1066N -0.52 3.88 0.66 3.58 1.04 0.48 -4.98 113.70 117.84 3hb9 s SER 1066Ca 0.07 0.73 -0.14 0.00 0.48 0.00 0.00 55.95 57.10 3hb9 s SER 1066Cb -0.12 -1.16 -0.00 0.00 0.10 0.00 0.00 66.02 64.84 3hb9 s SER 1066CO 0.02 -2.30 1.08 -1.61 0.98 0.00 0.00 173.24 171.42 3hb9 s GLU 1067N -5.55 2.89 0.45 4.02 0.41 -1.26 -4.56 118.70 115.10 3hb9 s GLU 1067Ca 0.65 1.23 -0.22 0.00 -0.41 0.00 0.00 54.97 56.22 3hb9 s GLU 1067Cb -0.11 -1.97 -0.08 0.00 -1.78 0.00 0.00 34.13 30.19 3hb9 s GLU 1067CO 0.51 -1.16 1.08 -2.14 -0.49 0.00 0.00 175.26 173.06 3hb9 s PRO 1068N -4.36 3.90 0.41 0.39 0.02 -1.26 -4.54 135.00 129.57 3hb9 s PRO 1068Ca 0.64 1.53 -0.07 0.00 0.02 0.00 0.00 61.00 63.12 3hb9 s PRO 1068Cb -0.18 -2.33 0.09 0.00 0.02 0.00 0.00 34.50 32.10 3hb9 s PRO 1068CO 0.44 -0.37 0.55 -0.40 -0.33 0.00 0.00 177.00 176.89 3hb9 n ASP 1069N -0.53 0.06 -0.07 2.53 3.85 -1.07 -0.15 116.55 121.17 3hb9 n ASP 1069Ca 0.07 -1.21 0.25 0.00 -0.71 0.00 0.00 54.79 53.19 3hb9 n ASP 1069Cb 0.50 -0.42 0.72 0.00 -1.35 0.00 0.00 41.12 40.57 3hb9 n ASP 1069CO 0.00 0.00 0.00 1.05 -1.01 0.00 0.00 177.20 177.24 3hb9 h GLU 1070N 0.00 0.00 -0.00 0.11 9.09 -1.85 -0.17 114.58 121.77 3hb9 h GLU 1070Ca -0.18 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.23 3hb9 h GLU 1070Cb 0.50 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.60 3hb9 h GLU 1070CO 0.13 0.00 -0.69 0.09 0.05 0.00 0.00 179.01 178.59 3hb9 n ASN 1071N -3.99 0.77 0.00 3.06 5.03 -1.26 -4.89 115.26 113.97 3hb9 n ASN 1071Ca 0.14 -0.61 0.00 0.00 0.87 0.00 0.00 54.58 54.98 3hb9 n ASN 1071Cb 0.86 0.55 0.00 0.00 -1.02 0.00 0.00 39.78 40.16 3hb9 n ASN 1071CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 3hb9 n GLY 1072N 1.49 0.78 3.62 7.41 0.00 -0.07 -4.91 105.19 113.50 3hb9 n GLY 1072Ca 0.05 -0.15 -0.42 0.00 0.00 0.00 0.00 46.02 45.51 3hb9 n GLY 1072CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3hb9 s ASN 1073N -2.13 6.75 0.10 1.61 0.01 -1.26 -0.86 114.94 119.16 3hb9 s ASN 1073Ca 0.00 0.80 -0.16 0.00 -0.71 0.00 0.00 52.86 52.79 3hb9 s ASN 1073Cb 0.00 -2.45 -0.07 0.00 0.41 0.00 0.00 41.25 39.15 3hb9 s ASN 1073CO 0.00 -0.67 0.54 -0.13 -1.51 0.00 0.00 177.10 175.33 3hb9 s ARG 1074N 3.12 4.05 -0.26 -0.60 0.52 0.88 -2.58 118.95 124.09 3hb9 s ARG 1074Ca 0.36 0.57 -0.13 0.00 -0.52 0.00 0.00 55.73 56.02 3hb9 s ARG 1074Cb -0.14 -3.08 -0.04 0.00 0.52 0.00 0.00 34.95 32.21 3hb9 s ARG 1074CO 0.13 0.57 0.27 0.99 0.02 0.00 0.00 175.30 177.27 3hb9 s THR 1075N -1.29 5.26 -0.21 0.02 2.01 -1.26 -1.60 115.64 118.57 3hb9 s THR 1075Ca 0.33 0.37 -0.11 0.00 0.31 0.00 0.00 61.69 62.58 3hb9 s THR 1075Cb -0.17 -3.60 -0.05 0.00 0.01 0.00 0.00 72.50 68.69 3hb9 s THR 1075CO 0.18 0.24 0.19 -0.63 -0.69 0.00 0.00 174.62 173.91 3hb9 s ILE 1076N 1.66 5.36 -0.48 1.82 1.01 0.24 -0.38 121.20 130.42 3hb9 s ILE 1076Ca 0.11 0.28 -0.20 0.00 0.00 0.00 0.00 60.65 60.85 3hb9 s ILE 1076Cb -0.15 -3.53 0.04 0.00 0.01 0.00 0.00 42.46 38.83 3hb9 s ILE 1076CO 0.09 0.38 0.62 -0.31 0.00 0.00 0.00 174.94 175.72 3hb9 s TYR 1077N 0.76 3.05 0.24 3.97 1.51 0.32 -1.94 117.35 125.26 3hb9 s TYR 1077Ca 0.10 -0.35 0.07 0.00 -1.01 0.00 0.00 57.07 55.87 3hb9 s TYR 1077Cb -0.13 -3.43 -0.04 0.00 -0.11 0.00 0.00 41.96 38.26 3hb9 s TYR 1077CO 0.02 -0.96 0.19 0.71 -1.11 0.00 0.00 175.55 174.41 3hb9 s TYR 1078N 2.69 3.13 -0.13 2.71 1.51 0.81 -0.91 117.35 127.16 3hb9 s TYR 1078Ca 0.18 -0.09 -0.01 0.00 -1.01 0.00 0.00 57.07 56.13 3hb9 s TYR 1078Cb -0.17 -1.42 0.03 0.00 -0.11 0.00 0.00 41.96 40.29 3hb9 s TYR 1078CO 0.15 0.52 -0.04 0.00 -1.11 0.00 0.00 175.55 175.07 3hb9 s ALA 1079N -2.07 1.18 -0.15 3.71 0.00 -0.17 -0.96 121.76 123.31 3hb9 s ALA 1079Ca 0.33 -0.54 -0.02 0.00 0.00 0.00 0.00 51.96 51.72 3hb9 s ALA 1079Cb -0.08 -0.96 0.05 0.00 0.00 0.00 0.00 23.12 22.12 3hb9 s ALA 1079CO 0.25 -0.62 0.02 1.41 0.00 0.00 0.00 175.76 176.82 3hb9 s MET 1080N 