#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hbb n SER 2 N 0.00 -7.61 -0.19 6.12 7.64 -1.26 -4.54 113.62 113.77 3hbb n SER 2 Ca 0.00 1.07 0.00 0.00 1.01 0.00 0.00 58.87 60.95 3hbb n SER 2 Cb 0.00 -3.94 0.00 0.00 -1.01 0.00 0.00 64.21 59.26 3hbb n SER 2 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3hbb n LEU 3 N -0.66 0.37 -0.01 -3.43 -0.00 -1.26 -3.75 117.00 108.27 3hbb n LEU 3 Ca 0.00 -0.19 0.09 0.00 -0.00 0.00 0.00 56.01 55.91 3hbb n LEU 3 Cb 0.00 -0.19 -0.15 0.00 -0.00 0.00 0.00 43.42 43.09 3hbb n LEU 3 CO 0.00 0.09 -0.74 0.49 -0.00 0.00 0.00 177.39 177.23 3hbb n PHE 4 N -0.30 0.00 -1.13 1.47 3.72 -1.26 -5.00 117.46 114.96 3hbb n PHE 4 Ca 0.00 0.00 -0.30 0.00 -0.05 0.00 0.00 57.45 57.10 3hbb n PHE 4 Cb 0.09 -0.45 0.23 0.00 -0.94 0.00 0.00 39.48 38.41 3hbb n PHE 4 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 176.76 176.86 3hbb s LYS 5 N -3.28 -0.88 -0.23 -1.08 1.02 -1.25 -5.05 119.74 108.99 3hbb s LYS 5 Ca -0.07 0.02 -0.03 0.00 0.02 0.00 0.00 55.97 55.91 3hbb s LYS 5 Cb 0.12 -1.63 0.00 0.00 -0.52 0.00 0.00 37.83 35.81 3hbb s LYS 5 CO 0.79 -3.50 -0.05 0.42 -0.92 0.00 0.00 175.35 172.08 3hbb s ILE 6 N -3.03 3.16 -0.14 2.17 1.01 -1.26 -5.03 121.20 118.08 3hbb s ILE 6 Ca 0.70 -0.69 -0.29 0.00 0.00 0.00 0.00 60.65 60.37 3hbb s ILE 6 Cb -0.11 -2.49 -0.01 0.00 0.01 0.00 0.00 42.46 39.86 3hbb s ILE 6 CO 0.56 0.35 0.98 -0.60 0.00 0.00 0.00 174.94 176.23 3hbb s ARG 7 N 1.42 4.37 0.27 2.79 3.52 -1.26 -0.48 118.95 129.58 3hbb s ARG 7 Ca 0.04 1.32 -0.29 0.00 -0.13 0.00 0.00 55.73 56.67 3hbb s ARG 7 Cb -0.15 -3.56 -0.09 0.00 -1.56 0.00 0.00 34.95 29.58 3hbb s ARG 7 CO -0.04 -0.37 1.17 -1.64 -0.81 0.00 0.00 175.30 173.61 3hbb s MET 8 N 2.24 4.54 0.99 5.12 -1.94 0.20 -4.91 119.30 125.54 3hbb s MET 8 Ca 0.46 1.92 -0.13 0.00 -1.71 0.00 0.00 55.69 56.22 3hbb s MET 8 Cb -0.17 -3.17 0.18 0.00 2.01 0.00 0.00 34.83 33.67 3hbb s MET 8 CO 0.15 0.04 1.13 -1.25 -0.01 0.00 0.00 175.02 175.08 3hbb s PRO 9 N -1.21 0.49 0.62 2.03 0.04 -1.26 -4.92 135.00 130.80 3hbb s PRO 9 Ca 0.48 0.27 0.37 0.00 0.04 0.00 0.00 61.00 62.17 3hbb s PRO 9 Cb -0.34 -1.77 2.10 0.00 0.04 0.00 0.00 34.50 34.53 3hbb s PRO 9 CO 0.43 -2.64 2.30 1.05 0.04 0.00 0.00 177.00 178.18 3hbb h GLU 10 N -1.82 0.00 -0.65 4.56 9.09 -1.95 -2.70 114.58 121.11 3hbb h GLU 10 Ca -0.51 0.00 0.00 0.00 0.05 0.00 0.00 59.36 58.90 3hbb h GLU 10 Cb 1.32 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.42 3hbb h GLU 10 CO 0.55 0.01 0.00 0.25 0.05 0.00 0.00 179.01 179.87 3hbb n THR 11 N -3.42 1.71 -0.25 -1.06 -2.24 -1.26 -4.74 114.28 103.02 3hbb n THR 11 Ca -0.03 -1.09 0.05 0.00 -2.27 0.00 0.00 64.05 60.72 3hbb n THR 11 Cb 0.09 0.07 0.18 0.00 -2.10 0.00 0.00 70.33 68.58 3hbb n THR 11 CO 0.00 0.00 0.00 1.62 -0.57 0.00 0.00 175.07 176.12 3hbb h VAL 12 N 3.78 0.60 0.00 2.28 3.04 -1.71 -1.44 116.25 122.80 3hbb h VAL 12 Ca 0.00 -0.12 -0.10 0.00 -1.01 0.00 0.00 66.70 65.46 3hbb h VAL 12 Cb 1.38 0.21 -0.01 0.00 -2.01 0.00 0.00 31.29 30.85 3hbb h VAL 12 CO 0.23 0.07 -0.49 0.00 -1.01 0.00 0.00 177.57 176.36 3hbb h ALA 13 N 1.56 0.85 -0.09 3.17 0.00 -1.88 -3.36 119.26 119.51 3hbb h ALA 13 Ca 0.40 -0.45 0.01 0.00 0.00 0.00 0.00 54.91 54.88 3hbb h ALA 13 Cb 0.64 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.34 3hbb h ALA 13 CO -0.44 0.61 0.02 0.93 0.00 0.00 0.00 179.25 180.37 3hbb h GLU 14 N 0.00 0.06 -7.03 0.00 4.39 -1.62 -3.13 114.58 107.25 3hbb h GLU 14 Ca -0.00 -0.00 -0.50 0.00 0.34 0.00 0.00 59.36 59.19 3hbb h GLU 14 Cb 1.13 -0.01 0.06 0.00 -0.10 0.00 0.00 28.75 29.83 3hbb h GLU 14 CO 0.06 0.04 0.46 0.20 -1.16 0.00 0.00 179.01 178.61 3hbb s GLY 15 N -2.33 2.72 -0.18 -3.84 0.00 -1.25 -3.51 107.32 98.93 3hbb s GLY 15 Ca -0.13 0.87 0.00 0.00 0.00 0.00 0.00 44.72 45.46 3hbb s GLY 15 CO 0.67 1.29 0.00 -1.30 0.00 0.00 0.00 173.10 173.76 3hbb n THR 16 N -0.75 0.00 -2.73 0.90 -2.24 -1.26 -4.98 114.28 103.21 3hbb n THR 16 Ca 0.09 0.00 -0.43 0.00 -2.27 0.00 0.00 64.05 61.44 3hbb n THR 16 Cb 0.49 -0.75 -0.03 0.00 -2.10 0.00 0.00 70.33 67.94 3hbb n THR 16 CO 0.00 0.00 0.00 -0.60 -0.57 0.00 0.00 175.07 173.90 3hbb s ARG 17 N -1.53 4.20 -0.13 -0.78 3.52 -1.18 -4.60 118.95 118.45 3hbb s ARG 17 Ca 0.00 1.18 -0.29 0.00 -0.13 0.00 0.00 55.73 56.49 3hbb s ARG 17 Cb 0.00 -3.66 -0.06 0.00 -1.56 0.00 0.00 34.95 29.68 3hbb s ARG 17 CO 0.00 -0.63 1.97 -1.17 -0.81 0.00 0.00 175.30 174.65 3hbb s LEU 18 N 3.14 3.91 -0.05 -0.88 0.20 -1.26 -4.90 118.68 118.85 3hbb s LEU 18 Ca 0.41 2.09 -0.20 0.00 0.69 0.00 0.00 54.13 57.12 3hbb s LEU 18 Cb -0.15 -3.52 -0.14 0.00 -0.43 0.00 0.00 46.19 41.95 3hbb s LEU 18 CO 0.08 -1.45 0.83 0.00 -0.29 0.00 0.00 176.35 175.52 3hbb h ALA 19 N 12.32 -0.27 -3.27 5.97 0.00 -1.94 -3.47 119.26 128.60 3hbb h ALA 19 Ca -0.42 -0.21 -0.34 0.00 0.00 0.00 0.00 54.91 53.94 3hbb h ALA 19 Cb 1.21 0.10 -0.21 0.00 0.00 0.00 0.00 17.79 18.90 3hbb h ALA 19 CO 0.97 -0.33 -0.75 -0.51 0.00 0.00 0.00 179.25 178.62 3hbb s LEU 20 N -9.01 2.27 0.10 0.00 1.43 -1.26 -4.34 118.68 107.86 3hbb s LEU 20 Ca -0.12 -0.59 -0.22 0.00 -1.03 0.00 0.00 54.13 52.18 3hbb s LEU 20 Cb 0.01 -0.33 -0.07 0.00 0.03 0.00 0.00 46.19 45.83 3hbb s LEU 20 CO 0.44 -0.15 0.66 -0.60 0.23 0.00 0.00 176.35 176.93 3hbb s ARG 21 N -1.68 4.36 0.71 1.70 6.06 -0.45 -4.97 118.95 124.68 3hbb s ARG 21 Ca -0.06 0.91 -0.14 0.00 -2.50 0.00 0.00 55.73 53.94 3hbb s ARG 21 Cb -0.10 -3.26 0.03 0.00 0.06 0.00 0.00 34.95 31.68 3hbb s ARG 21 CO 0.01 0.58 1.14 0.00 -2.50 0.00 0.00 175.30 174.53 3hbb s ALA 22 N -1.01 2.28 0.20 6.12 0.00 -1.26 -4.91 121.76 123.19 3hbb s ALA 22 Ca 0.32 0.62 -0.15 0.00 0.00 0.00 0.00 51.96 52.75 3hbb s ALA 22 Cb -0.21 -3.37 0.01 0.00 0.00 0.00 0.00 23.12 19.56 3hbb s ALA 22 CO 0.22 -1.59 0.47 -0.59 0.00 0.00 0.00 175.76 174.27 3hbb s PHE 23 N -2.32 0.08 0.42 0.00 -0.71 -0.10 -4.48 117.98 110.87 3hbb s PHE 23 Ca 0.68 -0.44 0.07 0.00 -1.04 0.00 0.00 56.93 56.20 3hbb s PHE 23 Cb -0.23 0.27 -0.05 0.00 -1.21 0.00 0.00 43.02 41.80 3hbb s PHE 23 CO 0.45 -0.91 0.16 -1.12 -1.34 0.00 0.00 175.22 172.46 3hbb s SER 24 N -2.92 4.35 -0.02 1.98 0.01 -0.03 -0.15 113.70 116.91 3hbb s SER 24 Ca 0.14 -1.13 0.04 0.00 1.31 0.00 0.00 55.95 56.31 3hbb s SER 24 Cb -0.00 -0.44 -0.01 0.00 0.21 0.00 0.00 66.02 65.78 3hbb s SER 24 CO 0.01 -0.54 -0.15 -0.22 0.41 0.00 0.00 173.24 172.74 3hbb s LEU 25 N -3.88 1.97 -0.14 2.44 0.20 0.01 -0.75 118.68 118.51 3hbb s LEU 25 Ca 0.40 -0.28 0.00 0.00 0.69 0.00 0.00 54.13 54.94 3hbb s LEU 25 Cb 0.05 -0.79 0.02 0.00 -0.43 0.00 0.00 46.19 45.04 3hbb s LEU 25 CO 0.22 0.16 -0.12 -0.69 -0.29 0.00 0.00 176.35 175.63 3hbb s VAL 26 N -0.18 1.43 0.07 1.68 1.01 -0.72 0.10 120.40 123.80 3hbb s VAL 26 Ca 0.02 -0.57 0.01 0.00 0.00 0.00 0.00 61.98 61.44 3hbb s VAL 26 Cb -0.08 -1.38 -0.04 0.00 0.00 0.00 0.00 36.38 34.88 3hbb s VAL 26 CO 0.00 0.41 -0.05 0.54 0.00 0.00 0.00 175.10 176.00 3hbb s VAL 27 N 1.54 0.47 -0.07 2.92 0.11 0.06 -4.45 120.40 120.99 3hbb s VAL 27 Ca 0.05 -1.85 0.02 0.00 -2.93 0.00 0.00 61.98 57.26 3hbb s VAL 27 Cb -0.13 -1.57 0.02 0.00 -1.53 0.00 0.00 36.38 33.17 3hbb s VAL 27 CO -0.10 -0.91 -0.11 0.00 -3.33 0.00 0.00 175.10 170.64 3hbb s ALA 28 N -3.68 1.24 0.27 1.54 0.00 -1.26 -1.45 121.76 118.42 3hbb s ALA 28 Ca 0.09 -0.41 0.06 0.00 0.00 0.00 0.00 51.96 51.70 3hbb s ALA 28 Cb 0.06 -0.61 -0.06 0.00 0.00 0.00 0.00 23.12 22.52 3hbb s ALA 28 CO -0.07 0.03 -0.04 0.14 0.00 0.00 0.00 175.76 175.82 3hbb s VAL 29 N 0.82 1.50 0.12 0.00 -7.23 0.55 -4.62 120.40 111.54 3hbb s VAL 29 Ca -0.12 -2.10 0.01 0.00 -1.81 0.00 0.00 61.98 57.96 3hbb s VAL 29 Cb -0.15 -2.45 0.02 0.00 0.56 0.00 0.00 36.38 34.36 3hbb s VAL 29 CO 0.02 -0.29 0.16 -0.90 -0.31 0.00 0.00 175.10 173.78 3hbb n ASP 30 N -0.56 0.31 0.00 4.85 5.75 -0.74 -0.00 116.55 126.17 3hbb n ASP 30 Ca -0.05 -1.24 0.10 0.00 -0.01 0.00 0.00 54.79 53.58 3hbb n ASP 30 Cb 0.64 -0.10 0.45 0.00 -1.03 0.00 0.00 41.12 41.08 3hbb n ASP 30 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 3hbb n GLU 31 N -1.28 0.10 -0.18 0.11 1.02 -1.19 -1.80 120.64 117.42 3hbb n GLU 31 Ca 0.03 0.14 0.09 0.00 -0.02 0.00 0.00 57.16 57.40 3hbb n GLU 31 Cb 0.11 -1.50 0.19 0.00 -0.02 0.00 0.00 31.44 30.21 3hbb n GLU 31 CO 0.00 0.00 0.00 -2.13 1.18 0.00 0.00 177.13 176.18 3hbb n ARG 32 N -1.43 2.33 -0.64 3.49 0.63 -1.26 -4.96 116.66 114.82 3hbb n ARG 32 Ca 0.06 -2.10 0.00 0.00 -0.92 0.00 0.00 57.85 54.90 3hbb n ARG 32 Cb 0.21 -1.40 0.00 0.00 0.45 0.00 0.00 32.46 31.72 3hbb n ARG 32 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 3hbb n GLY 33 N 1.09 1.58 3.77 5.14 0.00 -0.74 -4.92 105.19 111.10 3hbb n GLY 33 Ca 0.16 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.79 3hbb n GLY 33 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3hbb s GLY 34 N -1.97 2.90 -0.01 -0.02 0.00 -1.26 0.77 107.32 107.74 3hbb s GLY 34 Ca 0.00 1.25 0.03 0.00 0.00 0.00 0.00 44.72 46.00 3hbb s GLY 34 CO 0.00 1.81 0.06 0.29 0.00 0.00 0.00 173.10 175.26 3hbb n ILE 35 N -0.11 0.05 -3.61 0.90 -5.35 0.13 -1.79 119.36 109.58 3hbb n ILE 35 Ca 0.05 -0.09 -0.02 0.00 -0.27 0.00 0.00 62.75 62.42 3hbb n ILE 35 Cb 0.44 0.10 -0.02 0.00 -1.74 0.00 0.00 39.64 38.42 3hbb n ILE 35 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 3hbb s GLY 36 N -2.61 -0.30 0.00 3.28 0.00 -1.23 -4.69 107.32 101.78 3hbb s GLY 36 Ca -0.01 1.52 0.07 0.00 0.00 0.00 0.00 44.72 46.30 3hbb s GLY 36 CO 0.13 0.48 1.18 2.09 0.00 0.00 0.00 173.10 176.98 3hbb n ASP 37 N -0.15 0.00 0.00 1.64 5.68 -1.15 -2.41 116.55 120.16 3hbb n ASP 37 Ca -0.00 -1.61 0.00 0.00 -0.50 0.00 0.00 54.79 52.68 3hbb n ASP 37 Cb 0.59 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.57 3hbb n ASP 37 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3hbb n GLY 38 N 0.50 2.75 0.51 6.12 0.00 -1.26 -4.59 105.19 109.22 3hbb n GLY 38 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.07 3hbb n GLY 38 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3hbb n ARG 39 N -2.00 0.00 -3.97 1.61 5.12 -1.26 -5.05 116.66 111.11 3hbb n ARG 39 Ca 0.00 0.00 -0.09 0.00 -1.93 0.00 0.00 57.85 55.83 3hbb n ARG 39 Cb 0.00 -0.74 -0.08 0.00 -1.16 0.00 0.00 32.46 30.48 3hbb n ARG 39 CO 0.00 0.00 0.00 -1.54 -1.93 0.00 0.00 177.63 174.16 3hbb s SER 40 N -4.48 0.16 0.08 0.55 1.04 -1.26 -4.70 113.70 105.08 3hbb s SER 40 Ca 0.00 -0.87 -0.31 0.00 0.48 0.00 0.00 55.95 55.26 3hbb s SER 40 Cb 0.00 0.36 -0.08 0.00 0.10 0.00 0.00 66.02 66.40 3hbb s SER 40 CO 0.00 -0.78 1.56 0.27 0.98 0.00 0.00 173.24 175.27 3hbb s ILE 41 N -3.94 3.13 -0.08 -1.02 -4.36 -1.26 -2.92 121.20 110.75 3hbb s ILE 41 Ca 0.13 0.65 -0.26 0.00 -0.26 0.00 0.00 60.65 60.90 3hbb s ILE 41 Cb 0.05 -3.42 -0.24 0.00 1.25 0.00 0.00 42.46 40.10 3hbb s ILE 41 CO -0.04 0.01 0.97 -0.65 0.24 0.00 0.00 174.94 175.47 3hbb h PRO 42 N 7.83 0.08 -7.33 0.37 0.11 -1.96 -3.47 132.00 127.63 3hbb h PRO 42 Ca -0.42 -0.09 -0.50 0.00 0.11 0.00 0.00 66.00 65.10 3hbb h PRO 42 Cb 1.20 0.03 0.05 0.00 0.11 0.00 0.00 31.00 32.39 3hbb h PRO 42 CO 0.92 0.88 0.41 1.67 -0.21 0.00 0.00 178.00 181.67 3hbb s TRP 43 N -2.96 3.59 -0.31 0.65 -2.14 -1.26 -5.06 118.94 111.44 3hbb s TRP 43 Ca -0.17 1.32 0.01 0.00 2.66 0.00 0.00 56.10 59.92 3hbb s TRP 43 Cb -0.00 -2.74 0.09 0.00 -3.10 0.00 0.00 33.47 27.72 3hbb s TRP 43 CO 0.71 -0.65 0.06 1.21 -2.66 0.00 0.00 176.95 175.63 3hbb s ASN 44 N -3.98 4.21 -0.34 -2.66 3.04 -1.26 -5.07 114.94 108.88 3hbb s ASN 44 Ca 0.56 -1.73 0.01 0.00 0.04 0.00 0.00 52.86 51.74 3hbb s ASN 44 Cb -0.11 -1.14 0.11 0.00 -1.54 0.00 0.00 41.25 38.57 3hbb s ASN 44 CO 0.50 -0.38 0.12 -0.69 -3.04 0.00 0.00 177.10 173.61 3hbb s VAL 45 N 1.37 1.19 0.30 -5.21 1.01 -1.26 -4.82 120.40 112.98 3hbb s VAL 45 Ca 0.08 -1.80 0.04 0.00 0.00 0.00 0.00 61.98 60.31 3hbb s VAL 45 Cb -0.18 -1.88 0.30 0.00 0.00 0.00 0.00 36.38 34.61 3hbb s VAL 45 CO -0.17 -0.72 1.81 -0.65 0.00 0.00 0.00 175.10 175.37 3hbb h PRO 46 N 7.71 0.83 -0.31 2.72 0.11 -1.97 -1.88 132.00 139.20 3hbb h PRO 46 Ca -0.09 -0.05 0.03 0.00 0.11 0.00 0.00 66.00 65.99 3hbb h PRO 46 Cb 1.00 -0.19 -0.02 0.00 0.11 0.00 0.00 31.00 31.90 3hbb h PRO 46 CO 0.48 0.55 0.21 0.93 -0.21 0.00 0.00 178.00 179.95 3hbb h GLU 47 N 0.85 0.30 -0.25 1.05 3.07 -1.96 -1.02 114.58 116.62 3hbb h GLU 47 Ca 0.54 -0.02 -0.12 0.00 -0.50 0.00 0.00 59.36 59.26 3hbb h GLU 47 Cb 0.73 -0.07 -0.00 0.00 -0.84 0.00 0.00 28.75 28.57 3hbb h GLU 47 CO -0.32 0.20 -0.32 0.22 -1.40 0.00 0.00 179.01 177.38 3hbb h ASP 48 N 0.31 0.72 -0.89 1.42 3.58 -1.78 -2.84 116.42 116.93 3hbb h ASP 48 Ca 0.12 -0.50 0.07 0.00 0.42 0.00 0.00 57.03 57.14 3hbb h ASP 48 Cb 0.12 -0.20 -0.06 0.00 1.72 0.00 0.00 39.33 40.90 3hbb h ASP 48 CO -0.03 1.07 0.56 0.24 -2.88 0.00 0.00 179.24 178.20 3hbb h MET 49 N 0.38 0.98 -0.33 0.28 2.86 -1.13 0.21 114.93 118.18 3hbb h MET 49 Ca 0.03 -0.06 -0.02 0.00 -2.06 0.00 0.00 59.70 57.59 3hbb h MET 49 Cb 0.90 -0.22 -0.01 0.00 0.06 0.00 0.00 31.60 32.32 3hbb h MET 49 CO 0.08 0.65 0.13 -0.22 1.06 0.00 0.00 176.91 178.60 3hbb h LYS 50 N 1.01 0.49 -0.49 1.72 3.64 -1.42 -0.50 116.57 121.02 3hbb h LYS 50 Ca 0.39 -0.09 -0.00 0.00 -1.27 0.00 0.00 60.65 59.68 3hbb h LYS 50 Cb 0.19 -0.08 -0.02 0.00 -0.41 0.00 0.00 32.23 31.91 3hbb h LYS 50 CO -0.18 0.50 0.31 0.35 -2.27 0.00 0.00 179.45 178.16 3hbb h PHE 51 N 0.38 0.64 -0.44 1.91 3.57 -1.09 -0.37 116.94 121.54 3hbb h PHE 51 Ca 0.11 0.00 0.04 0.00 3.53 0.00 0.00 57.97 61.65 3hbb h PHE 51 Cb 0.19 -0.21 -0.04 0.00 2.79 0.00 0.00 35.95 38.68 3hbb h PHE 51 CO -0.00 0.43 0.22 0.35 -2.23 0.00 0.00 178.31 177.08 3hbb h PHE 52 N 0.66 0.40 -0.20 0.41 3.57 -0.46 -0.78 116.94 120.55 3hbb h PHE 52 Ca 0.18 0.02 0.01 0.00 3.53 0.00 0.00 57.97 61.70 3hbb h PHE 52 Cb -0.03 -0.12 -0.01 0.00 2.79 0.00 0.00 35.95 38.58 3hbb h PHE 52 CO -0.03 0.21 0.11 -0.09 -2.23 0.00 0.00 178.31 176.28 3hbb h ARG 53 N 0.44 0.23 -0.01 1.11 2.43 -0.72 -2.91 114.38 114.96 3hbb h ARG 53 Ca 0.19 -0.01 -0.00 0.00 -0.81 0.00 0.00 59.98 59.35 3hbb h ARG 53 Cb 0.10 -0.05 -0.00 0.00 -0.42 0.00 0.00 29.97 29.60 3hbb h ARG 53 CO -0.13 0.15 -0.00 -0.44 -1.51 0.00 0.00 179.97 178.03 3hbb h ASP 54 N 0.23 0.01 0.36 -3.80 3.32 -0.74 -0.88 116.42 114.93 3hbb h ASP 54 Ca 0.08 -0.41 -0.05 0.00 0.02 0.00 0.00 57.03 56.67 3hbb h ASP 54 Cb -0.00 -0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.53 3hbb h ASP 54 CO -0.04 0.42 -0.26 1.62 -1.72 0.00 0.00 179.24 179.26 3hbb h VAL 55 N -0.39 1.02 0.00 -1.35 3.04 -1.22 -0.94 116.25 116.40 3hbb h VAL 55 Ca 0.00 -0.93 -0.02 0.00 -1.01 0.00 0.00 66.70 64.74 3hbb h VAL 55 Cb 0.41 1.53 -0.00 0.00 -2.01 0.00 0.00 31.29 31.22 3hbb h VAL 55 CO 0.00 0.25 -1.33 0.35 -1.01 0.00 0.00 177.57 175.84 3hbb n THR 56 N -3.99 0.50 -0.09 3.17 -2.24 -1.10 -4.47 114.28 106.07 3hbb n THR 56 Ca -0.02 -0.55 -0.23 0.00 -2.27 0.00 0.00 64.05 60.98 3hbb n THR 56 Cb 0.33 -0.27 -0.12 0.00 -2.10 0.00 0.00 70.33 68.17 3hbb n THR 56 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 175.07 174.91 3hbb n THR 57 N -2.58 1.58 -1.68 4.28 -1.04 -0.34 -4.66 114.28 109.84 3hbb n THR 57 Ca -0.02 -0.21 -0.38 0.00 -2.04 0.00 0.00 64.05 61.40 3hbb n THR 57 Cb 0.58 -1.94 0.06 0.00 -1.82 0.00 0.00 70.33 67.21 3hbb n THR 57 CO 0.00 0.00 0.00 0.29 -0.64 0.00 0.00 175.07 174.72 3hbb n LYS 58 N -4.19 1.11 -4.39 -2.82 5.02 -0.38 -4.58 118.16 107.93 3hbb n LYS 58 Ca -0.36 0.43 -0.27 0.00 -2.02 0.00 0.00 58.31 56.09 3hbb n LYS 58 Cb 0.79 -2.38 -0.11 0.00 -0.02 0.00 0.00 35.03 33.31 3hbb n LYS 58 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 3hbb s LEU 59 N -3.20 2.55 0.51 -0.35 1.43 -1.26 -4.90 118.68 113.46 3hbb s LEU 59 Ca 0.78 -0.79 -0.23 0.00 -1.03 0.00 0.00 54.13 52.86 3hbb s LEU 59 Cb -0.40 -1.28 -0.06 0.00 0.03 0.00 0.00 46.19 44.47 3hbb s LEU 59 CO 0.45 0.12 1.36 -0.13 0.23 0.00 0.00 176.35 178.38 3hbb s ARG 60 N -2.67 3.36 0.00 1.70 0.52 -1.26 -4.73 118.95 115.87 3hbb s ARG 60 Ca 0.21 2.26 0.00 0.00 -0.52 0.00 0.00 55.73 57.68 3hbb s ARG 60 Cb -0.08 -2.40 0.00 0.00 0.52 0.00 0.00 34.95 32.99 3hbb s ARG 60 CO 0.11 -1.02 0.00 0.41 0.02 0.00 0.00 175.30 174.82 3hbb n GLY 61 N 0.66 0.38 0.00 -3.53 0.00 -1.26 -4.88 105.19 96.57 3hbb n GLY 61 Ca 0.08 -1.38 -0.00 0.00 0.00 0.00 0.00 46.02 44.72 3hbb n GLY 61 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3hbb n LYS 62 N 1.31 -0.00 -3.46 1.61 5.02 -1.26 -3.97 118.16 117.41 3hbb n LYS 62 Ca 0.00 0.29 -0.41 0.00 -2.02 0.00 0.00 58.31 56.16 3hbb n LYS 62 Cb 0.00 -0.43 -0.10 0.00 -0.02 0.00 0.00 35.03 34.48 3hbb n LYS 62 CO 0.00 0.00 0.00 -0.80 -0.52 0.00 0.00 177.40 176.08 3hbb s ASN 63 N -3.05 6.11 0.00 4.39 0.01 -1.26 -5.00 114.94 116.14 3hbb s ASN 63 Ca -0.00 -0.55 0.00 0.00 -0.71 0.00 0.00 52.86 51.60 3hbb s ASN 63 Cb 0.00 -2.17 0.00 0.00 0.41 0.00 0.00 41.25 39.49 3hbb s ASN 63 CO 0.00 -0.36 0.30 0.52 -1.51 0.00 0.00 177.10 176.06 3hbb n VAL 64 N 5.19 0.00 -3.52 1.60 0.31 -1.25 -4.99 118.33 115.66 3hbb n VAL 64 Ca -0.11 0.60 -0.34 0.00 -0.01 0.00 0.00 64.34 64.48 3hbb n VAL 64 Cb 0.49 -1.19 0.03 0.00 -0.91 0.00 0.00 33.84 32.25 3hbb n VAL 64 CO 0.00 0.00 0.00 2.29 -1.32 0.00 0.00 176.83 177.80 3hbb n LYS 65 N -0.73 -1.88 -1.56 5.55 2.85 -1.26 -4.92 118.16 116.21 3hbb n LYS 65 Ca 0.00 1.34 -0.35 0.00 -1.05 0.00 0.00 58.31 58.26 3hbb n LYS 65 Cb 0.00 -2.36 0.08 0.00 -0.65 0.00 0.00 35.03 32.10 3hbb n LYS 65 CO 0.00 0.00 0.00 -2.14 -0.05 0.00 0.00 177.40 175.21 3hbb s PRO 66 N -2.95 2.32 0.32 -1.58 0.02 -1.26 -4.96 135.00 126.91 3hbb s PRO 66 Ca 0.30 1.77 -0.16 0.00 0.02 0.00 0.00 61.00 62.93 3hbb s PRO 66 Cb -0.03 -1.85 0.03 0.00 0.02 0.00 0.00 34.50 32.66 3hbb s PRO 66 CO 0.87 -1.70 0.69 -1.54 -0.33 0.00 0.00 177.00 175.00 3hbb s SER 67 N -1.95 -0.04 0.47 2.53 1.04 -0.11 -4.99 113.70 110.64 3hbb s SER 67 Ca 0.75 -0.93 0.12 0.00 0.48 0.00 0.00 55.95 56.37 3hbb s SER 67 Cb -0.29 0.75 1.07 0.00 0.10 0.00 0.00 66.02 67.65 3hbb s SER 67 CO 0.43 -1.45 2.10 1.55 0.98 0.00 0.00 173.24 176.85 3hbb h PRO 68 N 2.04 0.23 -0.35 4.02 0.13 -1.97 -2.79 132.00 133.32 3hbb h PRO 68 Ca -0.26 -0.02 -0.02 0.00 -0.87 0.00 0.00 66.00 64.83 3hbb h PRO 68 Cb 1.25 -0.05 -0.02 0.00 0.13 0.00 0.00 31.00 32.31 3hbb h PRO 68 CO 0.33 0.17 0.13 0.00 -0.23 0.00 0.00 178.00 178.39 3hbb h ALA 69 N 1.87 0.46 -2.92 -0.56 0.00 -1.96 -3.43 119.26 112.72 3hbb h ALA 69 Ca 0.06 -0.15 -0.30 0.00 0.00 0.00 0.00 54.91 54.52 3hbb h ALA 69 Cb -0.00 -0.14 -0.36 0.00 0.00 0.00 0.00 17.79 17.29 3hbb h ALA 69 CO -0.01 0.08 -0.63 0.21 0.00 0.00 0.00 179.25 178.90 3hbb s LYS 70 N -5.47 0.09 0.19 0.00 2.47 -1.06 -4.46 119.74 111.50 3hbb s LYS 70 Ca -0.13 0.45 -0.24 0.00 -1.56 0.00 0.00 55.97 54.49 3hbb s LYS 70 Cb 0.09 -0.59 0.05 0.00 -1.46 0.00 0.00 37.83 35.92 3hbb s LYS 70 CO 0.75 -0.42 0.85 -0.98 0.16 0.00 0.00 175.35 175.71 3hbb s ARG 71 N 2.30 1.40 0.59 4.03 1.70 -1.13 -0.93 118.95 126.91 3hbb s ARG 71 Ca 0.04 -0.76 -0.02 0.00 -0.47 0.00 0.00 55.73 54.52 3hbb s ARG 71 Cb -0.13 0.49 0.03 0.00 -0.57 0.00 0.00 34.95 34.77 3hbb s ARG 71 CO -0.08 -0.64 0.85 -0.80 -1.08 0.00 0.00 175.30 173.55 3hbb s ASN 72 N -2.91 5.27 -0.06 -2.89 0.01 -1.26 -1.23 114.94 111.88 3hbb s ASN 72 Ca 0.11 0.29 0.03 0.00 -0.71 0.00 0.00 52.86 52.58 3hbb s ASN 72 Cb -0.03 -1.17 0.01 0.00 0.41 0.00 0.00 41.25 40.46 3hbb s ASN 72 CO 0.03 -1.20 -0.14 0.00 -1.51 0.00 0.00 177.10 174.28 3hbb s ALA 73 N -2.91 1.34 -0.17 0.60 0.00 -0.27 -1.15 121.76 119.21 3hbb s ALA 73 Ca 0.56 -0.51 -0.07 0.00 0.00 0.00 0.00 51.96 51.94 3hbb s ALA 73 Cb -0.10 -0.54 -0.04 0.00 0.00 0.00 0.00 23.12 22.44 3hbb s ALA 73 CO 0.41 0.17 0.07 0.14 0.00 0.00 0.00 175.76 176.55 3hbb s VAL 74 N 0.42 4.86 -0.13 0.00 -7.23 0.77 0.40 120.40 119.49 3hbb s VAL 74 Ca -0.11 -0.01 -0.01 0.00 -1.81 0.00 0.00 61.98 60.04 3hbb s VAL 74 Cb -0.14 -3.17 -0.02 0.00 0.56 0.00 0.00 36.38 33.61 3hbb s VAL 74 CO 0.03 0.49 -0.11 -0.69 -0.31 0.00 0.00 175.10 174.52 3hbb s VAL 75 N 0.08 3.27 0.02 1.32 1.01 0.84 -0.40 120.40 126.55 3hbb s VAL 75 Ca 0.06 -0.59 -0.06 0.00 0.00 0.00 0.00 61.98 61.39 3hbb s VAL 75 Cb -0.12 -2.38 -0.01 0.00 0.00 0.00 0.00 36.38 33.87 3hbb s VAL 75 CO 0.01 0.53 0.10 0.00 0.00 0.00 0.00 175.10 175.74 3hbb s MET 76 N 0.21 0.51 0.63 2.72 0.23 0.02 -1.25 119.30 122.37 3hbb s MET 76 Ca -0.07 -0.58 -0.13 0.00 -1.03 0.00 0.00 55.69 53.88 3hbb s MET 76 Cb -0.15 0.21 -0.02 0.00 -1.53 0.00 0.00 34.83 33.34 3hbb s MET 76 CO 0.05 -0.12 1.05 0.20 -2.03 0.00 0.00 175.02 174.16 3hbb s GLY 77 N -1.72 1.89 0.34 3.16 0.00 -1.16 -0.54 107.32 109.29 3hbb s GLY 77 Ca -0.11 0.21 0.05 0.00 0.00 0.00 0.00 44.72 44.87 3hbb s GLY 77 CO -0.01 0.52 1.93 -0.09 0.00 0.00 0.00 173.10 175.44 3hbb h ARG 78 N -0.08 0.81 -0.38 2.90 2.43 -1.67 -2.30 114.38 116.09 3hbb h ARG 78 Ca -0.45 -0.05 -0.12 0.00 -0.81 0.00 0.00 59.98 58.54 3hbb h ARG 78 Cb 1.21 -0.18 -0.01 0.00 -0.42 0.00 0.00 29.97 30.57 3hbb h ARG 78 CO 0.58 0.54 -0.27 0.87 -1.51 0.00 0.00 179.97 180.18 3hbb h LYS 79 N 0.84 0.79 -0.14 0.20 1.57 -1.93 -0.21 116.57 117.69 3hbb h LYS 79 Ca 0.36 -0.34 -0.00 0.00 -1.87 0.00 0.00 60.65 58.79 3hbb h LYS 79 Cb 0.31 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.59 3hbb h LYS 79 CO -0.13 0.97 0.08 1.15 -0.57 0.00 0.00 179.45 180.94 3hbb h THR 80 N 0.68 1.10 -0.12 -0.16 2.02 -1.78 0.03 112.91 114.68 3hbb h THR 80 Ca 0.08 -0.26 0.04 0.00 0.77 0.00 0.00 66.41 67.04 3hbb h THR 80 Cb 0.79 1.02 -0.06 0.00 -1.74 0.00 0.00 68.15 68.16 3hbb h THR 80 CO 0.07 0.09 -0.42 -0.25 0.37 0.00 0.00 175.52 175.37 3hbb h TRP 81 N 0.12 -1.20 -0.95 3.16 2.91 -1.17 -0.94 115.95 117.88 3hbb h TRP 81 Ca 0.05 0.05 0.20 0.00 1.13 0.00 0.00 58.89 60.32 3hbb h TRP 81 Cb 0.07 0.54 -0.08 0.00 -0.51 0.00 0.00 29.16 29.19 3hbb h TRP 81 CO -0.04 -0.48 0.61 -0.44 -1.03 0.00 0.00 178.44 177.06 3hbb h ASP 82 N -0.50 0.55 1.06 2.65 3.32 -0.86 -0.83 116.42 121.79 3hbb h ASP 82 Ca 0.07 0.06 -0.02 0.00 0.02 0.00 0.00 57.03 57.17 3hbb h ASP 82 Cb 0.63 -0.04 -0.00 0.00 0.22 0.00 0.00 39.33 40.14 3hbb h ASP 82 CO -0.39 0.21 -0.08 0.77 -1.72 0.00 0.00 179.24 178.03 3hbb h SER 83 N 0.54 0.00 -3.26 6.45 4.64 0.38 -3.41 113.55 118.89 3hbb h SER 83 Ca 0.51 0.00 -0.59 0.00 -0.47 0.00 0.00 61.79 61.24 3hbb h SER 83 Cb 1.08 0.00 -0.08 0.00 -0.31 0.00 0.00 62.40 63.10 3hbb h SER 83 CO -0.25 0.08 0.49 -0.63 -0.87 0.00 0.00 176.83 175.65 3hbb s ILE 84 N -3.63 4.83 0.24 0.95 1.01 -0.32 -5.03 121.20 119.25 3hbb s ILE 84 Ca 0.01 1.67 -0.31 0.00 0.00 0.00 0.00 60.65 62.02 3hbb s ILE 84 Cb 0.09 -4.16 -0.13 0.00 0.01 0.00 0.00 42.46 38.27 3hbb s ILE 84 CO 0.58 -0.05 1.42 -2.65 0.00 0.00 0.00 174.94 174.25 3hbb n PRO 85 N 5.72 2.05 -0.30 2.79 -0.02 -1.26 -4.83 135.00 139.15 3hbb n PRO 85 Ca 0.06 0.73 0.17 0.00 -2.02 0.00 0.00 63.50 62.44 3hbb n PRO 85 Cb 0.48 -2.40 0.42 0.00 -0.02 0.00 0.00 33.50 31.98 3hbb n PRO 85 CO 0.00 0.00 0.00 -1.00 1.98 0.00 0.00 175.50 176.48 3hbb h PRO 86 N 4.30 0.56 -1.01 0.52 0.13 -1.91 0.11 132.00 134.72 3hbb h PRO 86 Ca -0.45 -0.03 0.33 0.00 -0.87 0.00 0.00 66.00 64.98 3hbb h PRO 86 Cb 1.27 -0.13 -0.15 0.00 0.13 0.00 0.00 31.00 32.13 3hbb h PRO 86 CO 0.76 0.37 0.57 -0.22 -0.23 0.00 0.00 178.00 179.26 3hbb h LYS 87 N 0.58 0.29 -0.35 0.86 3.64 -1.90 -1.07 116.57 118.62 3hbb h LYS 87 Ca 0.53 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.89 3hbb h LYS 87 Cb 1.07 -0.07 0.00 0.00 -0.41 0.00 0.00 32.23 32.83 3hbb h LYS 87 CO -0.28 0.19 0.00 1.19 -2.27 0.00 0.00 179.45 178.28 3hbb n PHE 88 N -5.06 0.45 -3.99 1.91 3.72 0.39 -4.92 117.46 109.96 3hbb n PHE 88 Ca 0.32 -0.22 -0.34 0.00 -0.05 0.00 0.00 57.45 57.15 3hbb n PHE 88 Cb 1.01 0.00 -0.06 0.00 -0.94 0.00 0.00 39.48 39.49 3hbb n PHE 88 CO 0.00 0.00 0.00 1.03 -0.05 0.00 0.00 176.76 177.74 3hbb s ARG 89 N -1.55 3.31 0.59 -1.08 0.52 -0.41 -3.65 118.95 116.68 3hbb s ARG 89 Ca 0.38 -0.31 -0.12 0.00 -0.52 0.00 0.00 55.73 55.15 3hbb s ARG 89 Cb 0.23 -3.04 -0.05 0.00 0.52 0.00 0.00 34.95 32.61 3hbb s ARG 89 CO 0.32 0.70 1.01 -1.25 0.02 0.00 0.00 175.30 176.10 3hbb s PRO 90 N -1.53 3.68 0.02 3.54 0.04 -1.26 -4.96 135.00 134.53 3hbb s PRO 90 Ca 0.21 0.78 -0.33 0.00 0.04 0.00 0.00 61.00 61.71 3hbb s PRO 90 Cb -0.12 -2.10 -0.11 0.00 0.04 0.00 0.00 34.50 32.20 3hbb s PRO 90 CO 0.12 -0.48 1.84 1.28 0.04 0.00 0.00 177.00 179.79 3hbb n LEU 91 N -2.45 3.64 -4.70 -3.56 4.77 -1.24 -4.91 117.00 108.56 3hbb n LEU 91 Ca 0.06 0.98 -0.39 0.00 -0.03 0.00 0.00 56.01 56.63 3hbb n LEU 91 Cb 0.54 -1.44 0.03 0.00 -2.33 0.00 0.00 43.42 40.22 3hbb n LEU 91 CO 0.55 0.00 0.86 -2.65 -1.33 0.00 0.00 177.39 174.82 3hbb n PRO 92 N 6.10 1.66 -0.79 3.23 -0.02 -1.26 -3.64 135.00 140.27 3hbb n PRO 92 Ca 0.20 0.60 0.00 0.00 -2.02 0.00 0.00 63.50 62.29 3hbb n PRO 92 Cb 0.33 -2.42 0.00 0.00 -0.02 0.00 0.00 33.50 31.39 3hbb n PRO 92 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3hbb n GLY 93 N 0.87 1.21 3.20 -1.23 