1.77 0.65 -1.42 0.00 0.00 -0.83 -0.44 119.30 119.02 3hb9 s MET 1080Ca 0.03 -0.22 -0.09 0.00 0.00 0.00 0.00 55.69 55.41 3hb9 s MET 1080Cb -0.14 -1.68 0.02 0.00 0.00 0.00 0.00 34.83 33.04 3hb9 s MET 1080CO -0.07 -0.51 1.04 0.09 0.00 0.00 0.00 175.02 175.56 3hb9 n ASN 1081N 5.09 -6.03 0.00 1.11 4.13 -0.85 -2.76 115.26 115.95 3hb9 n ASN 1081Ca -0.08 -0.53 0.00 0.00 1.68 0.00 0.00 54.58 55.64 3hb9 n ASN 1081Cb 0.48 -4.78 0.00 0.00 -1.54 0.00 0.00 39.78 33.95 3hb9 n ASN 1081CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 3hb9 n GLY 1082N -1.86 0.90 3.35 7.41 0.00 -1.26 -5.03 105.19 108.70 3hb9 n GLY 1082Ca -0.01 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.69 3hb9 n GLY 1082CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3hb9 s GLN 1083N -0.22 3.08 0.53 1.61 -1.52 -1.11 -5.12 119.66 116.91 3hb9 s GLN 1083Ca 0.00 -0.74 -0.22 0.00 -1.95 0.00 0.00 55.36 52.45 3hb9 s GLN 1083Cb 0.00 -2.48 -0.05 0.00 -0.22 0.00 0.00 33.01 30.26 3hb9 s GLN 1083CO 0.00 0.30 1.30 0.00 -0.25 0.00 0.00 175.29 176.65 3hb9 s ALA 1084N 0.09 2.83 -0.10 6.09 0.00 -1.26 -1.97 121.76 127.44 3hb9 s ALA 1084Ca -0.07 1.22 -0.10 0.00 0.00 0.00 0.00 51.96 53.01 3hb9 s ALA 1084Cb -0.15 -3.52 0.03 0.00 0.00 0.00 0.00 23.12 19.48 3hb9 s ALA 1084CO 0.05 -1.20 0.28 0.50 0.00 0.00 0.00 175.76 175.39 3hb9 s ARG 1085N -2.89 0.36 -0.11 0.00 6.06 -0.13 -4.77 118.95 117.47 3hb9 s ARG 1085Ca 0.70 0.34 -0.01 0.00 -2.50 0.00 0.00 55.73 54.27 3hb9 s ARG 1085Cb -0.37 0.17 0.03 0.00 0.06 0.00 0.00 34.95 34.84 3hb9 s ARG 1085CO 0.44 -0.05 -0.06 1.03 -2.50 0.00 0.00 175.30 174.16 3hb9 s ARG 1086N 0.02 1.30 0.01 5.12 0.52 -1.26 -0.13 118.95 124.53 3hb9 s ARG 1086Ca -0.01 -0.19 0.08 0.00 -0.52 0.00 0.00 55.73 55.09 3hb9 s ARG 1086Cb -0.02 -1.48 -0.02 0.00 0.52 0.00 0.00 34.95 33.94 3hb9 s ARG 1086CO 0.01 -0.29 -0.25 0.42 0.02 0.00 0.00 175.30 175.20 3hb9 s ILE 1087N 1.77 2.16 -0.22 1.52 -1.09 -0.82 -4.89 121.20 119.64 3hb9 s ILE 1087Ca 0.05 -1.24 -0.06 0.00 -2.23 0.00 0.00 60.65 57.17 3hb9 s ILE 1087Cb -0.13 -1.80 -0.03 0.00 -1.58 0.00 0.00 42.46 38.92 3hb9 s ILE 1087CO -0.08 0.47 0.04 -0.31 -1.23 0.00 0.00 174.94 173.83 3hb9 s TYR 1088N -0.72 3.09 -0.09 3.97 4.12 -1.26 -0.60 117.35 125.87 3hb9 s TYR 1088Ca 0.11 -0.34 0.03 0.00 0.02 0.00 0.00 57.07 56.89 3hb9 s TYR 1088Cb -0.10 -2.15 0.01 0.00 -1.52 0.00 0.00 41.96 38.20 3hb9 s TYR 1088CO 0.01 -0.21 -0.16 0.42 0.02 0.00 0.00 175.55 175.62 3hb9 s ILE 1089N 1.14 1.47 -0.01 2.71 -1.09 -0.63 -4.95 121.20 119.83 3hb9 s ILE 1089Ca 0.04 -0.66 -0.30 0.00 -2.23 0.00 0.00 60.65 57.50 3hb9 s ILE 1089Cb -0.14 -1.32 -0.03 0.00 -1.58 0.00 0.00 42.46 39.39 3hb9 s ILE 1089CO 0.03 0.43 1.05 -0.75 -1.23 0.00 0.00 174.94 174.46 3hb9 s LYS 1090N 0.68 4.50 -0.45 2.79 2.20 -1.26 -0.08 119.74 128.11 3hb9 s LYS 1090Ca -0.13 1.51 -0.26 0.00 -0.36 0.00 0.00 55.97 56.72 3hb9 s LYS 1090Cb -0.16 -3.46 0.03 0.00 -1.51 0.00 0.00 37.83 32.73 3hb9 s LYS 1090CO 0.03 -0.17 0.95 0.34 -0.36 0.00 0.00 175.35 176.15 3hb9 s ASP 1091N 1.07 6.54 -0.01 1.43 3.68 -0.04 -4.94 116.67 124.40 3hb9 s ASP 1091Ca 0.53 0.23 -0.30 0.00 2.13 0.00 0.00 52.55 55.14 3hb9 s ASP 1091Cb -0.23 -2.46 -0.06 0.00 -1.45 0.00 0.00 42.92 38.72 3hb9 s ASP 1091CO 0.26 -1.05 1.63 -1.61 0.13 0.00 0.00 175.17 174.54 3hb9 s GLU 1092N 3.80 4.20 0.00 4.34 0.41 -1.26 -4.51 118.70 125.68 3hb9 s GLU 1092Ca 0.39 2.21 0.00 0.00 -0.41 0.00 0.00 54.97 57.16 3hb9 s GLU 1092Cb -0.10 -3.84 0.00 0.00 -1.78 0.00 0.00 34.13 28.41 3hb9 s GLU 1092CO 0.26 -0.79 0.00 -1.71 -0.49 0.00 0.00 175.26 172.53 3hb9 n ASN 1093N 6.53 0.00 0.00 -0.19 5.15 -1.26 -4.69 115.26 120.80 3hb9 n ASN 1093Ca 0.16 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 54.14 3hb9 n ASN 1093Cb 0.42 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.67 3hb9 n ASN 1093CO 0.00 0.00 0.00 0.52 1.40 0.00 0.00 177.26 179.18 3hb9 n VAL 1094N 0.00 0.00 -0.11 3.44 0.31 -1.26 -4.85 118.33 115.86 3hb9 n VAL 1094Ca 0.00 0.00 -0.12 0.00 -0.01 0.00 0.00 64.34 64.21 3hb9 n VAL 1094Cb 0.00 -0.53 -0.15 0.00 -0.91 0.00 0.00 33.84 32.26 3hb9 n VAL 1094CO 0.00 0.00 0.00 1.41 -1.32 0.00 0.00 176.83 176.92 3hb9 n HIS 1095N -1.47 0.00 0.00 3.52 8.25 -1.26 -4.98 115.22 119.27 3hb9 n HIS 1095Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 3hb9 n HIS 1095Cb 0.29 -0.99 0.00 0.00 1.12 0.00 0.00 29.99 30.41 3hb9 n HIS 1095CO 0.00 0.00 0.00 2.41 0.64 0.00 0.00 176.34 179.39 3hb9 n THR 1096N -2.87 0.00 -0.05 1.59 -1.04 -1.26 -2.33 114.28 108.32 3hb9 n THR 1096Ca -0.36 0.00 0.01 0.00 -2.04 0.00 0.00 64.05 61.66 3hb9 n THR 1096Cb 1.11 0.00 -0.14 0.00 -1.82 0.00 0.00 70.33 69.48 3hb9 n THR 1096CO 0.00 0.00 0.00 -0.46 -0.64 0.00 0.00 175.07 173.97 3hb9 n ASN 1097N 0.37 0.72 -0.85 8.00 0.23 -1.26 -4.58 115.26 117.88 3hb9 n ASN 1097Ca 0.00 0.00 0.00 0.00 -0.53 0.00 0.00 54.58 54.05 3hb9 n ASN 1097Cb 0.00 1.41 0.00 0.00 -2.08 0.00 0.00 39.78 39.11 3hb9 n ASN 1097CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 3hb9 n ALA 1098N -2.39 1.90 -2.66 -2.53 0.00 -0.98 -4.41 120.51 109.44 3hb9 n ALA 1098Ca -0.15 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 52.87 3hb9 n ALA 1098Cb 0.77 -1.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.18 3hb9 n ALA 1098CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 3hb9 s ASN 1099N 0.55 6.92 -0.42 0.00 -0.87 -1.26 -4.36 114.94 115.50 3hb9 s ASN 1099Ca 0.00 1.13 -0.27 0.00 -1.57 0.00 0.00 52.86 52.15 3hb9 s ASN 1099Cb 0.00 -2.45 0.02 0.00 -0.02 0.00 0.00 41.25 38.80 3hb9 s ASN 1099CO 0.00 -0.46 1.01 -0.69 -2.57 0.00 0.00 177.10 174.38 3hb9 s VAL 1100N 2.49 4.44 0.42 1.60 1.01 0.79 -4.79 120.40 126.35 3hb9 s VAL 1100Ca 0.37 1.16 -0.20 0.00 0.00 0.00 0.00 61.98 63.32 3hb9 s VAL 1100Cb -0.16 -4.45 -0.10 0.00 0.00 0.00 0.00 36.38 31.67 3hb9 s VAL 1100CO 0.10 -0.74 0.92 -0.54 0.00 0.00 0.00 175.10 174.84 3hb9 s LYS 1101N 3.85 4.17 1.04 2.72 -0.14 -1.26 -3.04 119.74 127.08 3hb9 s LYS 1101Ca 0.42 1.03 -0.12 0.00 -1.36 0.00 0.00 55.97 55.94 3hb9 s LYS 1101Cb -0.10 -2.21 0.21 0.00 -1.68 0.00 0.00 37.83 34.05 3hb9 s LYS 1101CO 0.24 -0.02 1.07 -2.14 -0.76 0.00 0.00 175.35 173.74 3hb9 s PRO 1102N -3.24 0.05 -0.10 -1.68 0.02 -1.26 -4.84 135.00 123.95 3hb9 s PRO 1102Ca 0.60 0.96 -0.09 0.00 0.02 0.00 0.00 61.00 62.50 3hb9 s PRO 1102Cb -0.09 -1.66 -0.04 0.00 0.02 0.00 0.00 34.50 32.73 3hb9 s PRO 1102CO 0.15 -3.11 0.20 0.15 -0.33 0.00 0.00 177.00 174.07 3hb9 s LYS 1103N -4.64 3.62 0.46 5.54 -0.14 -1.26 -1.33 119.74 121.99 3hb9 s LYS 1103Ca 0.67 -0.01 -0.23 0.00 -1.36 0.00 0.00 55.97 55.04 3hb9 s LYS 1103Cb -0.22 -3.22 -0.07 0.00 -1.68 0.00 0.00 37.83 32.63 3hb9 s LYS 1103CO 0.61 0.71 1.17 0.00 -0.76 0.00 0.00 175.35 177.08 3hb9 s ALA 1104N -0.91 2.96 -0.48 5.17 0.00 -0.32 -4.66 121.76 123.53 3hb9 s ALA 1104Ca 0.17 0.94 -0.29 0.00 0.00 0.00 0.00 51.96 52.78 3hb9 s ALA 1104Cb -0.13 -3.39 0.03 0.00 0.00 0.00 0.00 23.12 19.63 3hb9 s ALA 1104CO 0.06 -0.68 1.19 0.34 0.00 0.00 0.00 175.76 176.67 3hb9 s ASP 1105N -1.36 6.56 0.54 0.00 -1.08 -1.26 -4.91 116.67 115.17 3hb9 s ASP 1105Ca 0.64 0.50 0.32 0.00 -0.52 0.00 0.00 52.55 53.49 3hb9 s ASP 1105Cb -0.29 -2.55 1.38 0.00 -1.46 0.00 0.00 42.92 40.00 3hb9 s ASP 1105CO 0.35 -1.31 1.99 0.11 0.52 0.00 0.00 175.17 176.83 3hb9 h LYS 1106N 9.53 0.00 0.00 4.34 1.57 -1.93 -2.54 116.57 127.54 3hb9 h LYS 1106Ca -0.24 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.54 3hb9 h LYS 1106Cb 1.07 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.38 3hb9 h LYS 1106CO 1.13 0.05 -0.97 -1.13 -0.57 0.00 0.00 179.45 177.96 3hb9 n SER 1107N -3.18 0.77 -4.58 0.86 3.41 -1.26 -4.80 113.62 104.84 3hb9 n SER 1107Ca 0.00 0.23 -0.43 0.00 -0.26 0.00 0.00 58.87 58.41 3hb9 n SER 1107Cb 