0.00 -1.26 -4.97 105.19 103.02 3hbb n GLY 93 Ca 0.09 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.02 3hbb n GLY 93 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 3hbb s ARG 94 N -0.08 0.82 -0.06 1.61 1.70 -1.24 -4.43 118.95 117.27 3hbb s ARG 94 Ca 0.00 -0.88 -0.30 0.00 -0.47 0.00 0.00 55.73 54.08 3hbb s ARG 94 Cb 0.00 0.34 -0.04 0.00 -0.57 0.00 0.00 34.95 34.68 3hbb s ARG 94 CO 0.00 -0.26 1.32 -1.17 -1.08 0.00 0.00 175.30 174.11 3hbb s LEU 95 N -2.70 4.27 -0.49 -1.89 0.20 -0.30 -4.81 118.68 112.96 3hbb s LEU 95 Ca 0.03 1.92 -0.18 0.00 0.69 0.00 0.00 54.13 56.59 3hbb s LEU 95 Cb 0.04 -3.55 0.06 0.00 -0.43 0.00 0.00 46.19 42.30 3hbb s LEU 95 CO -0.10 -0.70 0.53 0.20 -0.29 0.00 0.00 176.35 176.00 3hbb s ASN 96 N 1.88 6.19 -0.26 3.68 0.02 -0.33 -0.16 114.94 125.96 3hbb s ASN 96 Ca 0.60 -1.04 -0.11 0.00 -1.02 0.00 0.00 52.86 51.28 3hbb s ASN 96 Cb -0.27 -2.25 -0.05 0.00 0.02 0.00 0.00 41.25 38.71 3hbb s ASN 96 CO 0.22 -0.78 0.20 -0.69 0.02 0.00 0.00 177.10 176.07 3hbb s VAL 97 N 2.24 5.31 -0.13 1.60 1.01 0.47 -1.09 120.40 129.81 3hbb s VAL 97 Ca 0.11 0.23 0.00 0.00 0.00 0.00 0.00 61.98 62.32 3hbb s VAL 97 Cb -0.21 -3.54 -0.01 0.00 0.00 0.00 0.00 36.38 32.62 3hbb s VAL 97 CO 0.10 0.28 -0.14 -0.69 0.00 0.00 0.00 175.10 174.65 3hbb s VAL 98 N 1.50 2.91 -0.27 2.92 1.01 -0.58 -0.80 120.40 127.09 3hbb s VAL 98 Ca 0.08 -0.71 -0.18 0.00 0.00 0.00 0.00 61.98 61.18 3hbb s VAL 98 Cb -0.15 -2.22 -0.02 0.00 0.00 0.00 0.00 36.38 33.99 3hbb s VAL 98 CO 0.08 0.53 0.52 -0.76 0.00 0.00 0.00 175.10 175.47 3hbb s LEU 99 N 0.41 4.07 -0.09 3.92 1.43 0.30 -0.72 118.68 128.01 3hbb s LEU 99 Ca -0.11 0.48 -0.30 0.00 -1.03 0.00 0.00 54.13 53.17 3hbb s LEU 99 Cb -0.16 -2.66 0.09 0.00 0.03 0.00 0.00 46.19 43.48 3hbb s LEU 99 CO 0.05 -0.31 0.77 -0.55 0.23 0.00 0.00 176.35 176.54 3hbb s SER 100 N 1.56 -0.59 -0.04 2.29 0.15 -0.77 -1.63 113.70 114.69 3hbb s SER 100 Ca 0.21 0.69 0.16 0.00 0.70 0.00 0.00 55.95 57.71 3hbb s SER 100 Cb -0.16 0.54 -0.24 0.00 -1.71 0.00 0.00 66.02 64.45 3hbb s SER 100 CO 0.09 -0.51 0.32 -1.54 1.20 0.00 0.00 173.24 172.80 3hbb n SER 101 N 1.00 1.33 -0.03 5.45 3.41 -1.26 -3.59 113.62 119.93 3hbb n SER 101 Ca -0.16 0.00 -0.18 0.00 -0.26 0.00 0.00 58.87 58.26 3hbb n SER 101 Cb 0.57 1.64 -0.14 0.00 -0.26 0.00 0.00 64.21 66.03 3hbb n SER 101 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 3hbb n THR 102 N -2.11 1.68 -3.21 6.66 -2.24 -1.26 -4.92 114.28 108.87 3hbb n THR 102 Ca -0.05 -0.67 -0.39 0.00 -2.27 0.00 0.00 64.05 60.67 3hbb n THR 102 Cb 0.48 -1.50 -0.06 0.00 -2.10 0.00 0.00 70.33 67.15 3hbb n THR 102 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 3hbb s LEU 103 N -6.71 4.22 0.46 3.22 2.01 -1.26 -5.07 118.68 115.55 3hbb s LEU 103 Ca -0.22 0.83 0.03 0.00 0.01 0.00 0.00 54.13 54.79 3hbb s LEU 103 Cb 0.07 -2.80 0.01 0.00 0.01 0.00 0.00 46.19 43.49 3hbb s LEU 103 CO 0.75 -0.13 0.66 0.42 1.01 0.00 0.00 176.35 179.06 3hbb s THR 104 N 1.22 3.26 0.48 5.49 -4.23 -1.26 -4.70 115.64 115.90 3hbb s THR 104 Ca 0.28 -0.75 0.25 0.00 -1.18 0.00 0.00 61.69 60.28 3hbb s THR 104 Cb -0.16 -3.17 0.29 0.00 1.34 0.00 0.00 72.50 70.80 3hbb s THR 104 CO 0.11 -0.10 2.12 0.00 -0.54 0.00 0.00 174.62 176.21 3hbb h THR 105 N 0.40 0.69 0.24 3.99 1.03 -1.94 -1.53 112.91 115.80 3hbb h THR 105 Ca -0.43 -0.35 -0.33 0.00 -0.01 0.00 0.00 66.41 65.29 3hbb h THR 105 Cb 1.28 1.21 0.04 0.00 -1.07 0.00 0.00 68.15 69.61 3hbb h THR 105 CO 0.52 0.09 -1.47 -0.61 -0.01 0.00 0.00 175.52 174.04 3hbb h GLN 106 N 0.00 0.52 0.00 0.00 5.75 -1.94 -2.90 115.11 116.54 3hbb h GLN 106 Ca -0.00 -0.88 -0.07 0.00 -0.15 0.00 0.00 58.65 57.54 3hbb h GLN 106 Cb 0.21 0.33 -0.01 0.00 1.07 0.00 0.00 27.48 29.08 3hbb h GLN 106 CO 0.01 1.42 -0.33 0.45 -2.65 0.00 0.00 178.83 177.73 3hbb h HIS 107 N 0.14 0.00 -0.06 3.99 3.86 -1.76 -2.25 115.15 119.07 3hbb h HIS 107 Ca -0.25 0.00 -0.19 0.00 -1.16 0.00 0.00 60.37 58.78 3hbb h HIS 107 Cb 2.16 0.00 0.01 0.00 1.06 0.00 0.00 27.41 30.64 3hbb h HIS 107 CO 0.12 0.33 -0.69 -0.07 0.86 0.00 0.00 177.93 178.49 3hbb h LEU 108 N 0.00 0.71 -1.92 2.43 3.38 -1.40 -3.15 115.31 115.36 3hbb h LEU 108 Ca -0.00 -0.69 0.16 0.00 0.09 0.00 0.00 57.88 57.43 3hbb h LEU 108 Cb 0.64 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 41.15 3hbb h LEU 108 CO 0.04 1.30 0.41 0.25 0.09 0.00 0.00 178.44 180.54 3hbb h LEU 109 N 0.18 0.08 -7.75 1.67 5.85 -1.28 -3.26 115.31 110.80 3hbb h LEU 109 Ca -0.07 0.00 -0.78 0.00 0.84 0.00 0.00 57.88 57.88 3hbb h LEU 109 Cb 1.35 -0.01 -0.25 0.00 0.37 0.00 0.00 40.66 42.12 3hbb h LEU 109 CO 0.14 0.04 0.43 -1.81 -0.34 0.00 0.00 178.44 176.90 3hbb s ASP 110 N -6.15 6.97 0.00 1.25 1.11 -0.87 -4.56 116.67 114.42 3hbb s ASP 110 Ca -0.06 -2.95 0.00 0.00 0.18 0.00 0.00 52.55 49.72 3hbb s ASP 110 Cb 0.20 -2.25 0.00 0.00 1.07 0.00 0.00 42.92 41.94 3hbb s ASP 110 CO 0.74 -0.55 0.00 0.61 1.18 0.00 0.00 175.17 177.15 3hbb n GLY 111 N 3.74 0.00 0.51 0.21 0.00 -1.23 -4.90 105.19 103.51 3hbb n GLY 111 Ca 0.21 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.23 3hbb n GLY 111 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3hbb n LEU 112 N 0.00 0.00 0.00 0.99 4.77 -1.26 -4.90 117.00 116.60 3hbb n LEU 112 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 3hbb n LEU 112 Cb 0.00 -0.24 0.00 0.00 -2.33 0.00 0.00 43.42 40.85 3hbb n LEU 112 CO 0.00 -0.50 0.00 -0.81 -1.33 0.00 0.00 177.39 174.75 3hbb n PRO 113 N -2.50 3.32 -1.11 3.23 -0.04 -1.26 -4.62 135.00 132.03 3hbb n PRO 113 Ca 0.00 0.00 0.01 0.00 -0.04 0.00 0.00 63.50 63.47 3hbb n PRO 113 Cb 0.00 0.00 -0.01 0.00 -0.04 0.00 0.00 33.50 33.45 3hbb n PRO 113 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 3hbb n ASP 114 N 0.00 -5.99 -4.12 3.54 9.92 -1.26 -5.15 116.55 113.50 3hbb n ASP 114 Ca 0.00 1.31 -0.29 0.00 -0.53 0.00 0.00 54.79 55.28 3hbb n ASP 114 Cb 0.00 -3.36 0.19 0.00 -0.64 0.00 0.00 41.12 37.30 3hbb n ASP 114 CO 0.00 0.00 0.00 -0.70 0.13 0.00 0.00 177.20 176.63 3hbb s GLU 115 N -4.90 0.62 0.00 -1.24 -6.30 -1.26 -5.12 118.70 100.50 3hbb s GLU 115 Ca 0.00 -0.50 0.00 0.00 -2.50 0.00 0.00 54.97 51.97 3hbb s GLU 115 Cb 0.00 -1.88 0.00 0.00 0.00 0.00 0.00 34.13 32.25 3hbb s GLU 115 CO 0.00 -2.40 0.00 -2.39 0.02 0.00 0.00 175.26 170.49 3hbb n HIS 121 N -3.73 0.00 0.00 5.30 -0.00 -1.26 -5.22 115.22 110.31 3hbb n HIS 121 Ca 0.16 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.88 3hbb n HIS 121 Cb 0.59 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 30.58 3hbb n HIS 121 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 3hbb n ALA 122 N 0.00 0.00 -1.59 1.59 0.00 -1.26 -4.30 120.51 114.95 3hbb n ALA 122 Ca 0.00 0.00 -0.47 0.00 0.00 0.00 0.00 53.44 52.97 3hbb n ALA 122 Cb 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.42 3hbb n ALA 122 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 3hbb n ASP 123 N 0.00 1.56 -1.73 0.00 2.03 -1.26 -4.94 116.55 112.20 3hbb n ASP 123 Ca 0.00 1.15 -0.02 0.00 0.52 0.00 0.00 54.79 56.44 3hbb n ASP 123 Cb 0.00 -1.26 0.01 0.00 -0.72 0.00 0.00 41.12 39.15 3hbb n ASP 123 CO 0.00 0.00 0.00 -1.54 -1.92 0.00 0.00 177.20 173.74 3hbb n SER 124 N 1.90 -0.16 -3.64 1.67 3.41 -1.26 -5.03 113.62 110.50 3hbb n SER 124 Ca 0.13 -2.05 -0.25 0.00 -0.26 0.00 0.00 58.87 56.45 3hbb n SER 124 Cb 0.27 0.10 -0.17 0.00 -0.26 0.00 0.00 64.21 64.14 3hbb n SER 124 CO 0.00 0.00 0.00 -0.51 -0.16 0.00 0.00 175.04 174.37 3hbb s ILE 125 N -0.52 -0.01 -0.01 -1.33 1.10 -1.26 -1.19 121.20 117.97 3hbb s ILE 125 Ca 0.15 -0.08 0.07 0.00 -0.51 0.00 0.00 60.65 60.29 3hbb s ILE 125 Cb 0.24 -0.54 -0.02 0.00 0.15 0.00 0.00 42.46 42.30 3hbb s ILE 125 CO -0.08 -0.16 -0.23 0.54 -2.11 0.00 0.00 174.94 172.90 3hbb s VAL 126 N 2.11 1.83 -0.10 4.00 0.11 -0.25 -4.97 120.40 123.13 3hbb s VAL 126 Ca 0.02 -1.00 -0.04 0.00 -2.93 0.00 0.00 61.98 58.03 3hbb s VAL 126 Cb -0.15 -1.52 -0.04 0.00 -1.53 0.00 0.00 36.38 33.14 3hbb s VAL 126 CO -0.08 0.51 0.06 0.00 -3.33 0.00 0.00 175.10 172.26 3hbb s ALA 127 N -0.56 3.52 -0.16 1.54 0.00 -1.26 -1.53 121.76 123.31 3hbb s ALA 127 Ca 0.09 -0.74 -0.00 0.00 0.00 0.00 0.00 51.96 51.31 3hbb s ALA 127 Cb -0.09 -1.67 0.00 0.00 0.00 0.00 0.00 23.12 21.36 3hbb s ALA 127 CO -0.01 0.60 -0.15 0.08 0.00 0.00 0.00 175.76 176.29 3hbb s VAL 128 N -0.94 2.64 -1.17 0.00 1.01 0.11 -4.71 120.40 117.34 3hbb s VAL 128 Ca 0.14 -0.77 -0.19 0.00 0.00 0.00 0.00 61.98 61.17 3hbb s VAL 128 Cb -0.12 -2.12 0.09 0.00 0.00 0.00 0.00 36.38 34.23 3hbb s VAL 128 CO 0.03 0.51 1.53 0.21 0.00 0.00 0.00 175.10 177.38 3hbb s ASN 129 N 0.95 6.77 0.00 3.32 2.47 -1.24 -1.84 114.94 125.38 3hbb s ASN 129 Ca -0.03 -2.25 0.00 0.00 0.42 0.00 0.00 52.86 51.00 3hbb s ASN 129 Cb -0.15 -2.52 0.00 0.00 -1.45 0.00 0.00 41.25 37.13 3hbb s ASN 129 CO -0.02 -1.16 0.00 0.61 -3.72 0.00 0.00 177.10 172.81 3hbb n GLY 130 N 5.54 -1.60 0.00 1.21 0.00 -1.26 -4.99 105.19 104.09 3hbb n GLY 130 Ca 0.40 -1.27 0.00 0.00 0.00 0.00 0.00 46.02 45.15 3hbb n GLY 130 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hbb n GLY 131 N -0.19 0.47 0.23 -0.02 0.00 -1.26 -4.40 105.19 100.02 3hbb n GLY 131 Ca 0.00 -1.86 0.05 0.00 0.00 0.00 0.00 46.02 44.21 3hbb n GLY 131 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3hbb h LEU 132 N 0.00 0.02 -0.42 0.99 5.85 -1.96 -1.99 115.31 117.81 3hbb h LEU 132 Ca 0.00 -0.00 -0.03 0.00 0.84 0.00 0.00 57.88 58.68 3hbb h LEU 132 Cb 0.00 -0.01 -0.02 0.00 0.37 0.00 0.00 40.66 41.01 3hbb h LEU 132 CO 0.00 0.18 0.14 -0.08 -0.34 0.00 0.00 178.44 178.34 3hbb h GLU 133 N 0.02 0.64 -0.40 1.25 4.81 -1.95 0.03 114.58 118.99 3hbb h GLU 133 Ca 0.00 -0.14 -0.08 0.00 -0.13 0.00 0.00 59.36 59.02 3hbb h GLU 133 Cb 0.29 -0.09 -0.02 0.00 0.63 0.00 0.00 28.75 29.56 3hbb h GLU 133 CO 0.02 0.63 -0.07 1.96 -0.73 0.00 0.00 179.01 180.82 3hbb h GLN 134 N 0.53 0.68 -0.23 1.92 7.50 -1.77 -1.26 115.11 122.48 3hbb h GLN 134 Ca 0.14 -0.20 -0.08 0.00 0.50 0.00 0.00 58.65 59.01 3hbb h GLN 134 Cb 0.25 -0.07 -0.01 0.00 0.05 0.00 0.00 27.48 27.70 3hbb h GLN 134 CO -0.01 0.75 -0.16 0.00 -1.50 0.00 0.00 178.83 177.92 3hbb h ALA 135 N 1.29 0.33 0.00 3.87 0.00 -1.13 -2.29 119.26 121.33 3hbb h ALA 135 Ca 0.12 -0.33 -0.06 0.00 0.00 0.00 0.00 54.91 54.64 3hbb h ALA 135 Cb 0.50 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.20 3hbb h ALA 135 CO 0.03 0.23 -0.29 -0.07 0.00 0.00 0.00 179.25 179.14 3hbb h LEU 136 N 0.22 0.00 -0.06 0.00 3.38 -0.82 -0.08 115.31 117.96 3hbb h LEU 136 Ca 0.05 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.00 3hbb h LEU 136 Cb 0.68 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.43 3hbb h LEU 136 CO 0.04 0.29 -0.03 -0.61 0.09 0.00 0.00 178.44 178.23 3hbb h GLN 137 N 0.00 0.12 -0.38 1.13 4.15 -1.20 -1.11 115.11 117.82 3hbb h GLN 137 Ca -0.00 -0.05 0.01 0.00 0.77 0.00 0.00 58.65 59.37 3hbb h GLN 137 Cb 0.65 -0.00 -0.02 0.00 0.21 0.00 0.00 27.48 28.31 3hbb h GLN 137 CO 0.04 0.50 0.24 1.25 -1.93 0.00 0.00 178.83 178.93 3hbb h LEU 138 N -0.26 0.40 0.00 -2.39 5.85 -0.99 -2.19 115.31 115.74 3hbb h LEU 138 Ca 0.01 -0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.73 3hbb h LEU 138 Cb 0.46 -0.09 0.00 0.00 0.37 0.00 0.00 40.66 41.40 3hbb h LEU 138 CO 0.01 0.29 0.00 0.18 -0.34 0.00 0.00 178.44 178.58 3hbb n LEU 139 N -4.84 0.00 0.05 2.25 4.77 -0.08 -1.21 117.00 117.94 3hbb n LEU 139 Ca 0.00 0.25 0.12 0.00 -0.03 0.00 0.00 56.01 56.35 3hbb n LEU 139 Cb 0.04 -0.25 0.23 0.00 -2.33 0.00 0.00 43.42 41.11 3hbb n LEU 139 CO 0.34 -0.14 0.44 0.00 -1.33 0.00 0.00 177.39 176.70 3hbb n ALA 140 N -1.25 2.96 -1.16 -1.18 0.00 -0.82 -3.76 120.51 115.30 3hbb n ALA 140 Ca 0.07 -0.24 -0.35 0.00 0.00 0.00 0.00 53.44 52.92 3hbb n ALA 140 Cb 0.10 -1.20 0.10 0.00 0.00 0.00 0.00 19.45 18.45 3hbb n ALA 140 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 3hbb n SER 141 N -1.98 -0.29 0.25 0.00 7.64 -0.35 -4.61 113.62 114.29 3hbb n SER 141 Ca 0.04 0.57 0.17 0.00 1.01 0.00 0.00 58.87 60.66 3hbb n SER 141 Cb 0.41 -1.35 0.90 0.00 -1.01 0.00 0.00 64.21 63.16 3hbb n SER 141 CO 0.00 0.00 0.00 1.55 -3.01 0.00 0.00 175.04 173.58 3hbb h PRO 142 N -0.69 0.00 0.00 1.43 0.13 -1.89 0.13 132.00 131.10 3hbb h PRO 142 Ca -0.46 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.66 3hbb h PRO 142 Cb 1.32 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.45 3hbb h PRO 142 CO 0.43 0.00 -0.06 -0.91 -0.23 0.00 0.00 178.00 177.23 3hbb h ASN 143 N 0.00 0.00 0.00 1.44 4.21 -1.91 -3.37 115.58 115.96 3hbb h ASN 143 Ca 0.00 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.51 3hbb h ASN 143 Cb 0.06 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.26 3hbb h ASN 143 CO 0.00 0.06 -0.81 -1.22 -1.29 0.00 0.00 177.43 174.18 3hbb n TYR 144 N -3.14 0.00 -3.97 1.19 4.01 -0.80 -4.77 117.16 109.67 3hbb n TYR 144 Ca 0.02 0.00 -0.35 0.00 -0.16 0.00 0.00 57.90 57.41 3hbb n TYR 144 Cb 0.43 0.00 -0.14 0.00 -0.31 0.00 0.00 39.34 39.33 3hbb n TYR 144 CO 0.00 0.00 0.00 0.99 -0.46 0.00 0.00 176.86 177.39 3hbb s THR 145 N -1.73 3.56 -0.32 -0.72 2.01 0.39 0.52 115.64 119.35 3hbb s THR 145 Ca 0.00 -0.43 0.09 0.00 0.31 0.00 0.00 61.69 61.66 3hbb s THR 145 Cb 0.00 -2.62 0.62 0.00 0.01 0.00 0.00 72.50 70.51 3hbb s THR 145 CO 0.00 0.42 1.67 -0.81 -0.69 0.00 0.00 174.62 175.22 3hbb n PRO 146 N 4.63 2.65 -0.23 4.92 -0.04 -1.26 -4.27 135.00 141.39 3hbb n PRO 146 Ca -0.18 -3.07 -0.05 0.00 -0.04 0.00 0.00 63.50 60.16 3hbb n PRO 146 Cb 0.51 -2.03 0.10 0.00 -0.04 0.00 0.00 33.50 32.05 3hbb n PRO 146 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 3hbb h SER 147 N 1.60 1.00 -3.47 3.54 4.64 -1.68 -3.38 113.55 115.79 3hbb h SER 147 Ca 0.31 -0.17 -0.58 0.00 -0.47 0.00 0.00 61.79 60.88 3hbb h SER 147 Cb 2.13 -0.26 -0.08 0.00 -0.31 0.00 0.00 62.40 63.89 3hbb h SER 147 CO 0.65 0.92 0.75 -0.63 -0.87 0.00 0.00 176.83 177.65 3hbb s ILE 148 N -5.40 4.48 -0.02 0.95 -1.09 0.18 -2.82 121.20 117.49 3hbb s ILE 148 Ca -0.11 1.38 -0.23 0.00 -2.23 0.00 0.00 60.65 59.46 3hbb s ILE 148 Cb 0.15 -4.42 -0.21 0.00 -1.58 0.00 0.00 42.46 36.41 3hbb s ILE 148 CO 0.83 -0.61 1.14 -0.08 -1.23 0.00 0.00 174.94 174.99 3hbb h GLU 149 N 8.50 0.25 -3.65 2.79 4.81 -1.36 -3.45 114.58 122.46 3hbb h GLU 149 Ca -0.22 -0.21 -0.33 0.00 -0.13 0.00 0.00 59.36 58.47 3hbb h GLU 149 Cb 1.07 0.05 -0.34 0.00 0.63 0.00 0.00 28.75 30.15 3hbb h GLU 149 CO 1.03 0.87 -0.74 0.99 -0.73 0.00 0.00 179.01 180.43 3hbb s THR 150 N -3.53 0.10 -0.07 0.32 2.01 -1.26 -4.52 115.64 108.69 3hbb s THR 150 Ca -0.15 0.13 -0.21 0.00 0.31 0.00 0.00 61.69 61.78 3hbb s THR 150 Cb 0.02 -0.21 -0.04 0.00 0.01 0.00 0.00 72.50 72.28 3hbb s THR 150 CO 0.75 0.13 0.58 -0.69 -0.69 0.00 0.00 174.62 174.70 3hbb s VAL 151 N 1.06 5.07 -0.13 3.82 1.01 -1.26 -1.11 120.40 128.85 3hbb s VAL 151 Ca -0.09 1.20 0.02 0.00 0.00 0.00 0.00 61.98 63.11 3hbb s VAL 151 Cb -0.13 -3.92 0.01 0.00 0.00 0.00 0.00 36.38 32.34 3hbb s VAL 151 CO -0.02 0.33 -0.20 -0.31 0.00 0.00 0.00 175.10 174.90 3hbb s TYR 152 N 0.44 2.46 -0.38 5.22 2.02 0.16 -0.85 117.35 126.43 3hbb s TYR 152 Ca 0.31 -1.23 -0.22 0.00 -0.37 0.00 0.00 57.07 55.57 3hbb s TYR 152 Cb -0.17 -1.70 0.01 0.00 -0.40 0.00 0.00 41.96 39.70 3hbb s TYR 152 CO 0.15 -0.58 0.71 0.00 -1.57 0.00 0.00 175.55 174.26 3hbb n ILE 154 N 5.74 2.23 0.00 0.00 -5.35 -0.38 -1.75 119.36 119.85 3hbb n ILE 154 Ca 0.01 -1.89 0.00 0.00 -0.27 0.00 0.00 62.75 60.59 3hbb n ILE 154 Cb 0.48 -0.24 0.00 0.00 -1.74 0.00 0.00 39.64 38.15 3hbb n ILE 154 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3hbb n GLY 155 N -0.56 1.49 0.00 3.28 0.00 -1.25 -4.92 105.19 103.22 3hbb n GLY 155 Ca 0.21 -1.89 0.00 0.00 0.00 0.00 0.00 46.02 44.34 3hbb n GLY 155 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hbb n GLY 156 N -1.98 2.38 0.19 -0.02 0.00 -1.26 -3.01 105.19 101.49 3hbb n GLY 156 Ca 0.00 -0.72 0.08 0.00 0.00 0.00 0.00 46.02 45.38 3hbb n GLY 156 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hbb n GLY 157 N 0.07 -0.75 0.30 -0.02 0.00 -1.26 0.25 105.19 103.78 3hbb n GLY 157 Ca 0.00 0.54 -0.06 0.00 0.00 0.00 0.00 46.02 46.50 3hbb n GLY 157 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3hbb h SER 158 N 0.00 0.86 -0.13 1.61 4.64 -1.96 0.41 113.55 118.98 3hbb h SER 158 Ca 0.33 -0.21 -0.04 0.00 -0.47 0.00 0.00 61.79 61.40 3hbb h SER 158 Cb 0.68 -0.23 -0.00 0.00 -0.31 0.00 0.00 62.40 62.54 3hbb h SER 158 CO -0.52 0.91 -0.07 0.58 -0.87 0.00 0.00 176.83 176.86 3hbb h VAL 159 N 0.83 1.32 -0.57 0.95 2.07 0.32 -2.63 116.25 118.53 3hbb h VAL 159 Ca 0.16 -1.11 0.08 0.00 0.82 0.00 0.00 66.70 66.65 3hbb h VAL 159 Cb 0.47 1.78 -0.06 0.00 -1.52 0.00 0.00 31.29 31.95 3hbb h VAL 159 CO 0.02 0.32 0.22 1.88 0.02 0.00 0.00 177.57 180.03 3hbb h TYR 160 N -0.07 0.39 -0.74 1.57 0.05 -0.81 0.21 116.97 117.57 3hbb h TYR 160 Ca 0.03 0.03 0.07 0.00 0.05 0.00 0.00 58.73 58.90 3hbb h TYR 160 Cb 0.54 -0.09 -0.06 0.00 1.01 0.00 0.00 36.73 38.13 3hbb h TYR 160 CO 0.07 0.12 0.42 0.00 -1.05 0.00 0.00 178.16 177.72 3hbb h ALA 161 N 1.38 1.01 -0.09 3.88 0.00 -0.85 -1.59 119.26 123.00 3hbb h ALA 161 Ca 0.28 0.01 -0.16 0.00 0.00 0.00 0.00 54.91 55.05 3hbb h ALA 161 Cb 0.31 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 3hbb h ALA 161 CO -0.27 0.11 -0.63 1.49 0.00 0.00 0.00 179.25 179.95 3hbb h GLU 162 N 0.77 0.33 0.00 0.00 4.81 -1.08 -3.05 114.58 116.36 3hbb h GLU 162 Ca 0.33 -0.23 -0.04 0.00 -0.13 0.00 0.00 59.36 59.29 3hbb h GLU 162 Cb 0.21 0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.63 3hbb h GLU 162 CO -0.19 0.85 -0.17 0.00 -0.73 0.00 0.00 179.01 178.77 3hbb h ALA 163 N 1.09 1.68 -0.54 2.92 0.00 -0.07 -2.66 119.26 121.69 3hbb h ALA 163 Ca -0.01 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.75 3hbb h ALA 163 Cb 1.15 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.92 3hbb h ALA 163 CO 0.10 0.21 0.00 1.28 0.00 0.00 0.00 179.25 180.85 3hbb n LEU 164 N -4.28 5.27 -4.11 0.00 4.77 -0.68 -2.78 117.00 115.18 3hbb n LEU 164 Ca -0.02 -2.85 -0.20 0.00 -0.03 0.00 0.00 56.01 52.90 3hbb n LEU 164 Cb 0.24 -0.64 -0.14 0.00 -2.33 0.00 0.00 43.42 40.55 3hbb n LEU 164 CO 0.36 0.67 -0.46 -0.60 -1.33 0.00 0.00 177.39 176.03 3hbb s ARG 165 N -2.60 0.93 0.56 3.23 3.52 -1.00 -4.85 118.95 118.73 3hbb s ARG 165 Ca 0.52 -0.61 -0.21 0.00 -0.13 0.00 0.00 55.73 55.30 3hbb s ARG 165 Cb 0.39 -0.91 -0.04 0.00 -1.56 0.00 0.00 34.95 32.83 3hbb s ARG 165 CO 0.16 0.23 1.35 -2.14 -0.81 0.00 0.00 175.30 174.09 3hbb s PRO 166 N -0.77 3.08 0.18 5.12 0.02 -1.26 -2.06 135.00 139.30 3hbb s PRO 166 Ca 0.02 2.20 0.25 0.00 0.02 0.00 0.00 61.00 63.50 3hbb s PRO 166 Cb -0.06 -2.21 0.53 0.00 0.02 0.00 0.00 34.50 32.78 3hbb s PRO 166 CO 0.00 -1.23 1.52 -1.00 -0.33 0.00 0.00 177.00 175.96 3hbb h PRO 167 N 1.35 0.00 -0.86 5.54 0.13 -1.99 -3.46 132.00 132.71 3hbb h PRO 167 Ca -0.51 0.00 0.03 0.00 -0.87 0.00 0.00 66.00 64.65 3hbb h PRO 167 Cb 1.30 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.38 3hbb h PRO 167 CO 0.57 0.00 0.56 0.00 -0.23 0.00 0.00 178.00 178.90 3hbb h VAL 169 N 1.09 0.96 0.00 0.00 3.04 -1.26 0.19 116.25 120.27 3hbb h VAL 169 Ca 0.34 -0.12 0.00 0.00 -1.01 0.00 0.00 66.70 65.91 3hbb h VAL 169 Cb -0.02 0.58 0.00 0.00 -2.01 0.00 0.00 31.29 29.85 3hbb h VAL 169 CO -0.11 0.06 0.00 1.41 -1.01 0.00 0.00 177.57 177.92 3hbb n HIS 170 N -4.47 0.00 0.24 3.17 8.25 -1.13 -1.44 115.22 119.83 3hbb n HIS 170 Ca 0.06 0.00 0.05 0.00 -0.26 0.00 0.00 57.72 57.57 3hbb n HIS 170 Cb 0.26 -0.34 0.07 0.00 1.12 0.00 0.00 29.99 31.10 3hbb n HIS 170 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 3hbb n LEU 171 N -1.34 2.17 -4.61 2.41 4.77 0.66 -4.96 117.00 116.10 3hbb n LEU 171 Ca 0.05 -1.32 -0.42 0.00 -0.03 0.00 0.00 56.01 54.28 3hbb n LEU 171 Cb 0.11 -0.07 -0.04 0.00 -2.33 0.00 0.00 43.42 41.09 3hbb n LEU 171 CO 0.10 0.47 0.75 -0.22 -1.33 0.00 0.00 177.39 177.15 3hbb s LEU 172 N -0.90 4.01 -0.06 2.23 2.96 -0.52 -0.93 118.68 125.47 3hbb s LEU 172 Ca 0.15 0.69 0.18 0.00 -0.22 0.00 0.00 54.13 54.93 3hbb s LEU 172 Cb 0.09 -3.26 -0.23 0.00 0.50 0.00 0.00 46.19 43.29 3hbb s LEU 172 CO 0.13 -0.79 0.45 0.00 -1.32 0.00 0.00 176.35 174.82 3hbb n GLN 173 N 6.63 0.66 -3.61 1.98 1.13 0.79 -4.75 117.38 120.20 3hbb n GLN 173 Ca 0.07 0.03 -0.14 0.00 -1.94 0.00 0.00 57.00 55.02 3hbb n GLN 173 Cb 0.48 -1.63 -0.07 0.00 0.11 0.00 0.00 30.24 29.13 3hbb n GLN 173 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 3hbb s ALA 174 N -2.89 -1.80 -0.18 -1.58 0.00 -1.26 -4.35 121.76 109.71 3hbb s ALA 174 Ca -0.07 1.88 -0.05 0.00 0.00 0.00 0.00 51.96 53.73 3hbb s ALA 174 Cb 0.09 -0.98 -0.03 0.00 0.00 0.00 0.00 23.12 22.20 3hbb s ALA 174 CO 0.84 -0.34 -0.01 0.42 0.00 0.00 0.00 175.76 176.68 3hbb s ILE 175 N 0.06 4.05 -0.38 0.00 1.01 0.13 -0.81 121.20 125.25 3hbb s ILE 175 Ca -0.02 -0.29 -0.09 0.00 0.00 0.00 0.00 60.65 60.25 3hbb s ILE 175 Cb -0.04 -2.80 0.06 0.00 0.01 0.00 0.00 42.46 39.68 3hbb s ILE 175 CO 0.02 0.46 0.20 -0.31 0.00 0.00 0.00 174.94 175.31 3hbb s TYR 176 N 0.61 3.30 -0.19 3.97 1.51 0.12 0.22 117.35 126.88 3hbb s TYR 176 Ca -0.01 -1.39 -0.02 0.00 -1.01 0.00 0.00 57.07 54.64 3hbb s TYR 176 Cb -0.14 -2.64 -0.01 0.00 -0.11 0.00 0.00 41.96 39.06 3hbb s TYR 176 CO 0.02 -0.77 -0.09 0.50 -1.11 0.00 0.00 175.55 174.11 3hbb s ARG 177 N 1.44 3.34 -0.11 -0.62 3.52 -0.67 -0.76 118.95 125.08 3hbb s ARG 177 Ca 0.01 -0.67 -0.16 0.00 -0.13 0.00 0.00 55.73 54.79 3hbb s ARG 177 Cb -0.21 -2.85 -0.05 0.00 -1.56 0.00 0.00 34.95 30.28 3hbb s ARG 177 CO 0.03 -0.08 0.38 0.99 -0.81 0.00 0.00 175.30 175.82 3hbb s THR 178 N 1.13 5.21 -0.23 4.11 2.01 -0.53 -1.16 115.64 126.19 3hbb s THR 178 Ca 0.01 0.76 -0.03 0.00 0.31 0.00 0.00 61.69 62.74 3hbb s THR 178 Cb -0.14 -3.72 0.00 0.00 0.01 0.00 0.00 72.50 68.65 3hbb s THR 178 CO -0.02 0.40 -0.06 -0.89 -0.69 0.00 0.00 174.62 173.36 3hbb s THR 179 N 0.24 3.14 -0.22 -0.82 2.01 0.23 -0.33 115.64 119.88 3hbb s THR 179 Ca 0.22 -0.68 -0.19 0.00 0.31 0.00 0.00 61.69 61.35 3hbb s THR 179 Cb -0.14 -2.47 -0.03 0.00 0.01 0.00 0.00 72.50 69.87 3hbb s THR 179 CO 0.08 0.37 0.55 -0.63 -0.69 0.00 0.00 174.62 174.29 3hbb s ILE 180 N 1.42 5.07 -0.15 1.82 -1.09 1.00 -1.72 121.20 127.55 3hbb s ILE 180 Ca 0.04 0.99 -0.05 0.00 -2.23 0.00 0.00 60.65 59.40 3hbb s ILE 180 Cb -0.15 -3.86 -0.16 0.00 -1.58 0.00 0.00 42.46 36.71 3hbb s ILE 180 CO -0.04 0.12 3.32 0.54 -1.23 0.00 0.00 174.94 177.65 3hbb n ARG 181 N 5.16 2.12 -4.16 2.79 1.74 0.23 -3.14 116.66 121.41 3hbb n ARG 181 Ca -0.03 -1.43 -0.24 0.00 -0.77 0.00 0.00 57.85 55.37 3hbb n ARG 181 Cb 0.50 -2.03 -0.07 0.00 -1.02 0.00 0.00 32.46 29.83 3hbb n ARG 181 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3hbb s ALA 182 N 0.09 3.49 -0.28 7.54 0.00 -1.26 -4.60 121.76 126.74 3hbb s ALA 182 Ca 0.63 -2.01 -0.16 0.00 0.00 0.00 0.00 51.96 50.43 3hbb s ALA 182 Cb 0.34 -0.48 0.08 0.00 0.00 0.00 0.00 23.12 23.06 3hbb s ALA 182 CO -0.07 -0.07 0.68 0.45 0.00 0.00 0.00 175.76 176.75 3hbb s SER 183 N -3.85 -0.94 0.30 0.00 0.15 -1.26 -3.15 113.70 104.95 3hbb s SER 183 Ca 0.39 1.51 -0.17 0.00 0.70 0.00 0.00 55.95 58.37 3hbb s SER 183 Cb 0.01 1.38 0.02 0.00 -1.71 0.00 0.00 66.02 65.73 3hbb s SER 183 CO 0.22 -0.24 0.68 -1.83 1.20 0.00 0.00 173.24 173.27 3hbb s GLU 184 N 1.64 1.85 -0.00 5.44 1.03 -1.26 -5.10 118.70 122.30 3hbb s GLU 184 Ca -0.10 -1.18 -0.21 0.00 0.03 0.00 0.00 54.97 53.51 3hbb s GLU 184 Cb -0.05 0.58 -0.23 0.00 -0.80 0.00 0.00 34.13 33.63 3hbb s GLU 184 CO -0.20 -0.84 1.10 0.66 -1.33 0.00 0.00 175.26 174.65 3hbb h SER 185 N 2.05 0.47 -1.45 0.83 4.64 -2.05 -3.38 113.55 114.65 3hbb h SER 185 Ca -0.24 -0.75 0.43 0.00 -0.47 0.00 0.00 61.79 60.76 3hbb h SER 185 Cb 1.25 -0.14 -0.06 0.00 -0.31 0.00 0.00 62.40 63.13 3hbb h SER 185 CO 0.30 1.15 1.04 -1.54 -0.87 0.00 0.00 176.83 176.91 3hbb n SER 186 N -4.29 0.02 -4.70 4.97 3.41 -1.26 -4.56 113.62 107.21 3hbb n SER 186 Ca -0.10 0.78 -0.42 0.00 -0.26 0.00 0.00 58.87 58.87 3hbb n SER 186 Cb 0.62 -0.39 -0.03 0.00 -0.26 0.00 0.00 64.21 64.15 3hbb n SER 186 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3hbb n SER 188 N 5.20 3.47 -4.68 0.00 3.41 -1.01 -4.96 113.62 115.04 3hbb n SER 188 Ca 0.15 0.00 -0.35 0.00 -0.26 0.00 0.00 58.87 58.41 3hbb n SER 188 Cb 0.41 0.94 -0.09 0.00 -0.26 0.00 0.00 64.21 65.20 3hbb n SER 188 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 3hbb s VAL 189 N -2.29 4.58 0.18 -3.33 1.01 -1.05 -5.01 120.40 114.49 3hbb s VAL 189 Ca -0.03 -0.13 0.08 0.00 0.00 0.00 0.00 61.98 61.90 3hbb s VAL 189 Cb 0.03 -2.99 -0.04 0.00 0.00 0.00 0.00 36.38 33.38 3hbb s VAL 189 CO 0.26 0.56 -0.16 -0.36 0.00 0.00 0.00 175.10 175.40 3hbb s PHE 190 N -0.43 1.73 -0.14 5.22 0.40 -1.26 -0.69 117.98 122.81 3hbb s PHE 190 Ca 0.09 -0.52 -0.01 0.00 -0.60 0.00 0.00 56.93 55.88 3hbb s PHE 190 Cb -0.12 -0.84 0.04 0.00 0.51 0.00 0.00 43.02 42.61 3hbb s PHE 