0.30 0.48 -0.04 0.00 -0.26 0.00 0.00 64.21 64.69 3hb9 n SER 1107CO 0.00 0.00 0.00 0.21 -0.16 0.00 0.00 175.04 175.09 3hb9 s ASN 1108N -4.99 6.57 0.00 4.04 3.84 -0.96 -4.93 114.94 118.51 3hb9 s ASN 1108Ca 0.01 0.29 0.15 0.00 0.21 0.00 0.00 52.86 53.52 3hb9 s ASN 1108Cb 0.11 -2.47 0.81 0.00 -0.55 0.00 0.00 41.25 39.15 3hb9 s ASN 1108CO 0.78 -1.02 1.36 -0.81 -2.79 0.00 0.00 177.10 174.62 3hb9 n PRO 1109N 7.14 0.33 0.12 0.43 -0.04 -1.26 -1.96 135.00 139.76 3hb9 n PRO 1109Ca 0.07 0.08 0.12 0.00 -0.04 0.00 0.00 63.50 63.73 3hb9 n PRO 1109Cb 0.48 -1.50 0.08 0.00 -0.04 0.00 0.00 33.50 32.52 3hb9 n PRO 1109CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 3hb9 h SER 1110N 0.00 0.00 -3.43 3.54 4.64 -1.91 -3.46 113.55 112.94 3hb9 h SER 1110Ca 0.00 -0.03 -0.60 0.00 -0.47 0.00 0.00 61.79 60.68 3hb9 h SER 1110Cb 0.07 0.00 -0.11 0.00 -0.31 0.00 0.00 62.40 62.06 3hb9 h SER 1110CO 0.00 0.02 0.23 -1.00 -0.87 0.00 0.00 176.83 175.21 3hb9 s HIS 1111N -3.29 3.30 -0.32 4.77 3.76 -0.83 -2.23 115.29 120.45 3hb9 s HIS 1111Ca 0.03 0.91 -0.14 0.00 -0.15 0.00 0.00 55.06 55.70 3hb9 s HIS 1111Cb 0.09 -2.89 -0.02 0.00 1.11 0.00 0.00 32.58 30.87 3hb9 s HIS 1111CO 0.75 -0.33 0.33 0.42 -0.85 0.00 0.00 174.74 175.06 3hb9 s ILE 1112N 2.52 5.20 0.28 0.60 -1.09 -0.55 -4.91 121.20 123.25 3hb9 s ILE 1112Ca 0.28 0.12 0.05 0.00 -2.23 0.00 0.00 60.65 58.87 3hb9 s ILE 1112Cb -0.15 -3.76 -0.03 0.00 -1.58 0.00 0.00 42.46 36.94 3hb9 s ILE 1112CO 0.08 -0.00 0.41 -0.83 -1.23 0.00 0.00 174.94 173.37 3hb9 s GLY 1113N 1.72 1.30 0.01 6.18 0.00 -1.26 -0.23 107.32 115.04 3hb9 s GLY 1113Ca 0.11 -1.22 -0.30 0.00 0.00 0.00 0.00 44.72 43.31 3hb9 s GLY 1113CO 0.11 -1.21 1.16 0.00 0.00 0.00 0.00 173.10 173.16 3hb9 s ALA 1114N -2.07 3.38 0.09 3.20 0.00 -0.33 -4.86 121.76 121.17 3hb9 s ALA 1114Ca 0.37 0.72 -0.05 0.00 0.00 0.00 0.00 51.96 53.00 3hb9 s ALA 1114Cb -0.09 -3.45 -0.21 0.00 0.00 0.00 0.00 23.12 19.37 3hb9 s ALA 1114CO 0.31 -0.50 1.20 1.96 0.00 0.00 0.00 175.76 178.72 3hb9 h GLN 1115N 7.01 0.35 -4.92 0.00 1.08 -1.92 0.90 115.11 117.61 3hb9 h GLN 1115Ca -0.39 -0.49 -0.31 0.00 -1.45 0.00 0.00 58.65 56.01 3hb9 h GLN 1115Cb 1.20 0.17 -0.18 0.00 -0.05 0.00 0.00 27.48 28.62 3hb9 h GLN 1115CO 0.82 1.19 -0.73 -1.64 -0.95 0.00 0.00 178.83 177.53 3hb9 s MET 1116N -2.91 0.83 0.61 1.46 -1.94 -1.26 -4.82 119.30 111.28 3hb9 s MET 1116Ca -0.05 -1.16 -0.15 0.00 -1.71 0.00 0.00 55.69 52.62 3hb9 s MET 1116Cb 0.08 -0.49 -0.03 0.00 2.01 0.00 0.00 34.83 36.40 3hb9 s MET 1116CO 0.88 0.07 1.06 -1.25 -0.01 0.00 0.00 175.02 175.78 3hb9 s PRO 1117N -2.85 3.21 0.00 2.03 0.04 -1.26 -4.34 135.00 131.83 3hb9 s PRO 1117Ca 0.06 1.20 0.00 0.00 0.04 0.00 0.00 61.00 62.29 3hb9 s PRO 1117Cb -0.02 -2.02 0.00 0.00 0.04 0.00 0.00 34.50 32.50 3hb9 s PRO 1117CO -0.00 -0.90 0.00 0.41 0.04 0.00 0.00 177.00 176.55 3hb9 n GLY 1118N -1.04 -0.62 3.42 0.56 0.00 -0.59 -4.58 105.19 102.34 3hb9 n GLY 1118Ca 0.09 -0.60 -0.27 0.00 0.00 0.00 0.00 46.02 45.24 3hb9 n GLY 1118CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3hb9 s SER 1119N -4.00 3.42 -0.33 1.61 0.01 0.46 -0.53 113.70 114.33 3hb9 s SER 1119Ca 0.00 -0.88 -0.17 0.00 1.31 0.00 0.00 55.95 56.21 3hb9 s SER 1119Cb 0.00 -0.25 -0.01 0.00 0.21 0.00 0.00 66.02 65.97 3hb9 s SER 1119CO 0.00 0.11 0.47 -0.69 0.41 0.00 0.00 173.24 173.54 3hb9 s VAL 1120N -1.72 5.06 -0.07 3.43 1.01 0.55 0.08 120.40 128.73 3hb9 s VAL 1120Ca 0.21 0.34 -0.02 0.00 0.00 0.00 0.00 61.98 62.51 3hb9 s VAL 1120Cb -0.08 -3.90 -0.01 0.00 0.00 0.00 0.00 36.38 32.39 3hb9 s VAL 1120CO 0.10 -0.14 -0.04 0.74 0.00 0.00 0.00 175.10 175.76 3hb9 h THR 1121N 5.56 0.00 -3.40 3.92 2.02 -0.69 0.55 112.91 120.88 3hb9 h THR 1121Ca -0.29 -0.66 -0.48 0.00 0.77 0.00 0.00 66.41 65.76 3hb9 h THR 1121Cb 1.13 0.00 -0.34 0.00 -1.74 0.00 0.00 68.15 67.20 3hb9 h THR 1121CO 0.74 0.00 -0.80 -0.70 0.37 0.00 0.00 175.52 175.14 3hb9 s GLU 1122N -1.51 1.34 -0.37 6.66 2.12 -0.66 -4.51 118.70 121.78 3hb9 s GLU 1122Ca -0.03 -0.27 -0.17 0.00 0.36 0.00 0.00 54.97 54.86 3hb9 s GLU 1122Cb 0.00 -1.22 -0.00 0.00 0.26 0.00 0.00 34.13 33.18 3hb9 s GLU 1122CO 0.04 -0.06 0.43 0.54 -0.54 0.00 0.00 175.26 175.68 3hb9 s VAL 1123N 0.92 5.09 -0.11 3.70 0.11 -1.26 -0.04 120.40 128.81 3hb9 s VAL 1123Ca -0.10 0.03 0.22 0.00 -2.93 0.00 0.00 61.98 59.20 3hb9 s VAL 1123Cb -0.15 -3.93 -0.20 0.00 -1.53 0.00 0.00 36.38 30.57 3hb9 s VAL 1123CO 0.01 -0.23 0.70 0.29 -3.33 0.00 0.00 175.10 172.55 3hb9 n LYS 1124N 5.56 0.64 -4.48 1.54 5.02 0.58 -4.98 118.16 122.04 3hb9 n LYS 1124Ca -0.07 -0.06 -0.24 0.00 -2.02 0.00 0.00 58.31 55.92 3hb9 n LYS 1124Cb 0.49 -1.65 -0.10 0.00 -0.02 0.00 0.00 35.03 33.75 3hb9 n LYS 1124CO 0.00 0.00 0.00 0.14 -0.52 0.00 0.00 177.40 177.02 3hb9 s VAL 1125N -3.44 2.23 0.23 -0.18 -7.23 -1.20 -5.01 120.40 105.81 3hb9 s VAL 1125Ca -0.05 -2.28 0.10 0.00 -1.81 0.00 0.00 61.98 57.93 3hb9 s VAL 1125Cb 0.12 -2.42 -0.05 0.00 0.56 0.00 0.00 36.38 34.60 3hb9 s VAL 1125CO 0.86 -0.34 -0.17 -0.44 -0.31 0.00 0.00 175.10 174.70 3hb9 s SER 1126N -3.52 3.04 -0.05 4.85 0.01 -1.26 -5.00 113.70 111.77 3hb9 s SER 1126Ca 0.30 -1.01 -0.29 0.00 1.31 0.00 0.00 55.95 56.26 3hb9 s SER 1126Cb -0.01 -0.21 -0.07 0.00 0.21 0.00 0.00 66.02 65.94 3hb9 s SER 1126CO 0.14 -0.06 1.90 -0.69 0.41 0.00 0.00 173.24 174.94 3hb9 s VAL 1127N -2.67 3.21 0.00 3.43 1.01 -1.26 -2.33 120.40 121.80 3hb9 s VAL 1127Ca 0.25 0.25 0.00 0.00 0.00 0.00 0.00 61.98 62.48 3hb9 s VAL 1127Cb -0.03 -3.18 0.00 0.00 0.00 0.00 0.00 36.38 33.16 3hb9 s VAL 1127CO 0.10 -0.05 0.00 0.61 0.00 0.00 0.00 175.10 175.77 3hb9 n GLY 1128N 4.66 0.69 3.77 4.51 0.00 0.18 -5.00 105.19 113.99 3hb9 n GLY 1128Ca 0.21 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.84 3hb9 n GLY 1128CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3hb9 s GLU 1129N -0.79 4.35 0.01 1.61 2.12 -0.98 -4.82 118.70 120.19 3hb9 s GLU 1129Ca 0.00 0.83 -0.28 0.00 0.36 0.00 0.00 54.97 55.89 3hb9 s GLU 1129Cb 0.00 -3.32 -0.04 0.00 0.26 0.00 0.00 34.13 31.03 3hb9 s GLU 1129CO 0.00 0.43 0.87 0.99 -0.54 0.00 0.00 175.26 177.02 3hb9 s THR 1130N -0.46 4.83 0.13 -1.70 2.01 -1.26 -1.81 115.64 117.39 3hb9 s THR 1130Ca 0.32 1.84 0.06 0.00 0.31 0.00 0.00 61.69 64.22 3hb9 s THR 1130Cb -0.19 -4.22 -0.04 0.00 0.01 0.00 0.00 72.50 68.06 3hb9 s THR 1130CO 0.19 0.24 -0.14 0.68 -0.69 0.00 0.00 174.62 174.90 3hb9 s VAL 1131N 0.63 1.37 0.38 3.82 -7.23 -0.48 -5.01 120.40 113.87 3hb9 s VAL 1131Ca 0.45 -1.77 0.02 0.00 -1.81 0.00 0.00 61.98 58.87 3hb9 s VAL 1131Cb -0.20 -1.59 -0.02 0.00 0.56 0.00 0.00 36.38 35.13 3hb9 s VAL 1131CO 0.25 -0.44 0.57 -0.54 -0.31 0.00 0.00 175.10 174.64 3hb9 s LYS 1132N -2.79 3.25 0.38 4.82 1.02 -1.26 -2.25 119.74 122.92 3hb9 s LYS 1132Ca 0.10 -0.53 -0.27 0.00 0.02 0.00 0.00 55.97 55.29 3hb9 s LYS 1132Cb -0.04 -2.66 -0.11 0.00 -0.52 0.00 0.00 37.83 34.50 3hb9 s LYS 1132CO 0.03 -0.02 1.39 0.00 -0.92 0.00 0.00 175.35 175.83 3hb9 n ALA 1133N -1.86 1.85 -0.85 5.17 0.00 -1.19 -2.65 120.51 120.97 3hb9 n ALA 1133Ca -0.02 0.32 0.00 0.00 0.00 0.00 0.00 53.44 53.75 3hb9 n ALA 1133Cb 0.57 -2.34 0.00 0.00 0.00 0.00 0.00 19.45 17.68 3hb9 n ALA 1133CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 3hb9 n ASN 1134N 0.43 -0.61 -4.72 0.00 3.02 0.22 -4.92 115.26 108.68 3hb9 n ASN 1134Ca 0.04 0.00 -0.42 0.00 -0.03 0.00 0.00 54.58 54.17 3hb9 n ASN 1134Cb 0.38 -0.97 -0.03 0.00 -0.61 0.00 0.00 39.78 38.55 3hb9 n ASN 1134CO 0.00 0.00 0.00 -1.58 -2.62 0.00 0.00 177.26 173.06 3hb9 s GLN 1135N -0.40 4.30 0.06 3.52 0.74 -1.09 -4.57 119.66 122.23 3hb9 s GLN 1135Ca 0.00 2.13 -0.32 0.00 0.05 0.00 0.00 55.36 57.22 3hb9 s GLN 1135Cb 0.00 -3.23 -0.11 0.00 1.10 0.00 0.00 33.01 30.77 3hb9 s GLN 1135CO 0.00 -0.46 1.82 -0.35 -0.55 0.00 0.00 