190 CO 0.02 0.33 -0.02 0.12 0.70 0.00 0.00 175.22 176.37 3hbb s PHE 191 N -2.48 1.29 -0.08 0.36 5.36 0.23 -4.84 117.98 117.83 3hbb s PHE 191 Ca 0.18 -0.79 0.03 0.00 -0.96 0.00 0.00 56.93 55.39 3hbb s PHE 191 Cb -0.03 -1.12 0.01 0.00 -0.34 0.00 0.00 43.02 41.53 3hbb s PHE 191 CO 0.06 -0.54 -0.17 1.03 -1.46 0.00 0.00 175.22 174.15 3hbb s ARG 192 N 1.77 2.22 -0.33 10.12 1.81 -1.26 -4.73 118.95 128.55 3hbb s ARG 192 Ca 0.02 -0.59 -0.19 0.00 -1.72 0.00 0.00 55.73 53.24 3hbb s ARG 192 Cb -0.15 -1.75 -0.01 0.00 -0.45 0.00 0.00 34.95 32.59 3hbb s ARG 192 CO -0.07 0.08 0.58 0.08 -0.68 0.00 0.00 175.30 175.29 3hbb s VAL 193 N 0.55 4.96 0.33 3.52 1.01 -1.26 -5.03 120.40 124.48 3hbb s VAL 193 Ca -0.16 0.62 -0.29 0.00 0.00 0.00 0.00 61.98 62.15 3hbb s VAL 193 Cb -0.17 -3.99 -0.12 0.00 0.00 0.00 0.00 36.38 32.11 3hbb s VAL 193 CO 0.06 -0.18 1.50 -2.65 0.00 0.00 0.00 175.10 173.82 3hbb n PRO 194 N 5.84 2.55 -2.21 2.72 -0.02 -1.26 -4.96 135.00 137.66 3hbb n PRO 194 Ca -0.03 0.90 -0.34 0.00 -2.02 0.00 0.00 63.50 62.02 3hbb n PRO 194 Cb 0.49 -2.62 -0.00 0.00 -0.02 0.00 0.00 33.50 31.34 3hbb n PRO 194 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 3hbb s GLU 195 N -1.29 3.41 -0.01 -0.52 2.02 -1.26 -4.70 118.70 116.35 3hbb s GLU 195 Ca 0.59 1.37 -0.36 0.00 0.02 0.00 0.00 54.97 56.59 3hbb s GLU 195 Cb -0.51 -2.04 -0.15 0.00 0.10 0.00 0.00 34.13 31.54 3hbb s GLU 195 CO 0.56 -0.76 1.60 0.45 0.02 0.00 0.00 175.26 177.14 3hbb n SER 196 N -1.58 2.56 -0.01 -0.19 2.88 -1.26 -2.28 113.62 113.74 3hbb n SER 196 Ca 0.10 1.07 -0.00 0.00 -1.33 0.00 0.00 58.87 58.71 3hbb n SER 196 Cb 0.52 -1.28 -0.00 0.00 -0.75 0.00 0.00 64.21 62.70 3hbb n SER 196 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3hbb n GLY 197 N 3.50 0.46 3.96 0.46 0.00 -1.26 -5.05 105.19 107.26 3hbb n GLY 197 Ca 0.21 -0.42 -0.22 0.00 0.00 0.00 0.00 46.02 45.58 3hbb n GLY 197 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3hbb s THR 198 N -2.00 4.33 0.17 2.61 -4.23 -0.96 -5.02 115.64 110.54 3hbb s THR 198 Ca 0.00 -0.65 -0.13 0.00 -1.18 0.00 0.00 61.69 59.73 3hbb s THR 198 Cb 0.00 -3.57 0.06 0.00 1.34 0.00 0.00 72.50 70.33 3hbb s THR 198 CO 0.00 -0.34 1.76 -0.33 -0.54 0.00 0.00 174.62 175.18 3hbb h GLU 199 N 0.65 0.77 -0.30 3.99 5.08 -1.96 -2.28 114.58 120.53 3hbb h GLU 199 Ca -0.47 -0.10 0.06 0.00 -1.00 0.00 0.00 59.36 57.84 3hbb h GLU 199 Cb 1.25 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 30.34 3hbb h GLU 199 CO 0.57 0.62 0.21 0.00 -1.00 0.00 0.00 179.01 179.40 3hbb h ALA 200 N 1.12 2.09 0.00 3.43 0.00 -1.95 -2.58 119.26 121.36 3hbb h ALA 200 Ca 0.19 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.09 3hbb h ALA 200 Cb 0.08 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 17.84 3hbb h ALA 200 CO -0.03 -0.16 -0.02 0.00 0.00 0.00 0.00 179.25 179.05 3hbb h ALA 201 N 1.84 1.09 -4.94 0.00 0.00 -1.66 -3.47 119.26 112.13 3hbb h ALA 201 Ca 0.13 -0.02 -0.39 0.00 0.00 0.00 0.00 54.91 54.64 3hbb h ALA 201 Cb 0.35 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.13 3hbb h ALA 201 CO -0.02 0.02 -0.58 0.00 0.00 0.00 0.00 179.25 178.67 3hbb n ALA 202 N -2.13 -1.02 -0.18 0.00 0.00 -0.97 -0.80 120.51 115.40 3hbb n ALA 202 Ca -0.02 0.20 0.00 0.00 0.00 0.00 0.00 53.44 53.62 3hbb n ALA 202 Cb 0.15 -3.41 0.00 0.00 0.00 0.00 0.00 19.45 16.19 3hbb n ALA 202 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3hbb n GLY 203 N -1.37 1.53 3.84 0.00 0.00 -1.26 -5.04 105.19 102.89 3hbb n GLY 203 Ca -0.07 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.60 3hbb n GLY 203 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3hbb s ILE 204 N -2.80 4.79 -0.44 -0.61 1.01 0.02 -4.99 121.20 118.19 3hbb s ILE 204 Ca 0.00 0.91 0.04 0.00 0.00 0.00 0.00 60.65 61.60 3hbb s ILE 204 Cb 0.00 -3.75 0.12 0.00 0.01 0.00 0.00 42.46 38.84 3hbb s ILE 204 CO 0.00 0.21 0.17 -1.61 0.00 0.00 0.00 174.94 173.71 3hbb s GLU 205 N -2.04 1.67 0.19 2.79 2.02 -1.26 -4.39 118.70 117.68 3hbb s GLU 205 Ca 0.40 -2.22 -0.31 0.00 0.02 0.00 0.00 54.97 52.86 3hbb s GLU 205 Cb -0.15 -3.12 -0.09 0.00 0.10 0.00 0.00 34.13 30.86 3hbb s GLU 205 CO 0.20 -1.05 1.41 -1.58 0.02 0.00 0.00 175.26 174.26 3hbb s TRP 206 N 0.30 3.15 0.14 1.61 0.52 -1.26 -0.49 118.94 122.91 3hbb s TRP 206 Ca 0.14 1.00 0.10 0.00 0.02 0.00 0.00 56.10 57.36 3hbb s TRP 206 Cb -0.23 -3.74 -0.04 0.00 -1.15 0.00 0.00 33.47 28.31 3hbb s TRP 206 CO -0.04 -2.50 -0.24 -0.65 0.02 0.00 0.00 176.95 173.54 3hbb s GLN 207 N 0.32 1.36 -0.25 4.98 -0.21 0.66 -4.88 119.66 121.64 3hbb s GLN 207 Ca 0.62 -1.37 -0.25 0.00 0.02 0.00 0.00 55.36 54.38 3hbb s GLN 207 Cb -0.39 -1.72 -0.00 0.00 1.00 0.00 0.00 33.01 31.89 3hbb s GLN 207 CO 0.37 0.39 0.84 0.50 -2.12 0.00 0.00 175.29 175.27 3hbb s ARG 208 N -2.27 4.16 -0.11 2.91 3.52 -1.26 -0.88 118.95 125.02 3hbb s ARG 208 Ca 0.14 0.93 -0.18 0.00 -0.13 0.00 0.00 55.73 56.49 3hbb s ARG 208 Cb -0.09 -3.66 -0.27 0.00 -1.56 0.00 0.00 34.95 29.38 3hbb s ARG 208 CO 0.07 -0.55 0.57 1.49 -0.81 0.00 0.00 175.30 176.06 3hbb h GLU 209 N 7.73 0.20 -3.52 5.12 4.81 -1.05 -3.48 114.58 124.39 3hbb h GLU 209 Ca -0.23 -0.34 -0.12 0.00 -0.13 0.00 0.00 59.36 58.55 3hbb h GLU 209 Cb 1.09 0.13 -0.18 0.00 0.63 0.00 0.00 28.75 30.42 3hbb h GLU 209 CO 0.88 1.16 -0.40 0.95 -0.73 0.00 0.00 179.01 180.88 3hbb s THR 210 N -2.44 0.10 -0.04 0.32 -4.23 -1.22 -5.00 115.64 103.14 3hbb s THR 210 Ca -0.20 -0.84 -0.02 0.00 -1.18 0.00 0.00 61.69 59.45 3hbb s THR 210 Cb 0.04 -0.82 0.03 0.00 1.34 0.00 0.00 72.50 73.08 3hbb s THR 210 CO 0.75 -0.46 0.09 -0.51 -0.54 0.00 0.00 174.62 173.94 3hbb s ILE 211 N -2.32 -0.07 0.91 2.99 2.07 -1.26 -1.88 121.20 121.63 3hbb s ILE 211 Ca -0.07 0.23 -0.12 0.00 -1.41 0.00 0.00 60.65 59.28 3hbb s ILE 211 Cb -0.02 -0.17 0.14 0.00 0.13 0.00 0.00 42.46 42.54 3hbb s ILE 211 CO -0.03 0.09 1.10 -0.94 -1.91 0.00 0.00 174.94 173.26 3hbb s SER 212 N 1.28 3.44 0.90 4.50 1.04 -0.00 -5.02 113.70 119.85 3hbb s SER 212 Ca -0.07 1.27 -0.12 0.00 0.48 0.00 0.00 55.95 57.51 3hbb s SER 212 Cb -0.12 -1.94 0.13 0.00 0.10 0.00 0.00 66.02 64.19 3hbb s SER 212 CO -0.04 -2.63 1.09 -1.61 0.98 0.00 0.00 173.24 171.03 3hbb s GLU 213 N -5.05 1.19 0.07 4.02 2.02 -1.26 -4.75 118.70 114.94 3hbb s GLU 213 Ca 0.63 0.84 -0.31 0.00 0.02 0.00 0.00 54.97 56.16 3hbb s GLU 213 Cb -0.17 -1.80 -0.07 0.00 0.10 0.00 0.00 34.13 32.19 3hbb s GLU 213 CO 0.56 -2.30 1.45 -2.00 0.02 0.00 0.00 175.26 172.99 3hbb s GLU 214 N -4.91 4.28 0.24 1.61 2.12 -1.26 -4.65 118.70 116.13 3hbb s GLU 214 Ca 0.64 2.10 0.11 0.00 0.36 0.00 0.00 54.97 58.18 3hbb s GLU 214 Cb -0.18 -3.41 -0.05 0.00 0.26 0.00 0.00 34.13 30.76 3hbb s GLU 214 CO 0.57 -0.54 -0.20 -0.51 -0.54 0.00 0.00 175.26 174.04 3hbb s LEU 215 N 1.78 2.58 -0.17 2.70 1.43 0.94 -4.93 118.68 123.01 3hbb s LEU 215 Ca 0.66 -0.91 -0.02 0.00 -1.03 0.00 0.00 54.13 52.83 3hbb s LEU 215 Cb -0.36 -1.20 -0.01 0.00 0.03 0.00 0.00 46.19 44.65 3hbb s LEU 215 CO 0.29 0.08 -0.08 -0.89 0.23 0.00 0.00 176.35 175.98 3hbb s THR 216 N -2.08 3.33 0.19 5.49 2.01 -1.26 0.02 115.64 123.34 3hbb s THR 216 Ca 0.26 -0.54 -0.30 0.00 0.31 0.00 0.00 61.69 61.42 3hbb s THR 216 Cb -0.07 -2.46 -0.08 0.00 0.01 0.00 0.00 72.50 69.90 3hbb s THR 216 CO 0.13 0.48 1.15 -0.55 -0.69 0.00 0.00 174.62 175.13 3hbb s SER 217 N 0.82 7.18 -1.16 3.53 0.15 0.12 -4.93 113.70 119.41 3hbb s SER 217 Ca -0.03 2.17 -0.06 0.00 0.70 0.00 0.00 55.95 58.73 3hbb s SER 217 Cb -0.15 -2.61 0.02 0.00 -1.71 0.00 0.00 66.02 61.58 3hbb s SER 217 CO 0.01 -0.29 2.71 0.00 1.20 0.00 0.00 173.24 176.87 3hbb n ALA 218 N 2.33 6.92 -0.48 5.45 0.00 -1.26 -4.12 120.51 129.35 3hbb n ALA 218 Ca 0.03 -3.59 0.06 0.00 0.00 0.00 0.00 53.44 49.95 3hbb n ALA 218 Cb 0.45 -2.80 0.16 0.00 0.00 0.00 0.00 19.45 17.27 3hbb n ALA 218 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 3hbb n ASN 219 N 2.14 3.06 0.00 0.00 6.94 -1.26 -4.95 115.26 121.19 3hbb n ASN 219 Ca 0.63 -2.41 0.00 0.00 -0.02 0.00 0.00 54.58 52.78 3hbb n ASN 219 Cb 0.35 -0.32 0.00 0.00 -2.36 0.00 0.00 39.78 37.45 3hbb n ASN 219 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 3hbb n GLY 220 N -0.11 2.58 2.20 4.83 0.00 -1.26 -5.00 105.19 108.43 3hbb n GLY 220 Ca 0.13 -0.71 -0.18 0.00 0.00 0.00 0.00 46.02 45.26 3hbb n GLY 220 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3hbb n ASN 221 N 1.87 -1.35 -2.86 1.61 3.02 -1.26 -4.99 115.26 111.30 3hbb n ASN 221 Ca 0.00 -0.98 -0.32 0.00 -0.03 0.00 0.00 54.58 53.25 3hbb n ASN 221 Cb 0.00 -0.62 0.00 0.00 -0.61 0.00 0.00 39.78 38.55 3hbb n ASN 221 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 3hbb n GLU 222 N -3.41 3.52 -1.90 3.52 4.71 -1.26 -4.73 120.64 121.08 3hbb n GLU 222 Ca 0.10 -4.38 -0.43 0.00 -0.01 0.00 0.00 57.16 52.44 3hbb n GLU 222 Cb 0.36 -2.28 -0.03 0.00 -1.01 0.00 0.00 31.44 28.48 3hbb n GLU 222 CO 0.00 0.00 0.00 0.99 0.09 0.00 0.00 177.13 178.21 3hbb s THR 223 N -5.01 3.38 0.48 2.62 2.01 -1.26 -4.67 115.64 113.19 3hbb s THR 223 Ca 0.48 0.42 -0.21 0.00 0.31 0.00 0.00 61.69 62.68 3hbb s THR 223 Cb 0.35 -3.43 -0.08 0.00 0.01 0.00 0.00 72.50 69.36 3hbb s THR 223 CO -0.23 -0.21 1.07 -0.54 -0.69 0.00 0.00 174.62 174.03 3hbb s LYS 224 N 5.30 3.78 0.10 4.92 -0.14 -1.26 0.13 119.74 132.56 3hbb s LYS 224 Ca 0.83 1.49 -0.25 0.00 -1.36 0.00 0.00 55.97 56.68 3hbb s LYS 224 Cb -0.29 -2.20 0.08 0.00 -1.68 0.00 0.00 37.83 33.74 3hbb s LYS 224 CO 0.33 -0.47 0.69 1.52 -0.76 0.00 0.00 175.35 176.67 3hbb s TYR 225 N -1.82 -0.49 0.08 3.18 1.13 0.10 -0.60 117.35 118.94 3hbb s TYR 225 Ca 0.66 0.35 -0.11 0.00 -1.41 0.00 0.00 57.07 56.55 3hbb s TYR 225 Cb -0.20 0.54 0.01 0.00 -1.10 0.00 0.00 41.96 41.21 3hbb s TYR 225 CO 0.24 -0.74 0.26 1.52 -2.51 0.00 0.00 175.55 174.32 3hbb s TYR 226 N -3.38 0.02 0.03 -3.49 1.13 -0.70 -0.04 117.35 110.92 3hbb s TYR 226 Ca 0.01 -0.35 0.03 0.00 -1.41 0.00 0.00 57.07 55.35 3hbb s TYR 226 Cb -0.01 0.04 -0.04 0.00 -1.10 0.00 0.00 41.96 40.85 3hbb s TYR 226 CO -0.10 -0.56 -0.02 -0.06 -2.51 0.00 0.00 175.55 172.30 3hbb s PHE 227 N -3.48 3.00 0.01 -3.49 0.08 -1.26 -0.60 117.98 112.23 3hbb s PHE 227 Ca 0.02 0.02 -0.03 0.00 0.12 0.00 0.00 56.93 57.05 3hbb s PHE 227 Cb 0.03 -1.61 -0.01 0.00 -0.57 0.00 0.00 43.02 40.86 3hbb s PHE 227 CO -0.09 0.44 0.05 -1.83 -0.10 0.00 0.00 175.22 173.69 3hbb s GLU 228 N -1.75 0.35 -0.17 0.44 -1.05 -0.31 -0.82 118.70 115.40 3hbb s GLU 228 Ca 0.21 -0.44 -0.02 0.00 -0.15 0.00 0.00 54.97 54.56 3hbb s GLU 228 Cb -0.11 0.14 -0.01 0.00 -0.44 0.00 0.00 34.13 33.70 3hbb s GLU 228 CO 0.12 -0.07 -0.08 0.21 0.95 0.00 0.00 175.26 176.39 3hbb s LYS 229 N -1.25 3.43 -0.10 -4.83 2.20 -0.79 -1.68 119.74 116.73 3hbb s LYS 229 Ca -0.14 -0.64 0.02 0.00 -0.36 0.00 0.00 55.97 54.86 3hbb s LYS 229 Cb -0.08 -2.82 -0.02 0.00 -1.51 0.00 0.00 37.83 33.41 3hbb s LYS 229 CO 0.00 0.06 -0.16 -0.51 -0.36 0.00 0.00 175.35 174.39 3hbb s LEU 230 N 0.78 2.59 0.04 5.43 1.43 0.13 -0.34 118.68 128.75 3hbb s LEU 230 Ca -0.03 -0.33 0.05 0.00 -1.03 0.00 0.00 54.13 52.78 3hbb s LEU 230 Cb -0.15 -1.55 -0.02 0.00 0.03 0.00 0.00 46.19 44.50 3hbb s LEU 230 CO 0.01 0.23 -0.13 0.27 0.23 0.00 0.00 176.35 176.96 3hbb s ILE 231 N -0.03 1.06 -0.19 -0.59 -4.36 -0.06 0.20 121.20 117.23 3hbb s ILE 231 Ca -0.04 -1.00 -0.28 0.00 -0.26 0.00 0.00 60.65 59.06 3hbb s ILE 231 Cb -0.14 -0.97 -0.00 0.00 1.25 0.00 0.00 42.46 42.60 3hbb s ILE 231 CO 0.04 -0.03 0.98 -2.16 0.24 0.00 0.00 174.94 174.01 3hbb s PRO 232 N -1.18 4.30 -0.27 0.37 0.04 -1.26 -0.24 135.00 136.76 3hbb s PRO 232 Ca 0.01 1.28 -0.39 0.00 0.04 0.00 0.00 61.00 61.93 3hbb s PRO 232 Cb -0.08 -3.61 -0.15 0.00 0.04 0.00 0.00 34.50 30.71 3hbb s PRO 232 CO 0.01 -0.49 1.82 -2.13 0.04 0.00 0.00 177.00 176.25 3hbb n ARG 233 N 5.80 1.26 -2.94 4.56 0.63 0.35 -4.56 116.66 121.76 3hbb n ARG 233 Ca 0.09 0.45 -0.44 0.00 -0.92 0.00 0.00 57.85 57.04 3hbb n ARG 233 Cb 0.47 -2.20 -0.01 0.00 0.45 0.00 0.00 32.46 31.17 3hbb n ARG 233 CO 0.00 0.00 0.00 1.21 -2.51 0.00 0.00 177.63 176.33 3hbb s ASN 234 N 4.10 6.97 0.25 6.15 3.84 -1.26 -4.80 114.94 130.18 3hbb s ASN 234 Ca 0.99 -2.77 -0.05 0.00 0.21 0.00 0.00 52.86 51.24 3hbb s ASN 234 Cb -1.01 -2.40 0.30 0.00 -0.55 0.00 0.00 41.25 37.59 3hbb s ASN 234 CO 0.62 -0.82 1.89 0.03 -2.79 0.00 0.00 177.10 176.04 3hbb h ARG 235 N 7.55 1.14 -0.44 0.43 2.47 -1.96 -2.31 114.38 121.25 3hbb h ARG 235 Ca 0.28 -0.07 0.04 0.00 -1.26 0.00 0.00 59.98 58.97 3hbb h