175.29 175.74 3hb9 n PRO 1136N 3.89 2.51 -0.09 1.67 -0.04 -1.26 -1.29 135.00 140.38 3hb9 n PRO 1136Ca 0.12 0.91 -0.18 0.00 -0.04 0.00 0.00 63.50 64.31 3hb9 n PRO 1136Cb 0.42 -2.78 -0.07 0.00 -0.04 0.00 0.00 33.50 31.02 3hb9 n PRO 1136CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 3hb9 n LEU 1137N 5.72 1.99 -4.19 1.53 4.77 0.74 -4.75 117.00 122.82 3hb9 n LEU 1137Ca 0.19 0.11 -0.18 0.00 -0.03 0.00 0.00 56.01 56.10 3hb9 n LEU 1137Cb 0.34 -0.59 -0.12 0.00 -2.33 0.00 0.00 43.42 40.72 3hb9 n LEU 1137CO 0.68 0.56 -0.45 -0.76 -1.33 0.00 0.00 177.39 176.09 3hb9 s LEU 1138N -6.67 2.32 -0.19 2.23 1.02 -0.96 -0.31 118.68 116.13 3hb9 s LEU 1138Ca -0.26 -0.68 0.01 0.00 0.02 0.00 0.00 54.13 53.22 3hb9 s LEU 1138Cb 0.09 -0.51 0.03 0.00 0.02 0.00 0.00 46.19 45.82 3hb9 s LEU 1138CO 0.37 -0.11 -0.17 -0.63 0.02 0.00 0.00 176.35 175.83 3hb9 s ILE 1139N -1.60 1.96 0.18 -0.59 1.01 0.95 -0.99 121.20 122.12 3hb9 s ILE 1139Ca 0.02 -1.00 0.07 0.00 0.00 0.00 0.00 60.65 59.73 3hb9 s ILE 1139Cb -0.08 -1.85 -0.04 0.00 0.01 0.00 0.00 42.46 40.51 3hb9 s ILE 1139CO 0.02 0.41 0.06 0.42 0.00 0.00 0.00 174.94 175.85 3hb9 s THR 1140N 1.30 4.00 -0.19 2.92 -4.23 0.77 0.06 115.64 120.27 3hb9 s THR 1140Ca 0.02 -1.36 0.01 0.00 -1.18 0.00 0.00 61.69 59.19 3hb9 s THR 1140Cb -0.14 -3.04 0.03 0.00 1.34 0.00 0.00 72.50 70.69 3hb9 s THR 1140CO -0.11 -0.15 -0.14 -0.70 -0.54 0.00 0.00 174.62 172.98 3hb9 s GLU 1141N -3.13 2.37 0.00 3.99 2.12 0.11 -0.25 118.70 123.91 3hb9 s GLU 1141Ca 0.29 -0.84 0.00 0.00 0.36 0.00 0.00 54.97 54.78 3hb9 s GLU 1141Cb -0.09 -2.45 0.00 0.00 0.26 0.00 0.00 34.13 31.85 3hb9 s GLU 1141CO 0.21 -0.35 0.00 0.00 -0.54 0.00 0.00 175.26 174.58 3hb9 n ALA 1142N 4.65 0.00 -3.21 6.30 0.00 -0.31 -0.41 120.51 127.54 3hb9 n ALA 1142Ca -0.17 0.00 -0.26 0.00 0.00 0.00 0.00 53.44 53.01 3hb9 n ALA 1142Cb 0.48 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.87 3hb9 n ALA 1142CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 3hb9 n MET 1143N -0.69 2.56 -1.24 0.00 2.81 -1.26 -4.75 117.12 114.55 3hb9 n MET 1143Ca 0.00 -4.56 -0.08 0.00 -1.81 0.00 0.00 57.70 51.25 3hb9 n MET 1143Cb 0.00 -2.14 -0.04 0.00 -0.71 0.00 0.00 33.22 30.34 3hb9 n MET 1143CO 0.00 0.00 0.00 1.63 1.51 0.00 0.00 175.97 179.11 3hb9 n LYS 1144N 0.44 -0.94 -5.00 0.03 5.02 -1.26 -5.01 118.16 111.44 3hb9 n LYS 1144Ca 0.29 0.73 -0.29 0.00 -2.02 0.00 0.00 58.31 57.02 3hb9 n LYS 1144Cb 0.43 -4.69 -0.17 0.00 -0.02 0.00 0.00 35.03 30.58 3hb9 n LYS 1144CO 0.00 0.00 0.00 -1.64 -0.52 0.00 0.00 177.40 175.24 3hb9 s MET 1145N -2.44 2.41 -0.31 1.97 -1.94 -1.26 -5.12 119.30 112.62 3hb9 s MET 1145Ca 0.00 -0.72 -0.17 0.00 -1.71 0.00 0.00 55.69 53.10 3hb9 s MET 1145Cb 0.00 -1.92 -0.02 0.00 2.01 0.00 0.00 34.83 34.90 3hb9 s MET 1145CO 0.00 0.18 0.46 -1.21 -0.01 0.00 0.00 175.02 174.43 3hb9 s GLU 1146N 0.31 3.82 -0.10 2.03 2.02 -1.26 -1.16 118.70 124.35 3hb9 s GLU 1146Ca -0.13 -0.04 -0.10 0.00 0.02 0.00 0.00 54.97 54.72 3hb9 s GLU 1146Cb -0.16 -3.73 -0.05 0.00 0.10 0.00 0.00 34.13 30.29 3hb9 s GLU 1146CO 0.06 -0.47 0.22 0.99 0.02 0.00 0.00 175.26 176.08 3hb9 s THR 1147N 2.24 5.36 -0.42 3.63 2.01 0.66 -4.94 115.64 124.18 3hb9 s THR 1147Ca 0.17 0.40 -0.07 0.00 0.31 0.00 0.00 61.69 62.51 3hb9 s THR 1147Cb -0.16 -3.51 0.09 0.00 0.01 0.00 0.00 72.50 68.94 3hb9 s THR 1147CO 0.11 0.58 0.24 -0.89 -0.69 0.00 0.00 174.62 173.97 3hb9 s THR 1148N -0.81 3.84 -0.02 -0.82 2.01 -1.26 -0.16 115.64 118.41 3hb9 s THR 1148Ca 0.17 -1.67 -0.30 0.00 0.31 0.00 0.00 61.69 60.20 3hb9 s THR 1148Cb -0.13 -3.45 -0.04 0.00 0.01 0.00 0.00 72.50 68.89 3hb9 s THR 1148CO 0.06 -0.58 1.17 -0.63 -0.69 0.00 0.00 174.62 173.95 3hb9 s ILE 1149N 1.31 4.28 0.33 1.82 1.01 -0.16 -4.94 121.20 124.85 3hb9 s ILE 1149Ca 0.04 1.62 0.09 0.00 0.00 0.00 0.00 60.65 62.41 3hb9 s ILE 1149Cb -0.23 -4.04 -0.05 0.00 0.01 0.00 0.00 42.46 