ARG 235 Cb 0.91 -0.26 -0.04 0.00 -1.65 0.00 0.00 29.97 28.93 3hbb h ARG 235 CO 1.21 0.76 0.22 0.93 0.56 0.00 0.00 179.97 183.64 3hbb h GLU 236 N 1.18 0.42 -0.17 0.04 5.08 -1.89 -2.09 114.58 117.16 3hbb h GLU 236 Ca 0.38 -0.03 -0.11 0.00 -1.00 0.00 0.00 59.36 58.60 3hbb h GLU 236 Cb 0.01 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.15 3hbb h GLU 236 CO -0.12 0.28 -0.38 1.49 -1.00 0.00 0.00 179.01 179.28 3hbb h GLU 237 N 0.43 0.36 -0.46 2.33 4.81 -1.85 -3.03 114.58 117.17 3hbb h GLU 237 Ca 0.19 -0.17 -0.03 0.00 -0.13 0.00 0.00 59.36 59.23 3hbb h GLU 237 Cb 0.10 -0.01 -0.02 0.00 0.63 0.00 0.00 28.75 29.46 3hbb h GLU 237 CO -0.14 0.69 0.17 0.93 -0.73 0.00 0.00 179.01 179.94 3hbb h GLU 238 N 0.31 0.66 -0.68 1.92 5.08 -0.86 -2.04 114.58 118.96 3hbb h GLU 238 Ca 0.03 -0.09 0.07 0.00 -1.00 0.00 0.00 59.36 58.37 3hbb h GLU 238 Cb 0.81 -0.12 -0.10 0.00 0.50 0.00 0.00 28.75 29.84 3hbb h GLU 238 CO 0.06 0.55 -0.57 1.96 -1.00 0.00 0.00 179.01 180.01 3hbb h GLN 239 N 0.65 -0.20 0.10 2.33 4.20 -1.27 0.58 115.11 121.50 3hbb h GLN 239 Ca 0.16 0.01 0.02 0.00 0.06 0.00 0.00 58.65 58.90 3hbb h GLN 239 Cb 0.15 0.05 -0.05 0.00 0.30 0.00 0.00 27.48 27.93 3hbb h GLN 239 CO -0.01 -0.14 -0.51 -0.92 -0.67 0.00 0.00 178.83 176.58 3hbb h TYR 240 N -0.21 -1.48 -0.74 2.96 3.20 -1.49 -1.80 116.97 117.41 3hbb h TYR 240 Ca 0.11 0.04 0.08 0.00 3.14 0.00 0.00 58.73 62.10 3hbb h TYR 240 Cb 0.51 0.63 -0.06 0.00 1.54 0.00 0.00 36.73 39.35 3hbb h TYR 240 CO -0.87 -0.58 0.41 -0.07 -1.64 0.00 0.00 178.16 175.41 3hbb h LEU 241 N -0.73 0.59 -0.47 2.82 3.38 -0.79 -0.39 115.31 119.72 3hbb h LEU 241 Ca 0.00 0.04 0.09 0.00 0.09 0.00 0.00 57.88 58.10 3hbb h LEU 241 Cb 0.75 -0.07 -0.08 0.00 0.09 0.00 0.00 40.66 41.34 3hbb h LEU 241 CO -0.29 0.36 -0.01 0.28 0.09 0.00 0.00 178.44 178.87 3hbb h SER 242 N 0.72 -0.22 -0.61 -0.43 0.02 0.36 -0.19 113.55 113.20 3hbb h SER 242 Ca 0.34 0.11 -0.04 0.00 -0.84 0.00 0.00 61.79 61.37 3hbb h SER 242 Cb 0.27 0.20 -0.03 0.00 0.14 0.00 0.00 62.40 62.98 3hbb h SER 242 CO -0.22 -0.07 0.23 0.25 -1.14 0.00 0.00 176.83 175.88 3hbb h LEU 243 N 0.10 0.86 -0.16 5.07 5.85 -0.29 0.47 115.31 127.21 3hbb h LEU 243 Ca 0.23 -0.18 0.00 0.00 0.84 0.00 0.00 57.88 58.77 3hbb h LEU 243 Cb 0.35 -0.22 -0.01 0.00 0.37 0.00 0.00 40.66 41.15 3hbb h LEU 243 CO -0.40 0.81 0.11 0.58 -0.34 0.00 0.00 178.44 179.20 3hbb h VAL 244 N 0.86 1.04 -0.97 1.05 2.07 -0.70 -1.12 116.25 118.48 3hbb h VAL 244 Ca 0.20 -0.07 0.01 0.00 0.82 0.00 0.00 66.70 67.66 3hbb h VAL 244 Cb 0.23 0.80 -0.05 0.00 -1.52 0.00 0.00 31.29 30.76 3hbb h VAL 244 CO -0.01 0.04 0.64 -0.78 0.02 0.00 0.00 177.57 177.47 3hbb h ASP 245 N 0.22 1.11 -0.21 0.57 3.58 -0.72 -2.26 116.42 118.70 3hbb h ASP 245 Ca 0.06 -0.03 -0.09 0.00 0.42 0.00 0.00 57.03 57.39 3hbb h ASP 245 Cb -0.02 -0.28 -0.02 0.00 1.72 0.00 0.00 39.33 40.73 3hbb h ASP 245 CO -0.02 0.81 -0.14 -0.09 -2.88 0.00 0.00 179.24 176.92 3hbb h ARG 246 N 1.31 0.62 -0.40 0.28 2.43 -0.63 -2.18 114.38 115.81 3hbb h ARG 246 Ca 0.35 -0.20 -0.07 0.00 -0.81 0.00 0.00 59.98 59.25 3hbb h ARG 246 Cb -0.15 -0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 29.33 3hbb h ARG 246 CO -0.08 0.74 -0.02 0.82 -1.51 0.00 0.00 179.97 179.93 3hbb h ILE 247 N 0.56 1.26 -0.52 1.20 2.04 -0.71 0.27 117.51 121.62 3hbb h ILE 247 Ca 0.10 -1.05 -0.04 0.00 1.00 0.00 0.00 64.86 64.87 3hbb h ILE 247 Cb 0.57 1.15 -0.02 0.00 -0.74 0.00 0.00 36.82 37.78 3hbb h ILE 247 CO 0.04 0.35 0.16 0.40 0.00 0.00 0.00 178.15 179.10 3hbb h ILE 248 N 0.54 1.23 0.04 -0.67 2.04 -1.31 0.15 117.51 119.52 3hbb h ILE 248 Ca 0.11 -0.78 -0.25 0.00 1.00 0.00 0.00 64.86 64.93 3hbb h ILE 248 Cb 0.51 0.76 -0.03 0.00 -0.74 0.00 0.00 36.82 37.32 3hbb h ILE 248 CO 0.02 0.29 -1.29 0.03 0.00 0.00 0.00 178.15 177.20 3hbb h ARG 249 N 0.71 0.08 0.00 2.37 3.08 -1.33 -3.41 114.38 115.89 3hbb h ARG 249 Ca 0.17 -0.13 0.00 0.00 0.07 0.00 0.00 59.98 60.08 3hbb h ARG 249 Cb 0.28 0.05 0.00 0.00 0.08 0.00 0.00 29.97 30.38 3hbb h ARG 249 CO -0.00 0.93 -0.26 0.39 -1.07 0.00 0.00 179.97 179.96 3hbb n GLU 250 N -3.32 4.38 -1.78 0.04 1.02 0.95 -5.08 120.64 116.86 3hbb n GLU 250 Ca -0.08 0.00 -0.33 0.00 -0.02 0.00 0.00 57.16 56.73 3hbb n GLU 250 Cb 0.99 -0.57 0.05 0.00 -0.02 0.00 0.00 31.44 31.89 3hbb n GLU 250 CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 3hbb s GLY 251 N -1.10 2.20 0.38 0.62 0.00 0.52 -4.99 107.32 104.95 3hbb s GLY 251 Ca 0.00 0.58 -0.09 0.00 0.00 0.00 0.00 44.72 45.21 3hbb s GLY 251 CO 0.00 0.94 0.73 -1.31 0.00 0.00 0.00 173.10 173.45 3hbb s ASN 252 N -2.50 6.50 -0.08 1.64 0.01 0.95 -4.54 114.94 116.91 3hbb s ASN 252 Ca 0.68 1.05 -0.30 0.00 -0.71 0.00 0.00 52.86 53.58 3hbb s ASN 252 Cb -0.21 -2.29 -0.02 0.00 0.41 0.00 0.00 41.25 39.15 3hbb s ASN 252 CO 0.41 -0.36 1.00 -0.69 -1.51 0.00 0.00 177.10 175.94 3hbb s VAL 253 N -2.32 4.80 0.04 1.60 1.01 -1.26 0.04 120.40 124.32 3hbb s VAL 253 Ca 0.50 2.04 0.02 0.00 0.00 0.00 0.00 61.98 64.54 3hbb s VAL 253 Cb -0.10 -4.31 -0.03 0.00 0.00 0.00 0.00 36.38 31.94 3hbb s VAL 253 CO 0.31 0.04 -0.07 -0.54 0.00 0.00 0.00 175.10 174.85 3hbb s LYS 254 N 1.79 0.53 -0.13 2.72 1.02 0.11 -4.96 119.74 120.82 3hbb s LYS 254 Ca 0.49 -0.82 0.03 0.00 0.02 0.00 0.00 55.97 55.69 3hbb s LYS 254 Cb -0.19 -0.19 0.01 0.00 -0.52 0.00 0.00 37.83 36.95 3hbb s LYS 254 CO 0.20 0.02 -0.21 -1.01 -0.92 0.00 0.00 175.35 173.43 3hbb s HIS 255 N -1.77 2.52 0.02 3.18 3.76 -1.26 0.52 115.29 122.26 3hbb s HIS 255 Ca -0.08 -1.22 -0.00 0.00 -0.15 0.00 0.00 55.06 53.61 3hbb s HIS 255 Cb -0.07 -1.72 0.00 0.00 1.11 0.00 0.00 32.58 31.90 3hbb s HIS 255 CO -0.01 -0.55 0.02 -0.40 -0.85 0.00 0.00 174.74 172.95 3hbb n ASP 256 N 3.99 0.00 -0.23 1.40 5.68 -0.97 -4.82 116.55 121.60 3hbb n ASP 256 Ca -0.20 -1.01 -0.03 0.00 -0.50 0.00 0.00 54.79 53.06 3hbb n ASP 256 Cb 0.52 -0.02 0.03 0.00 -1.14 0.00 0.00 41.12 40.51 3hbb n ASP 256 CO 0.00 0.00 0.00 0.03 -1.33 0.00 0.00 177.20 175.90 3hbb h ARG 257 N 0.00 -0.10 0.00 0.11 2.47 -2.01 -0.32 114.38 114.53 3hbb h ARG 257 Ca -0.01 0.01 -0.09 0.00 -1.26 0.00 0.00 59.98 58.63 3hbb h ARG 257 Cb 0.02 0.02 -0.01 0.00 -1.65 0.00 0.00 29.97 28.35 3hbb h ARG 257 CO 0.00 -0.06 -0.44 1.79 0.56 0.00 0.00 179.97 181.82 3hbb h THR 258 N -0.10 0.93 0.00 2.04 1.35 -2.06 -3.47 112.91 111.61 3hbb h THR 258 Ca 0.28 -1.78 0.00 0.00 -0.55 0.00 0.00 66.41 64.36 3hbb h THR 258 Cb 0.55 2.09 0.00 0.00 -1.73 0.00 0.00 68.15 69.06 3hbb h THR 258 CO -0.73 0.43 0.00 0.61 -0.25 0.00 0.00 175.52 175.59 3hbb n GLY 259 N 0.51 1.38 3.75 5.82 0.00 -0.13 -5.11 105.19 111.41 3hbb n GLY 259 Ca 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.62 3hbb n GLY 259 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3hbb s VAL 260 N -2.00 4.33 0.53 1.61 1.01 -1.26 -4.74 120.40 119.87 3hbb s VAL 260 Ca 0.00 1.91 -0.22 0.00 0.00 0.00 0.00 61.98 63.67 3hbb s VAL 260 Cb 0.00 -4.24 -0.05 0.00 0.00 0.00 0.00 36.38 32.08 3hbb s VAL 260 CO 0.00 0.45 1.30 -0.83 0.00 0.00 0.00 175.10 176.02 3hbb s GLY 261 N -0.78 2.85 -0.09 4.51 0.00 -1.26 -2.28 107.32 110.27 3hbb s GLY 261 Ca 0.40 1.22 -0.14 0.00 0.00 0.00 0.00 44.72 46.20 3hbb s GLY 261 CO 0.29 1.71 0.35 -1.59 0.00 0.00 0.00 173.10 173.86 3hbb s THR 262 N -1.38 0.02 -0.16 0.90 2.01 0.18 -1.57 115.64 115.65 3hbb s THR 262 Ca 0.70 -0.16 -0.06 0.00 0.31 0.00 0.00 61.69 62.47 3hbb s THR 262 Cb -0.37 -0.55 -0.04 0.00 0.01 0.00 0.00 72.50 71.55 3hbb s THR 262 CO 0.44 -0.09 0.04 -0.76 -0.69 0.00 0.00 174.62 173.56 3hbb s LEU 263 N -0.36 3.73 -0.00 4.42 1.43 0.33 0.07 118.68 128.30 3hbb s LEU 263 Ca -0.05 0.08 0.01 0.00 -1.03 0.00 0.00 54.13 53.14 3hbb s LEU 263 Cb -0.03 -1.92 -0.00 0.00 0.03 0.00 0.00 46.19 44.26 3hbb s LEU 263 CO 0.02 0.22 -0.02 -0.55 0.23 0.00 0.00 176.35 176.25 3hbb s SER 264 N 0.10 0.21 0.28 2.29 0.15 0.11 -1.02 113.70 115.82 3hbb s SER 264 Ca 0.04 -0.03 0.07 0.00 0.70 0.00 0.00 55.95 56.72 3hbb s SER 264 Cb -0.12 -0.02 -0.06 0.00 -1.71 0.00 0.00 66.02 64.10 3hbb s SER 264 CO 0.01 0.02 -0.06 0.27 1.20 0.00 0.00 173.24 174.68 3hbb s ILE 265 N -0.04 1.69 -0.14 6.45 -5.25 -0.26 -0.04 121.20 123.60 3hbb s ILE 265 Ca 0.01 -2.13 0.00 0.00 -0.99 0.00 0.00 60.65 57.54 3hbb s ILE 265 Cb -0.01 -2.47 0.02 0.00 2.95 0.00 0.00 42.46 42.96 3hbb s ILE 265 CO -0.00 -0.29 -0.14 0.12 -1.79 0.00 0.00 174.94 172.84 3hbb s PHE 266 N -2.98 2.11 0.00 1.37 5.36 -1.26 -1.32 117.98 121.26 3hbb s PHE 266 Ca 0.30 -1.16 0.00 0.00 -0.96 0.00 0.00 56.93 55.11 3hbb s PHE 266 Cb 0.04 -1.56 0.00 0.00 -0.34 0.00 0.00 43.02 41.16 3hbb s PHE 266 CO 0.12 -0.64 0.00 0.41 -1.46 0.00 0.00 175.22 173.66 3hbb n GLY 267 N 4.70 -2.43 3.31 13.12 0.00 0.46 -5.02 105.19 119.34 3hbb n GLY 267 Ca -0.17 -0.50 -0.10 0.00 0.00 0.00 0.00 46.02 45.25 3hbb n GLY 267 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hbb s ALA 268 N 0.00 0.49 -0.16 4.61 0.00 -0.85 -5.01 121.76 120.84 3hbb s ALA 268 Ca 0.00 -1.25 -0.07 0.00 0.00 0.00 0.00 51.96 50.63 3hbb s ALA 268 Cb 0.00 1.07 0.06 0.00 0.00 0.00 0.00 23.12 24.25 3hbb s ALA 268 CO 0.00 -0.64 0.36 -1.14 0.00 0.00 0.00 175.76 174.34 3hbb s GLN 269 N -4.05 0.30 0.28 0.00 0.74 -1.26 -1.76 119.66 113.91 3hbb s GLN 269 Ca 0.26 0.79 0.11 0.00 0.05 0.00 0.00 55.36 56.58 3hbb s GLN 269 Cb 0.04 0.04 -0.05 0.00 1.10 0.00 0.00 33.01 34.15 3hbb s GLN 269 CO 0.06 -0.20 -0.15 -1.64 -0.55 0.00 0.00 175.29 172.81 3hbb s MET 270 N 1.81 1.84 -0.02 1.67 -1.94 -0.07 -4.98 119.30 117.61 3hbb s MET 270 Ca -0.06 -1.69 0.00 0.00 -1.71 0.00 0.00 55.69 52.23 3hbb s MET 270 Cb -0.10 -1.86 0.02 0.00 2.01 0.00 0.00 34.83 34.89 3hbb s MET 270 CO -0.11 0.33 -0.01 0.50 -0.01 0.00 0.00 175.02 175.72 3hbb s ARG 271 N -3.56 0.22 -0.01 2.03 3.52 -1.26 -0.07 118.95 119.82 3hbb s ARG 271 Ca 0.30 0.03 0.04 0.00 -0.13 0.00 0.00 55.73 55.97 3hbb s ARG 271 Cb -0.05 -0.34 -0.01 0.00 -1.56 0.00 0.00 34.95 32.99 3hbb s ARG 271 CO 0.16 -0.07 -0.12 -0.06 -0.81 0.00 0.00 175.30 174.40 3hbb s PHE 272 N 0.62 1.12 -0.13 5.12 0.40 0.65 -4.86 117.98 120.90 3hbb s PHE 272 Ca -0.06 -0.22 -0.22 0.00 -0.60 0.00 0.00 56.93 55.83 3hbb s PHE 272 Cb -0.09 -0.73 -0.03 0.00 0.51 0.00 0.00 43.02 42.68 3hbb s PHE 272 CO -0.01 -0.03 0.66 0.45 0.70 0.00 0.00 175.22 176.99 3hbb s SER 273 N -0.23 6.85 0.00 1.36 0.15 -1.26 -0.29 113.70 120.28 3hbb s SER 273 Ca 0.04 1.03 0.23 0.00 0.70 0.00 0.00 55.95 57.94 3hbb s SER 273 Cb -0.05 -2.38 0.23 0.00 -1.71 0.00 0.00 66.02 62.10 3hbb s SER 273 CO -0.00 -0.18 1.25 0.18 1.20 0.00 0.00 173.24 175.69 3hbb n LEU 274 N 4.33 3.00 -4.77 3.45 4.32 0.18 -4.61 117.00 122.90 3hbb n LEU 274 Ca -0.01 -1.10 -0.41 0.00 -0.02 0.00 0.00 56.01 54.47 3hbb n LEU 274 Cb 0.51 -0.05 -0.01 0.00 -1.62 0.00 0.00 43.42 42.25 3hbb n LEU 274 CO 0.46 0.54 1.03 -0.13 -1.22 0.00 0.00 177.39 178.06 3hbb s ARG 275 N -1.80 4.19 -1.20 3.23 0.52 -1.19 -3.63 118.95 119.06 3hbb s ARG 275 Ca 0.29 2.33 -0.04 0.00 -0.52 0.00 0.00 55.73 57.78 3hbb s ARG 275 Cb 0.20 -2.97 -0.02 0.00 0.52 0.00 0.00 34.95 32.68 3hbb s ARG 275 CO 0.29 -0.37 0.82 0.09 0.02 0.00 0.00 175.30 176.15 3hbb n ASN 276 N 0.54 -3.15 0.00 0.23 3.02 -1.26 -2.50 115.26 112.13 3hbb n ASN 276 Ca 0.01 -0.79 0.00 0.00 -0.03 0.00 0.00 54.58 53.77 3hbb n ASN 276 Cb 0.41 -4.42 0.00 0.00 -0.61 0.00 0.00 39.78 35.16 3hbb n ASN 276 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 3hbb n ASN 277 N -3.05 -2.94 -4.78 6.41 4.13 -1.25 -4.97 115.26 108.81 3hbb n ASN 277 Ca -0.22 0.00 -0.41 0.00 1.68 0.00 0.00 54.58 55.63 3hbb n ASN 277 Cb 0.65 -1.94 -0.01 0.00 -1.54 0.00 0.00 39.78 36.95 3hbb n ASN 277 CO 0.00 0.00 0.00 -0.13 0.28 0.00 0.00 177.26 177.41 3hbb s ARG 278 N -0.94 4.16 -0.12 3.52 1.81 -1.04 -0.60 118.95 125.74 3hbb s ARG 278 Ca 0.00 2.49 -0.02 0.00 -1.72 0.00 0.00 55.73 56.48 3hbb s ARG 278 Cb 0.00 -2.99 0.04 0.00 -0.45 0.00 0.00 34.95 31.55 3hbb s ARG 278 CO 0.00 -0.46 0.01 -1.17 -0.68 0.00 0.00 175.30 173.01 3hbb s LEU 279 N -2.02 0.82 -1.01 2.53 2.96 -0.81 -4.55 118.68 116.59 3hbb s LEU 279 Ca 0.52 -0.37 -0.08 0.00 -0.22 0.00 0.00 54.13 53.98 3hbb s LEU 279 Cb -0.45 -0.51 -0.06 0.00 0.50 0.00 0.00 46.19 45.67 3hbb s LEU 279 CO 0.61 -0.24 2.21 -0.81 -1.32 0.00 0.00 176.35 176.80 3hbb n PRO 280 N 5.11 2.27 -2.74 0.98 -0.04 -1.26 -3.74 135.00 135.58 3hbb n PRO 280 Ca -0.08 -1.60 -0.43 0.00 -0.04 0.00 0.00 63.50 61.35 3hbb n PRO 280 Cb 0.49 -2.55 -0.03 0.00 -0.04 0.00 0.00 33.50 31.37 3hbb n PRO 280 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 3hbb s LEU 281 N 0.22 3.88 0.31 1.53 1.43 -1.26 -4.42 118.68 120.38 3hbb s LEU 281 Ca 0.45 0.29 -0.28 0.00 -1.03 0.00 0.00 54.13 53.56 3hbb s LEU 281 Cb 0.12 -3.32 -0.13 0.00 0.03 0.00 0.00 46.19 42.88 3hbb s LEU 281 CO -0.03 -1.10 1.16 0.18 0.23 0.00 0.00 176.35 176.80 3hbb n LEU 282 N 7.35 2.71 -0.01 1.79 4.32 -1.26 -4.65 117.00 127.24 3hbb n LEU 282 Ca 0.08 1.19 0.08 0.00 -0.02 0.00 0.00 56.01 57.35 3hbb n LEU 282 Cb 0.49 -1.39 -0.14 0.00 -1.62 0.00 0.00 43.42 40.76 3hbb n LEU 282 CO 0.66 -0.91 -0.73 0.35 -1.22 0.00 0.00 177.39 175.54 3hbb n THR 283 N 0.32 0.06 0.69 -5.08 -2.24 -1.26 -4.37 114.28 102.39 3hbb n THR 283 Ca 0.07 -0.42 0.11 0.00 -2.27 0.00 0.00 64.05 61.54 3hbb n THR 283 Cb 0.34 0.06 0.45 0.00 -2.10 0.00 0.00 70.33 69.09 3hbb n THR 283 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 3hbb n THR 284 N -2.14 0.57 -3.67 4.28 -2.24 -1.26 -0.93 114.28 108.89 3hbb n THR 284 Ca -0.04 0.10 -0.11 0.00 -2.27 0.00 0.00 64.05 61.73 3hbb n THR 284 Cb 0.49 -0.79 -0.08 0.00 -2.10 0.00 0.00 70.33 67.84 3hbb n THR 284 CO 0.00 0.00 0.00 -0.75 -0.57 0.00 0.00 175.07 173.75 3hbb s LYS 285 N -3.05 0.63 0.14 -0.78 2.20 -1.26 -4.69 119.74 112.93 3hbb s LYS 285 Ca 0.10 0.93 -0.31 0.00 -0.36 0.00 0.00 55.97 56.33 3hbb s LYS 285 Cb 0.13 0.20 -0.10 0.00 -1.51 0.00 0.00 37.83 36.55 3hbb s LYS 285 CO 0.41 -0.12 1.62 0.50 -0.36 0.00 0.00 175.35 177.40 3hbb s ARG 286 N 0.95 4.20 -0.05 4.03 3.52 -1.26 -4.74 118.95 125.60 3hbb s ARG 286 Ca -0.05 2.39 -0.16 0.00 -0.13 0.00 0.00 55.73 57.78 3hbb s ARG 286 Cb -0.05 -3.27 -0.05 0.00 -1.56 0.00 0.00 34.95 30.01 3hbb s ARG 286 CO -0.08 -0.66 0.44 0.08 -0.81 0.00 0.00 175.30 174.26 3hbb s VAL 287 N 1.58 5.08 -1.09 7.11 1.01 -1.26 -5.00 120.40 127.83 3hbb s VAL 287 Ca 0.72 0.90 -0.20 0.00 0.00 0.00 0.00 61.98 63.40 3hbb s VAL 287 Cb -0.44 -3.77 -0.07 0.00 0.00 0.00 0.00 36.38 32.11 3hbb s VAL 287 CO 0.32 0.47 1.95 0.33 0.00 0.00 0.00 175.10 178.16 3hbb n PHE 288 N 2.64 2.84 -0.30 5.22 7.35 -1.26 -4.77 117.46 129.17 3hbb n PHE 288 Ca -0.11 -2.05 -0.00 0.00 -0.76 0.00 0.00 57.45 54.53 3hbb n PHE 288 Cb 0.52 -2.27 0.18 0.00 0.35 0.00 0.00 39.48 38.26 3hbb n PHE 288 CO 0.00 0.00 0.00 2.35 -0.76 0.00 0.00 176.76 178.35 3hbb h TRP 289 N 8.09 1.11 -0.72 -5.13 2.91 -1.98 -1.75 115.95 118.48 3hbb h TRP 289 Ca 0.39 0.03 0.03 0.00 1.13 0.00 0.00 58.89 60.47 3hbb h TRP 289 Cb 0.78 -0.37 -0.04 0.00 -0.51 0.00 0.00 29.16 29.01 3hbb h TRP 289 CO 1.30 0.68 0.47 -0.09 -1.03 0.00 0.00 178.44 179.77 3hbb h ARG 290 N 1.18 0.85 -0.23 2.65 2.43 -2.00 0.21 114.38 119.47 3hbb h ARG 290 Ca 0.34 -0.05 -0.19 0.00 -0.81 0.00 0.00 59.98 59.26 3hbb h ARG 290 Cb -0.09 -0.19 0.00 0.00 -0.42 0.00 0.00 29.97 29.27 3hbb h ARG 290 CO -0.08 0.56 -0.61 0.78 -1.51 0.00 0.00 179.97 179.10 3hbb h GLY 291 N 0.88 0.86 0.82 2.80 0.00 -1.80 -1.96 103.07 104.67 3hbb h GLY 291 Ca 0.29 -1.06 0.04 0.00 0.00 0.00 0.00 47.33 46.59 3hbb h GLY 291 CO -0.08 0.95 0.45 -2.08 0.00 0.00 0.00 176.54 175.78 3hbb h VAL 292 N 0.58 1.07 -0.05 4.60 2.07 -0.39 -1.86 116.25 122.27 3hbb h VAL 292 Ca -0.01 -0.30 -0.06 0.00 0.82 0.00 0.00 66.70 67.16 3hbb h VAL 292 Cb 1.22 0.13 0.00 0.00 -1.52 0.00 0.00 31.29 31.12 3hbb h VAL 292 CO 0.13 0.16 -0.20 0.00 0.02 0.00 0.00 177.57 177.67 3hbb h GLU 294 N -0.31 0.08 0.04 0.00 4.39 -1.32 -2.35 114.58 115.12 3hbb h GLU 294 Ca -0.01 -0.02 -0.27 0.00 0.34 0.00 0.00 59.36 59.40 3hbb h GLU 294 Cb 0.84 -0.01 0.02 0.00 -0.10 0.00 0.00 28.75 29.51 3hbb h GLU 294 CO 0.04 0.26 -1.08 1.49 -1.16 0.00 0.00 179.01 178.56 3hbb h GLU 295 N 0.08 0.66 -0.54 2.33 4.81 -1.36 -2.73 114.58 117.83 3hbb h GLU 295 Ca 0.01 -0.77 -0.11 0.00 -0.13 0.00 0.00 59.36 58.37 3hbb h GLU 295 Cb 0.35 0.23 -0.02 0.00 0.63 0.00 0.00 28.75 29.95 3hbb h GLU 295 CO 0.02 1.33 -0.09 1.25 -0.73 0.00 0.00 179.01 180.80 3hbb h LEU 296 N 0.32 1.01 -0.77 1.64 5.85 -1.21 0.11 115.31 122.27 3hbb h LEU 296 Ca -0.15 -0.32 -0.05 0.00 0.84 0.00 0.00 57.88 58.20 3hbb h LEU 296 Cb 1.74 -0.27 -0.03 0.00 0.37 0.00 0.00 40.66 42.47 3hbb h LEU 296 CO 0.21 1.11 0.30 -0.07 -0.34 0.00 0.00 178.44 179.65 3hbb h LEU 297 N 0.91 1.07 -0.27 2.25 4.07 -1.52 -0.21 115.31 121.61 3hbb h LEU 297 Ca 0.14 -0.18 0.02 0.00 0.08 0.00 0.00 57.88 57.94 3hbb h LEU 297 Cb 0.65 -0.28 -0.02 0.00 1.08 0.00 0.00 40.66 42.09 3hbb h LEU 297 CO 0.05 0.96 0.13 -0.25 -1.08 0.00 0.00 178.44 178.25 3hbb h TRP 298 N 1.12 0.25 0.41 1.13 7.01 -1.15 -1.04 115.95 123.69 3hbb h TRP 298 Ca 0.25 0.01 -0.01 0.00 2.11 0.00 0.00 58.89 61.26 3hbb h TRP 298 Cb 0.23 -0.07 -0.03 0.00 -2.10 0.00 0.00 29.16 27.19 3hbb h TRP 298 CO 0.02 0.14 -0.48 0.74 -2.79 0.00 0.00 178.44 176.06 3hbb h PHE 299 N 0.28 -1.35 -0.85 2.65 0.04 -0.36 -2.49 116.94 114.86 3hbb h PHE 299 Ca 0.11 0.01 0.19 0.00 2.80 0.00 0.00 57.97 61.08 3hbb h PHE 299 Cb 0.03 0.53 -0.06 0.00 2.20 0.00 0.00 35.95 38.66 3hbb h PHE 299 CO -0.09 -0.63 0.57 -0.07 -0.60 0.00 0.00 178.31 177.48 3hbb h LEU 300 N -0.92 0.35 -0.47 1.54 3.38 -0.91 0.30 115.31 118.59 3hbb h LEU 300 Ca -0.04 0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.96 3hbb h LEU 300 Cb 0.83 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.54 3hbb h LEU 300 CO -0.10 0.15 0.00 0.54 0.09 0.00 0.00 178.44 179.12 3hbb n ARG 301 N -4.48 0.16 -1.05 1.13 1.74 -0.40 -4.88 116.66 108.87 3hbb n ARG 301 Ca 0.18 0.35 0.00 0.00 -0.77 0.00 0.00 57.85 57.61 3hbb n ARG 301 Cb 0.67 -1.78 0.00 0.00 -1.02 0.00 0.00 32.46 30.33 3hbb n ARG 301 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3hbb n GLY 302 N 0.17 0.41 3.78 -0.13 0.00 0.11 -5.02 105.19 104.51 3hbb n GLY 302 Ca 0.03 -1.04 -0.36 0.00 0.00 0.00 0.00 46.02 44.65 3hbb n GLY 302 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3hbb s GLU 303 N -2.10 3.92 0.00 1.61 2.56 -0.95 -3.92 118.70 119.82 3hbb s GLU 303 Ca 0.00 1.58 0.00 0.00 0.00 0.00 0.00 54.97 56.55 3hbb s GLU 303 Cb 0.00 -2.39 0.00 0.00 2.00 0.00 0.00 34.13 33.74 3hbb s GLU 303 CO 0.00 -0.37 0.08 0.25 -0.56 0.00 0.00 175.26 174.65 3hbb n THR 304 N -0.44 0.00 -2.83 -1.70 -2.24 -1.26 -4.39 114.28 101.41 3hbb n THR 304 Ca 0.07 -0.27 -0.43 0.00 -2.27 0.00 0.00 64.05 61.15 3hbb n THR 304 Cb 0.50 1.13 -0.04 0.00 -2.10 0.00 0.00 70.33 69.81 3hbb n THR 304 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 3hbb s TYR 305 N -0.39 2.89 -0.88 4.78 5.04 -1.26 -2.12 117.35 125.41 3hbb s TYR 305 Ca 0.00 0.27 0.24 0.00 -2.44 0.00 0.00 57.07 55.14 3hbb s TYR 305 Cb 0.00 -3.98 0.97 0.00 0.35 0.00 0.00 41.96 39.30 3hbb s TYR 305 CO 0.00 -1.16 1.76 0.00 -1.34 0.00 0.00 175.55 174.81 3hbb n ALA 306 N 7.22 2.07 0.16 3.97 0.00 0.67 -2.64 120.51 131.95 3hbb n ALA 306 Ca 0.05 -0.05 0.01 0.00 0.00 0.00 0.00 53.44 53.45 3hbb n ALA 306 Cb 0.48 -1.40 0.32 0.00 0.00 0.00 0.00 19.45 18.85 3hbb n ALA 306 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 3hbb h LYS 307 N 0.00 0.08 -0.16 0.00 3.64 -1.92 -2.49 116.57 115.73 3hbb h LYS 307 Ca 0.00 -0.03 0.04 0.00 -1.27 0.00 0.00 60.65 59.39 3hbb h LYS 307 Cb 0.47 -0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.28 3hbb h LYS 307 CO 0.00 0.44 0.24 0.87 -2.27 0.00 0.00 179.45 178.73 3hbb h LYS 308 N 0.07 0.00 0.02 1.90 1.57 -1.89 0.21 116.57 118.45 3hbb h LYS 308 Ca 0.01 0.00 -0.22 0.00 -1.87 0.00 0.00 60.65 58.56 3hbb h LYS 308 Cb 0.69 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.97 3hbb h LYS 308 CO 0.05 0.00 -1.21 -0.07 -0.57 0.00 0.00 179.45 177.65 3hbb h LEU 309 N 0.00 0.07 -1.26 2.94 4.07 -1.65 -3.35 115.31 116.12 3hbb h LEU 309 Ca 0.07 -0.63 -0.05 0.00 0.08 0.00 0.00 57.88 57.36 3hbb h LEU 309 Cb 0.56 -0.02 -0.02 0.00 1.08 0.00 0.00 40.66 42.26 3hbb h LEU 309 CO -0.00 1.48 0.00 0.77 -1.08 0.00 0.00 178.44 179.62 3hbb h SER 310 N -0.85 0.47 -0.12 -0.43 4.64 -0.92 -0.01 113.55 116.33 3hbb h SER 310 Ca -0.32 -0.08 0.03 0.00 -0.47 0.00 0.00 61.79 60.96 3hbb h SER 310 Cb 1.38 -0.12 -0.00 0.00 -0.31 0.00 0.00 62.40 63.34 3hbb h SER 310 CO -0.14 0.53 0.12 0.44 -0.87 0.00 0.00 176.83 176.91 3hbb h ASP 311 N 0.48 0.00 -0.61 4.97 3.32 -0.79 -0.11 116.42 123.68 3hbb h ASP 311 Ca 0.11 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.16 3hbb h ASP 311 Cb 0.31 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.86 3hbb h ASP 311 CO 0.01 0.00 0.00 0.29 -1.72 0.00 0.00 179.24 177.82 3hbb n LYS 312 N -3.99 2.94 -1.04 3.56 5.02 -0.11 -4.92 118.16 119.62 3hbb n LYS 312 Ca -0.00 -2.42 -0.01 0.00 -2.02 0.00 0.00 58.31 53.86 3hbb n LYS 312 Cb 0.23 -1.66 -0.01 0.00 -0.02 0.00 0.00 35.03 33.58 3hbb n LYS 312 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3hbb n GLY 313 N 1.30 0.50 3.25 0.72 0.00 -0.05 -5.00 105.19 105.91 3hbb n GLY 313 Ca 0.22 -0.74 -0.38 0.00 0.00 0.00 0.00 46.02 45.12 3hbb n GLY 313 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3hbb s VAL 314 N -2.03 3.86 -0.25 1.61 1.01 -0.64 -4.98 120.40 118.99 3hbb s VAL 314 Ca 0.00 -1.35 0.13 0.00 0.00 0.00 0.00 61.98 60.77 3hbb s VAL 314 Cb 0.00 -3.30 0.64 0.00 0.00 0.00 0.00 36.38 33.71 3hbb s VAL 314 CO 0.00 -0.36 1.60 1.41 0.00 0.00 0.00 175.10 177.75 3hbb n HIS 315 N 4.82 1.60 0.21 5.22 8.25 -1.26 -2.19 115.22 131.87 3hbb n HIS 315 Ca -0.10 -1.06 0.05 0.00 -0.26 0.00 0.00 57.72 56.34 3hbb n HIS 315 Cb 0.44 -0.49 0.46 0.00 1.12 0.00 0.00 29.99 31.52 3hbb n HIS 315 CO 0.00 0.00 0.00 -0.84 0.64 0.00 0.00 176.34 176.14 3hbb h ILE 316 N 2.27 1.13 -0.40 1.59 3.07 -1.95 -2.12 117.51 121.10 3hbb h ILE 316 Ca 0.12 -0.89 0.00 0.00 1.55 0.00 0.00 64.86 65.64 3hbb h ILE 316 Cb 1.84 1.49 0.00 0.00 -0.27 0.00 0.00 36.82 39.87 3hbb h ILE 316 CO 0.45 0.25 0.00 0.79 -1.05 0.00 0.00 178.15 178.59 3hbb n TRP 317 N -4.16 0.52 0.31 0.16 7.02 -1.26 -4.62 117.44 115.42 3hbb n TRP 317 Ca -0.02 -0.26 -0.17 0.00 -1.02 0.00 0.00 57.50 56.03 3hbb n TRP 317 Cb 0.31 0.00 -0.09 0.00 -2.42 0.00 0.00 31.31 29.12 3hbb n TRP 317 CO 0.00 0.00 0.00 -0.44 -2.02 0.00 0.00 177.69 175.23 3hbb h ASP 318 N 3.38 -0.65 -0.06 -0.99 5.19 -1.72 -2.23 116.42 119.34 3hbb h ASP 318 Ca 0.00 0.00 0.04 0.00 -0.62 0.00 0.00 57.03 56.45 3hbb h ASP 318 Cb 0.75 0.17 -0.06 0.00 0.18 0.00 0.00 39.33 40.37 3hbb h ASP 318 CO 0.00 -0.43 -0.40 0.44 -3.12 0.00 0.00 179.24 175.73 3hbb h ASP 319 N -0.81 -1.23 0.03 6.45 3.32 -1.82 -2.11 116.42 120.25 3hbb h ASP 319 Ca -0.08 0.16 0.00 0.00 0.02 0.00 0.00 57.03 57.13 3hbb h ASP 319 Cb 0.60 0.49 0.00 0.00 0.22 0.00 0.00 39.33 40.65 3hbb h ASP 319 CO 0.13 -0.43 0.00 0.59 -1.72 0.00 0.00 179.24 177.81 3hbb n ASN 320 N -5.44 0.00 -0.07 6.45 3.02 -1.16 -2.34 115.26 115.71 3hbb n ASN 320 Ca -0.05 -0.24 0.01 0.00 -0.03 0.00 0.00 54.58 54.27 3hbb n ASN 320 Cb 0.36 -0.05 0.01 0.00 -0.61 0.00 0.00 39.78 39.49 3hbb n ASN 320 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3hbb n GLY 321 N -0.38 -1.22 3.81 7.41 0.00 -0.81 -4.70 105.19 109.30 3hbb n GLY 321 Ca 0.07 -0.05 -0.33 0.00 0.00 0.00 0.00 46.02 45.71 3hbb n GLY 321 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3hbb s SER 322 N -0.19 6.14 0.27 1.61 1.04 -0.99 -0.11 113.70 121.47 3hbb s SER 322 Ca 0.02 1.82 -0.02 0.00 0.48 0.00 0.00 55.95 58.25 3hbb s SER 322 Cb 0.02 -2.54 0.58 0.00 0.10 0.00 0.00 66.02 64.17 3hbb s SER 322 CO 0.03 -0.92 1.66 -0.09 0.98 0.00 0.00 173.24 174.90 3hbb h ARG 323 N 0.97 0.23 0.05 4.02 9.65 -1.94 -0.64 114.38 126.72 3hbb h ARG 323 Ca -0.48 -0.01 -0.00 0.00 -1.10 0.00 0.00 59.98 58.39 3hbb h ARG 323 Cb 1.21 -0.05 -0.00 0.00 -1.39 0.00 0.00 29.97 29.74 3hbb h ARG 323 CO 0.59 0.15 -0.03 0.00 2.80 0.00 0.00 179.97 183.47 3hbb h ALA 324 N 1.70 -0.07 -0.31 2.80 0.00 -1.94 -2.37 119.26 119.07 3hbb h ALA 324 Ca 0.48 -0.01 -0.07 0.00 0.00 0.00 0.00 54.91 55.31 3hbb h ALA 324 Cb 0.89 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.72 3hbb h ALA 324 CO -0.59 -0.54 -0.09 0.35 0.00 0.00 0.00 179.25 178.38 3hbb h PHE 325 N -0.08 0.68 -0.64 0.00 3.57 -1.51 -1.74 116.94 117.22 3hbb h PHE 325 Ca -0.00 -0.15 0.02 0.00 3.53 0.00 0.00 57.97 61.37 3hbb h PHE 325 Cb 0.07 -0.16 -0.04 0.00 2.79 0.00 0.00 35.95 38.61 3hbb h PHE 325 CO -0.09 0.79 0.40 -0.07 -2.23 0.00 0.00 178.31 177.11 3hbb h LEU 326 N 0.37 0.65 -1.70 0.59 3.38 -1.17 -0.45 115.31 116.99 3hbb h LEU 326 Ca 0.08 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.05 3hbb h LEU 326 Cb 0.58 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.17 