38.14 3hb9 s ILE 1149CO -0.01 0.04 -0.03 -1.10 0.00 0.00 0.00 174.94 173.85 3hb9 s GLN 1150N 1.81 2.02 0.04 2.79 -0.21 -1.26 -0.18 119.66 124.67 3hb9 s GLN 1150Ca 0.56 -1.74 -0.30 0.00 0.02 0.00 0.00 55.36 53.89 3hb9 s GLN 1150Cb -0.25 -1.90 -0.05 0.00 1.00 0.00 0.00 33.01 31.80 3hb9 s GLN 1150CO 0.24 0.18 1.22 0.00 -2.12 0.00 0.00 175.29 174.81 3hb9 s ALA 1151N -2.51 3.43 0.34 6.09 0.00 -0.41 -4.86 121.76 123.84 3hb9 s ALA 1151Ca 0.34 0.82 0.08 0.00 0.00 0.00 0.00 51.96 53.19 3hb9 s ALA 1151Cb -0.01 -3.47 0.63 0.00 0.00 0.00 0.00 23.12 20.27 3hb9 s ALA 1151CO 0.18 -0.53 1.82 -1.00 0.00 0.00 0.00 175.76 176.24 3hb9 h PRO 1152N 6.98 0.26 0.00 0.00 0.13 -1.92 0.63 132.00 138.08 3hb9 h PRO 1152Ca -0.40 -0.08 -0.11 0.00 -0.87 0.00 0.00 66.00 64.54 3hb9 h PRO 1152Cb 1.20 -0.02 -0.02 0.00 0.13 0.00 0.00 31.00 32.28 3hb9 h PRO 1152CO 0.83 0.49 -0.04 1.97 -0.23 0.00 0.00 178.00 181.02 3hb9 n PHE 1153N -4.17 -0.93 -2.71 1.56 1.16 -1.26 -4.65 117.46 106.46 3hb9 n PHE 1153Ca -0.01 -0.96 -0.42 0.00 -1.87 0.00 0.00 57.45 54.19 3hb9 n PHE 1153Cb 0.36 0.25 -0.03 0.00 -1.61 0.00 0.00 39.48 38.44 3hb9 n PHE 1153CO 0.00 0.00 0.00 -0.51 -1.87 0.00 0.00 176.76 174.38 3hb9 s ASP 1154N -1.90 7.41 0.00 5.98 1.01 -1.26 -3.19 116.67 124.71 3hb9 s ASP 1154Ca 0.12 1.72 0.00 0.00 0.71 0.00 0.00 52.55 55.09 3hb9 s ASP 1154Cb -0.01 -2.58 0.00 0.00 1.01 0.00 0.00 42.92 41.35 3hb9 s ASP 1154CO 0.08 -0.20 0.00 0.61 0.21 0.00 0.00 175.17 175.88 3hb9 n GLY 1155N 2.68 -0.10 3.65 0.21 0.00 -0.95 -4.83 105.19 105.85 3hb9 n GLY 1155Ca 0.05 -0.95 -0.35 0.00 0.00 0.00 0.00 46.02 44.77 3hb9 n GLY 1155CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3hb9 s VAL 1156N -2.00 4.84 0.23 1.61 -7.23 -1.26 -1.39 120.40 115.20 3hb9 s VAL 1156Ca 0.00 -0.02 -0.31 0.00 -1.81 0.00 0.00 61.98 59.85 3hb9 s VAL 1156Cb 0.00 -3.17 -0.10 0.00 0.56 0.00 0.00 36.38 33.67 3hb9 s VAL 1156CO 0.00 0.47 1.52 -0.63 -0.31 0.00 0.00 175.10 176.15 3hb9 s ILE 1157N 0.23 2.52 -0.09 -0.62 1.09 -0.75 -2.75 121.20 120.83 3hb9 s ILE 1157Ca 0.04 0.41 0.07 0.00 -1.10 0.00 0.00 60.65 60.08 3hb9 s ILE 1157Cb -0.12 -3.26 -0.10 0.00 -1.06 0.00 0.00 42.46 37.91 3hb9 s ILE 1157CO 0.00 0.06 0.01 1.17 -0.10 0.00 0.00 174.94 176.08 3hb9 n LYS 1158N 2.85 2.18 -3.71 2.79 3.00 0.98 -0.65 118.16 125.61 3hb9 n LYS 1158Ca 0.09 0.01 -0.11 0.00 -0.00 0.00 0.00 58.31 58.30 3hb9 n LYS 1158Cb 0.39 -1.23 -0.11 0.00 0.00 0.00 0.00 35.03 34.08 3hb9 n LYS 1158CO 0.00 0.00 0.00 1.14 0.00 0.00 0.00 177.40 178.54 3hb9 s GLN 1159N -2.22 0.38 -0.33 1.64 -2.07 -1.24 -4.78 119.66 111.04 3hb9 s GLN 1159Ca -0.06 0.72 -0.08 0.00 -1.82 0.00 0.00 55.36 54.11 3hb9 s GLN 1159Cb 0.03 0.01 0.02 0.00 -1.09 0.00 0.00 33.01 31.98 3hb9 s GLN 1159CO 0.35 -0.14 0.14 0.08 -1.32 0.00 0.00 175.29 174.39 3hb9 s VAL 1160N 1.17 4.22 0.18 3.63 1.01 -1.26 -1.78 120.40 127.57 3hb9 s VAL 1160Ca -0.08 -0.81 0.06 0.00 0.00 0.00 0.00 61.98 61.15 3hb9 s VAL 1160Cb -0.08 -3.28 -0.13 0.00 0.00 0.00 0.00 36.38 32.89 3hb9 s VAL 1160CO -0.10 -0.09 1.41 0.74 0.00 0.00 0.00 175.10 177.07 3hb9 h THR 1161N 5.91 1.54 -2.02 3.92 2.02 -1.60 -3.47 112.91 119.22 3hb9 h THR 1161Ca -0.28 -2.70 -0.55 0.00 0.77 0.00 0.00 66.41 63.66 3hb9 h THR 1161Cb 1.11 2.48 -0.08 0.00 -1.74 0.00 0.00 68.15 69.92 3hb9 h THR 1161CO 0.63 0.78 -0.58 0.68 0.37 0.00 0.00 175.52 177.40 3hb9 s VAL 1162N -3.18 3.27 0.43 3.16 -7.23 -1.26 -4.77 120.40 110.81 3hb9 s VAL 1162Ca -0.01 -1.75 0.04 0.00 -1.81 0.00 0.00 61.98 58.44 3hb9 s VAL 1162Cb 0.11 -2.96 -0.05 0.00 0.56 0.00 0.00 36.38 34.04 3hb9 s VAL 1162CO 0.81 -0.26 0.03 0.20 -0.31 0.00 0.00 175.10 175.57 3hb9 s ASN 1163N -3.78 3.51 0.19 4.85 0.01 -1.26 -5.02 114.94 113.44 3hb9 s ASN 1163Ca 0.35 -1.51 -0.32 0.00 -0.71 0.00 0.00 52.86 50.67 3hb9 s ASN 1163Cb -0.04 0.11 -0.11 0.00 0.41 0.00 0.00 41.25 41.61 3hb9 s ASN 1163CO 0.22 -0.69 1.66 0.20 -1.51 0.00 0.00 177.10 176.98 3hb9 s ASN 1164N -3.71 6.46 0.00 -1.22 0.01 -1.26 -2.37 114.94 112.85 3hb9 s ASN 1164Ca 0.24 2.77 0.00 0.00 -0.71 0.00 0.00 52.86 55.16 3hb9 s ASN 1164Cb 0.06 -2.60 0.00 0.00 0.41 0.00 0.00 41.25 39.12 3hb9 s ASN 1164CO 0.12 -0.91 0.00 0.61 -1.51 0.00 0.00 177.10 175.41 3hb9 n GLY 1165N 3.83 1.03 3.77 0.66 0.00 0.19 -4.99 105.19 109.68 3hb9 n GLY 1165Ca 0.15 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.80 3hb9 n GLY 1165CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3hb9 s ASP 1166N -3.05 6.24 0.06 1.61 1.11 -1.00 -4.67 116.67 116.97 3hb9 s ASP 1166Ca 0.00 2.30 -0.11 0.00 0.18 0.00 0.00 52.55 54.92 3hb9 s ASP 1166Cb 0.00 -2.60 -0.06 0.00 1.07 0.00 0.00 42.92 41.33 3hb9 s ASP 1166CO 0.00 -0.87 0.40 0.42 1.18 0.00 0.00 175.17 176.30 3hb9 s THR 1167N -1.54 5.08 0.07 -1.27 -4.23 -1.26 -0.33 115.64 112.16 3hb9 s THR 1167Ca 0.63 0.53 0.04 0.00 -1.18 0.00 0.00 61.69 61.70 3hb9 s THR 1167Cb -0.28 -3.66 -0.03 0.00 1.34 0.00 0.00 72.50 69.87 3hb9 s THR 1167CO 0.35 0.34 -0.12 0.27 -0.54 0.00 0.00 174.62 174.92 3hb9 s ILE 1168N -1.34 0.91 0.10 2.99 -4.36 0.31 -4.97 121.20 114.84 3hb9 s ILE 1168Ca 0.31 -1.29 0.08 0.00 -0.26 0.00 0.00 60.65 59.49 3hb9 s ILE 1168Cb -0.14 -0.98 -0.04 0.00 1.25 0.00 0.00 42.46 42.55 3hb9 s ILE 1168CO 0.17 -0.33 -0.17 0.00 0.24 0.00 0.00 174.94 174.85 3hb9 s ALA 1169N -1.50 2.69 -0.12 2.27 0.00 -1.26 -1.54 121.76 122.29 3hb9 s ALA 1169Ca -0.03 -1.31 -0.41 0.00 0.00 0.00 0.00 51.96 50.21 3hb9 s ALA 1169Cb -0.09 -0.69 -0.19 0.00 0.00 0.00 0.00 23.12 22.16 3hb9 s ALA 1169CO 0.01 0.59 1.34 2.41 0.00 0.00 0.00 175.76 180.12 3hb9 n THR 1170N 0.94 0.04 -0.04 0.00 -1.04 -1.26 -1.19 114.28 111.72 3hb9 n THR 1170Ca -0.16 -0.01 0.00 0.00 -2.04 0.00 0.00 64.05 61.85 3hb9 n THR 1170Cb 0.53 -0.47 0.00 0.00 -1.82 0.00 0.00 70.33 68.57 3hb9 n THR 1170CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 3hb9 n GLY 1171N 2.64 0.84 3.74 3.41 0.00 0.31 -4.92 105.19 111.20 3hb9 n GLY 1171Ca 0.23 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.83 3hb9 n GLY 1171CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3hb9 s ASP 1172N -2.64 6.68 0.15 1.61 -0.00 -0.34 -1.17 116.67 120.95 3hb9 s ASP 1172Ca 0.00 2.60 -0.31 0.00 -0.00 0.00 0.00 52.55 54.84 3hb9 s ASP 1172Cb 0.00 -2.61 -0.09 0.00 -0.00 0.00 0.00 42.92 40.21 3hb9 s ASP 1172CO 0.00 -0.71 1.52 -0.22 -0.00 0.00 0.00 175.17 175.76 3hb9 s LEU 1173N 0.11 4.37 -0.08 1.23 2.96 -0.44 -1.18 118.68 125.64 3hb9 s LEU 1173Ca 0.62 2.53 -0.02 0.00 -0.22 0.00 0.00 54.13 57.04 3hb9 s LEU 1173Cb -0.41 -3.59 -0.04 0.00 0.50 0.00 0.00 46.19 42.64 3hb9 s LEU 1173CO 0.39 -0.78 -0.09 0.18 -1.32 0.00 0.00 176.35 174.73 3hb9 n LEU 1174N 3.99 1.79 -4.00 -0.68 4.77 0.68 -4.71 117.00 118.83 3hb9 n LEU 1174Ca 0.13 0.03 -0.09 0.00 -0.03 0.00 0.00 56.01 56.06 3hb9 n LEU 1174Cb 0.40 -0.27 -0.11 0.00 -2.33 0.00 0.00 43.42 41.11 3hb9 n LEU 1174CO 0.61 0.41 -0.34 -0.63 -1.33 0.00 0.00 177.39 176.10 3hb9 s ILE 1175N -2.16 0.14 -0.05 -0.08 -1.09 -1.20 -1.65 121.20 115.12 3hb9 s ILE 1175Ca -0.11 -1.17 0.03 0.00 -2.23 0.00 0.00 60.65 57.16 3hb9 s ILE 1175Cb 0.04 -0.67 0.00 0.00 -1.58 0.00 0.00 42.46 40.25 3hb9 s ILE 1175CO 0.17 -0.65 -0.14 -0.70 -1.23 0.00 0.00 174.94 172.40 3hb9 s GLU 1176N -2.24 1.58 0.13 2.79 2.12 -0.74 -1.48 118.70 120.87 3hb9 s GLU 1176Ca -0.09 -0.47 0.01 0.00 0.36 0.00 0.00 54.97 54.78 3hb9 s GLU 1176Cb -0.04 -1.36 -0.04 0.00 0.26 0.00 0.00 34.13 32.95 3hb9 s GLU 1176CO -0.04 0.13 -0.02 0.96 -0.54 0.00 0.00 175.26 175.76 3hb9 s ILE 1177N 0.31 0.56 -0.99 -3.70 -0.00 -0.95 -0.01 121.20 116.43 3hb9 s ILE 1177Ca -0.08 -1.94 0.08 0.00 -0.00 0.00 0.00 60.65 58.71 3hb9 s ILE 1177Cb -0.13 -1.91 0.06 0.00 -0.00 0.00 0.00 42.46 40.49 3hb9 s ILE 1177CO 0.02 -0.65 0.75 -0.62 -0.00 0.00 0.00 174.94 174.44