3hbb h LEU 326 CO 0.03 0.46 0.19 0.44 0.09 0.00 0.00 178.44 179.65 3hbb h ASP 327 N 0.78 0.34 0.91 -0.43 3.32 -1.33 0.19 116.42 120.20 3hbb h ASP 327 Ca 0.25 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.29 3hbb h ASP 327 Cb 0.00 -0.09 0.00 0.00 0.22 0.00 0.00 39.33 39.47 3hbb h ASP 327 CO -0.10 0.25 0.00 0.77 -1.72 0.00 0.00 179.24 178.45 3hbb h SER 328 N 0.40 0.00 -0.46 6.45 4.64 -0.15 -2.33 113.55 122.10 3hbb h SER 328 Ca 0.11 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.43 3hbb h SER 328 Cb -0.04 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.05 3hbb h SER 328 CO -0.02 0.00 0.00 0.54 -0.87 0.00 0.00 176.83 176.48 3hbb n ARG 329 N -2.56 2.86 -1.11 4.77 5.12 -0.73 -4.96 116.66 120.06 3hbb n ARG 329 Ca 0.02 -2.26 -0.04 0.00 -1.93 0.00 0.00 57.85 53.64 3hbb n ARG 329 Cb 0.28 -1.38 -0.02 0.00 -1.16 0.00 0.00 32.46 30.18 3hbb n ARG 329 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 3hbb n GLY 330 N 0.80 0.68 2.74 -0.13 0.00 -0.88 -4.94 105.19 103.45 3hbb n GLY 330 Ca 0.16 -0.75 -0.38 0.00 0.00 0.00 0.00 46.02 45.05 3hbb n GLY 330 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3hbb n LEU 331 N -0.43 7.33 0.24 0.99 4.77 0.58 -4.70 117.00 125.78 3hbb n LEU 331 Ca -0.04 -4.80 0.16 0.00 -0.03 0.00 0.00 56.01 51.31 3hbb n LEU 331 Cb 0.14 -1.15 0.75 0.00 -2.33 0.00 0.00 43.42 40.83 3hbb n LEU 331 CO 0.06 1.84 0.98 0.71 -1.33 0.00 0.00 177.39 179.65 3hbb h THR 332 N 2.09 0.00 0.00 -5.08 1.35 -1.89 -2.51 112.91 106.87 3hbb h THR 332 Ca 0.54 -0.24 -0.02 0.00 -0.55 0.00 0.00 66.41 66.13 3hbb h THR 332 Cb 0.25 1.10 -0.00 0.00 -1.73 0.00 0.00 68.15 67.77 3hbb h THR 332 CO 1.27 0.00 -0.50 -0.33 -0.25 0.00 0.00 175.52 175.71 3hbb h GLU 333 N 0.00 0.00 -6.81 4.72 4.39 -1.95 -3.46 114.58 111.46 3hbb h GLU 333 Ca 0.00 0.00 -0.50 0.00 0.34 0.00 0.00 59.36 59.20 3hbb h GLU 333 Cb 0.28 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 28.93 3hbb h GLU 333 CO 0.00 0.08 0.43 0.71 -1.16 0.00 0.00 179.01 179.07 3hbb s TYR 334 N -3.21 3.67 0.40 4.33 2.02 -0.95 -5.03 117.35 118.58 3hbb s TYR 334 Ca 0.03 1.76 -0.24 0.00 -0.37 0.00 0.00 57.07 58.25 3hbb s TYR 334 Cb 0.07 -3.18 -0.09 0.00 -0.40 0.00 0.00 41.96 38.37 3hbb s TYR 334 CO 0.73 -0.25 1.08 -2.00 -1.57 0.00 0.00 175.55 173.53 3hbb s GLU 335 N -1.48 4.12 0.02 -0.62 2.12 -1.26 -4.94 118.70 116.66 3hbb s GLU 335 Ca 0.45 1.59 -0.38 0.00 0.36 0.00 0.00 54.97 56.99 3hbb s GLU 335 Cb -0.29 -2.56 -0.17 0.00 0.26 0.00 0.00 34.13 31.37 3hbb s GLU 335 CO 0.37 -0.20 1.37 -1.91 -0.54 0.00 0.00 175.26 174.36 3hbb n GLU 336 N -0.06 1.02 -0.43 4.30 2.13 -1.26 -0.65 120.64 125.69 3hbb n GLU 336 Ca 0.05 0.37 0.00 0.00 0.66 0.00 0.00 57.16 58.24 3hbb n GLU 336 Cb 0.49 -2.00 0.00 0.00 0.27 0.00 0.00 31.44 30.20 3hbb n GLU 336 CO 0.00 0.00 0.00 -1.33 -0.41 0.00 0.00 177.13 175.39 3hbb n MET 337 N 2.84 0.00 -2.81 5.31 2.81 0.85 -4.94 117.12 121.18 3hbb n MET 337 Ca 0.20 0.00 -0.43 0.00 -1.81 0.00 0.00 57.70 55.66 3hbb n MET 337 Cb 0.17 -1.54 -0.04 0.00 -0.71 0.00 0.00 33.22 31.09 3hbb n MET 337 CO 0.00 0.00 0.00 0.34 1.51 0.00 0.00 175.97 177.82 3hbb s ASP 338 N -3.20 6.38 0.00 7.83 -1.08 0.17 -0.24 116.67 126.53 3hbb s ASP 338 Ca 0.00 -0.21 0.28 0.00 -0.52 0.00 0.00 52.55 52.10 3hbb s ASP 338 Cb 0.00 -2.45 1.13 0.00 -1.46 0.00 0.00 42.92 40.14 3hbb s ASP 338 CO 0.00 -1.21 1.80 0.18 0.52 0.00 0.00 175.17 176.46 3hbb n LEU 339 N 7.48 0.50 0.00 -1.34 4.77 -0.90 -4.72 117.00 122.79 3hbb n LEU 339 Ca 0.03 0.01 0.00 0.00 -0.03 0.00 0.00 56.01 56.02 3hbb n LEU 339 Cb 0.48 -0.20 0.00 0.00 -2.33 0.00 0.00 43.42 41.37 3hbb n LEU 339 CO 0.64 0.10 0.00 0.61 -1.33 0.00 0.00 177.39 177.41 3hbb n GLY 340 N 1.32 -2.22 2.42 -0.72 0.00 -1.26 -1.24 105.19 103.48 3hbb n GLY 340 Ca 0.13 -1.52 -0.14 0.00 0.00 0.00 0.00 46.02 44.49 3hbb n GLY 340 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3hbb n PRO 341 N -0.38 1.57 -1.91 1.61 -0.04 -1.26 -4.81 135.00 129.78 3hbb n PRO 341 Ca 0.00 -0.99 -0.30 0.00 -0.04 0.00 0.00 63.50 62.17 3hbb n PRO 341 Cb 0.00 -2.11 0.06 0.00 -0.04 0.00 0.00 33.50 31.41 3hbb n PRO 341 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 3hbb s VAL 342 N 2.67 3.13 0.00 0.52 -7.23 -1.26 -4.42 120.40 113.81 3hbb s VAL 342 Ca 0.38 0.35 0.00 0.00 -1.81 0.00 0.00 61.98 60.89 3hbb s VAL 342 Cb 0.14 -3.36 0.00 0.00 0.56 0.00 0.00 36.38 33.72 3hbb s VAL 342 CO -0.02 -0.47 0.00 -1.22 -0.31 0.00 0.00 175.10 173.08 3hbb n TYR 343 N -3.07 0.00 -0.34 2.82 4.01 -1.26 -0.60 117.16 118.72 3hbb n TYR 343 Ca 0.07 0.00 0.22 0.00 -0.16 0.00 0.00 57.90 58.03 3hbb n TYR 343 Cb 0.58 0.00 0.47 0.00 -0.31 0.00 0.00 39.34 40.09 3hbb n TYR 343 CO 0.00 0.00 0.00 0.78 -0.46 0.00 0.00 176.86 177.18 3hbb h GLY 344 N 0.00 1.54 0.74 2.72 0.00 -1.82 0.29 103.07 106.54 3hbb h GLY 344 Ca 0.00 -0.24 0.06 0.00 0.00 0.00 0.00 47.33 47.16 3hbb h GLY 344 CO 0.00 -0.23 0.63 -2.75 0.00 0.00 0.00 176.54 174.19 3hbb h PHE 345 N 0.43 1.17 0.00 5.60 3.04 -0.97 -1.35 116.94 124.85 3hbb h PHE 345 Ca 0.64 0.03 -0.13 0.00 3.98 0.00 0.00 57.97 62.50 3hbb h PHE 345 Cb 1.52 -0.38 -0.02 0.00 2.56 0.00 0.00 35.95 39.62 3hbb h PHE 345 CO -0.00 0.61 -0.61 1.96 -2.02 0.00 0.00 178.31 178.24 3hbb h GLN 346 N 1.15 0.00 -0.17 1.11 1.08 -0.52 0.16 115.11 117.92 3hbb h GLN 346 Ca 0.42 0.00 -0.08 0.00 -1.45 0.00 0.00 58.65 57.54 3hbb h GLN 346 Cb 0.16 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.58 3hbb h GLN 346 CO -0.17 0.61 -0.25 -1.49 -0.95 0.00 0.00 178.83 176.57 3hbb h TRP 347 N 0.00 0.33 0.00 2.96 4.06 -0.59 -2.80 115.95 119.92 3hbb h TRP 347 Ca -0.01 -0.06 0.00 0.00 2.06 0.00 0.00 58.89 60.88 3hbb h TRP 347 Cb 1.20 -0.08 0.00 0.00 -1.00 0.00 0.00 29.16 29.27 3hbb h TRP 347 CO 0.00 0.54 -0.75 0.54 -3.56 0.00 0.00 178.44 175.21 3hbb n ARG 348 N -4.15 2.69 -2.72 0.49 5.12 -0.70 -1.42 116.66 115.97 3hbb n ARG 348 Ca -0.01 -0.02 -0.01 0.00 -1.93 0.00 0.00 57.85 55.88 3hbb n ARG 348 Cb 0.37 -0.94 0.07 0.00 -1.16 0.00 0.00 32.46 30.81 3hbb n ARG 348 CO 0.00 0.00 0.00 0.72 -1.93 0.00 0.00 177.63 176.42 3hbb n HIS 349 N -1.41 0.21 -1.68 -1.55 8.25 0.55 -3.50 115.22 116.09 3hbb n HIS 349 Ca -0.00 -1.94 -0.57 0.00 -0.26 0.00 0.00 57.72 54.95 3hbb n HIS 349 Cb 0.11 0.32 -0.07 0.00 1.12 0.00 0.00 29.99 31.47 3hbb n HIS 349 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 3hbb n PHE 350 N -0.84 1.88 -1.00 4.41 -0.00 -0.47 -0.81 117.46 120.63 3hbb n PHE 350 Ca -0.01 0.59 0.00 0.00 -0.00 0.00 0.00 57.45 58.03 3hbb n PHE 350 Cb 0.83 -2.41 0.00 0.00 -0.00 0.00 0.00 39.48 37.90 3hbb n PHE 350 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 3hbb n GLY 351 N 3.73 0.48 3.77 7.13 0.00 -1.26 -1.58 105.19 117.46 3hbb n GLY 351 Ca 0.25 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.88 3hbb n GLY 351 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hbb s ALA 352 N -2.03 3.11 0.00 4.61 0.00 0.01 -4.85 121.76 122.62 3hbb s ALA 352 Ca 0.00 0.99 -0.30 0.00 0.00 0.00 0.00 51.96 52.64 3hbb s ALA 352 Cb 0.00 -3.39 -0.06 0.00 0.00 0.00 0.00 23.12 19.67 3hbb s ALA 352 CO 0.00 -0.60 1.45 0.00 0.00 0.00 0.00 175.76 176.61 3hbb s ALA 353 N -1.43 3.60 0.13 0.00 0.00 -1.26 -4.99 121.76 117.80 3hbb s ALA 353 Ca 0.59 0.93 -0.12 0.00 0.00 0.00 0.00 51.96 53.36 3hbb s ALA 353 Cb -0.31 -3.62 -0.06 0.00 0.00 0.00 0.00 23.12 19.13 3hbb s ALA 353 CO 0.39 -0.97 0.48 -0.47 0.00 0.00 0.00 175.76 175.18 3hbb s TYR 354 N 2.54 3.58 0.00 0.00 5.04 -1.26 -5.00 117.35 122.25 3hbb s TYR 354 Ca 0.66 0.91 0.00 0.00 -2.44 0.00 0.00 57.07 56.20 3hbb s TYR 354 Cb -0.33 -2.26 0.00 0.00 0.35 0.00 0.00 41.96 39.72 3hbb s TYR 354 CO 0.27 0.45 0.00 0.25 -1.34 0.00 0.00 175.55 175.18 3hbb n THR 355 N 0.74 0.00 -4.09 4.34 -2.24 -1.26 -5.10 114.28 106.66 3hbb n THR 355 Ca -0.06 0.00 -0.10 0.00 -2.27 0.00 0.00 64.05 61.62 3hbb n THR 355 Cb 0.52 -0.51 -0.09 0.00 -2.10 0.00 0.00 70.33 68.15 3hbb n THR 355 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 3hbb s HIS 356 N -0.73 0.75 0.42 4.78 0.09 -1.26 -4.98 115.29 114.36 3hbb s HIS 356 Ca 0.00 -1.08 0.08 0.00 -0.00 0.00 0.00 55.06 54.06 3hbb s HIS 356 Cb 0.00 -0.31 0.90 0.00 -0.00 0.00 0.00 32.58 33.16 3hbb s HIS 356 CO 0.00 -0.65 2.07 1.12 -0.00 0.00 0.00 174.74 177.28 3hbb h HIS 357 N 2.66 0.47 -0.44 1.40 2.07 -1.97 -2.79 115.15 116.55 3hbb h HIS 357 Ca -0.33 0.01 0.04 0.00 -2.85 0.00 0.00 60.37 57.24 3hbb h HIS 357 Cb 1.22 -0.16 -0.04 0.00 2.57 0.00 0.00 27.41 31.00 3hbb h HIS 357 CO 0.40 0.30 0.21 -0.44 -3.07 0.00 0.00 177.93 175.32 3hbb h ASP 358 N 0.51 0.29 -2.97 3.10 5.19 -2.02 -3.46 116.42 117.06 3hbb h ASP 358 Ca 0.14 0.03 -0.56 0.00 -0.62 0.00 0.00 57.03 56.02 3hbb h ASP 358 Cb -0.05 -0.02 0.19 0.00 0.18 0.00 0.00 39.33 39.63 3hbb h ASP 358 CO -0.03 0.21 -0.65 0.00 -3.12 0.00 0.00 179.24 175.65 3hbb n ALA 359 N -2.32 -2.20 -2.63 3.45 0.00 -1.05 -4.93 120.51 110.83 3hbb n ALA 359 Ca 0.03 -0.30 -0.43 0.00 0.00 0.00 0.00 53.44 52.74 3hbb n ALA 359 Cb 0.12 -1.72 -0.07 0.00 0.00 0.00 0.00 19.45 17.78 3hbb n ALA 359 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 3hbb s ASN 360 N -1.42 6.24 -0.14 0.00 3.04 -1.26 -4.92 114.94 116.48 3hbb s ASN 360 Ca 0.61 -0.71 0.17 0.00 0.04 0.00 0.00 52.86 52.98 3hbb s ASN 360 Cb -0.34 -2.28 0.73 0.00 -1.54 0.00 0.00 41.25 37.83 3hbb s ASN 360 CO 0.62 -0.78 1.65 -1.22 -3.04 0.00 0.00 177.10 174.33 3hbb n TYR 361 N 6.04 1.58 -1.68 0.43 4.01 -1.26 -4.98 117.16 121.31 3hbb n TYR 361 Ca -0.05 -0.65 -0.53 0.00 -0.16 0.00 0.00 57.90 56.51 3hbb n TYR 361 Cb 0.46 -0.30 -0.06 0.00 -0.31 0.00 0.00 39.34 39.13 3hbb n TYR 361 CO 0.00 0.00 0.00 -0.25 -0.46 0.00 0.00 176.86 176.15 3hbb n ASP 362 N 0.96 2.56 -1.48 7.72 8.00 -1.26 -1.21 116.55 131.83 3hbb n ASP 362 Ca 0.26 1.06 -0.16 0.00 0.71 0.00 0.00 54.79 56.66 3hbb n ASP 362 Cb 0.95 -1.23 -0.04 0.00 -0.02 0.00 0.00 41.12 40.78 3hbb n ASP 362 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3hbb n GLY 363 N 3.84 0.77 3.61 0.44 0.00 -1.26 -4.99 105.19 107.60 3hbb n GLY 363 Ca 0.23 -0.24 -0.34 0.00 0.00 0.00 0.00 46.02 45.66 3hbb n GLY 363 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3hbb s GLN 364 N -3.99 2.94 1.27 1.61 -1.52 -0.35 -5.01 119.66 114.61 3hbb s GLN 364 Ca 0.00 -0.49 0.00 0.00 -1.95 0.00 0.00 55.36 52.92 3hbb s GLN 364 Cb 0.00 -2.70 0.00 0.00 -0.22 0.00 0.00 33.01 30.09 3hbb s GLN 364 CO 0.00 0.63 0.00 0.41 -0.25 0.00 0.00 175.29 176.08 3hbb n GLY 365 N 2.33 -1.81 3.65 3.09 0.00 -1.26 -4.23 105.19 106.96 3hbb n GLY 365 Ca -0.18 -1.33 -0.38 0.00 0.00 0.00 0.00 46.02 44.13 3hbb n GLY 365 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3hbb s VAL 366 N 0.00 5.27 -1.10 1.61 1.01 -0.61 -4.70 120.40 121.88 3hbb s VAL 366 Ca 0.00 0.43 -0.17 0.00 0.00 0.00 0.00 61.98 62.24 3hbb s VAL 366 Cb 0.00 -3.61 0.13 0.00 0.00 0.00 0.00 36.38 32.89 3hbb s VAL 366 CO 0.00 0.28 1.37 -0.62 0.00 0.00 0.00 175.10 176.12 3hbb s ASP 367 N 1.19 6.82 0.18 3.32 -1.08 -1.23 -1.37 116.67 124.50 3hbb s ASP 367 Ca 0.13 -2.41 -0.11 0.00 -0.52 0.00 0.00 52.55 49.64 3hbb s ASP 367 Cb -0.14 -2.44 0.08 0.00 -1.46 0.00 0.00 42.92 38.96 3hbb s ASP 367 CO 0.07 -1.00 1.73 1.56 0.52 0.00 0.00 175.17 178.04 3hbb h GLN 368 N 8.11 0.94 -0.32 4.34 4.20 -1.49 -2.54 115.11 128.36 3hbb h GLN 368 Ca 0.26 -0.18 -0.01 0.00 0.06 0.00 0.00 58.65 58.78 3hbb h GLN 368 Cb 0.94 -0.15 -0.01 0.00 0.30 0.00 0.00 27.48 28.56 3hbb h GLN 368 CO 1.24 0.81 0.16 0.82 -0.67 0.00 0.00 178.83 181.19 3hbb h ILE 369 N 0.88 1.15 -0.74 2.54 1.08 -1.83 -1.84 117.51 118.75 3hbb h ILE 369 Ca 0.21 -0.42 0.01 0.00 -0.39 0.00 0.00 64.86 64.27 3hbb h ILE 369 Cb 0.23 0.85 -0.04 0.00 -3.07 0.00 0.00 36.82 34.79 3hbb h ILE 369 CO -0.01 0.16 0.49 0.50 -0.69 0.00 0.00 178.15 178.59 3hbb h LYS 370 N 0.38 0.95 -0.48 2.37 3.64 -1.84 -1.60 116.57 119.99 3hbb h LYS 370 Ca 0.11 -0.06 0.02 0.00 -1.27 0.00 0.00 60.65 59.45 3hbb h LYS 370 Cb 0.10 -0.21 -0.03 0.00 -0.41 0.00 0.00 32.23 31.68 3hbb h LYS 370 CO -0.01 0.63 0.29 0.00 -2.27 0.00 0.00 179.45 178.09 3hbb h ALA 371 N 1.28 0.61 0.05 5.00 0.00 -1.10 -1.38 119.26 123.73 3hbb h ALA 371 Ca 0.28 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.17 3hbb h ALA 371 Cb -0.08 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.56 3hbb h ALA 371 CO -0.07 -0.01 -0.02 0.82 0.00 0.00 0.00 179.25 179.97 3hbb h ILE 372 N 0.58 1.10 -0.58 0.00 2.04 -1.01 -0.54 117.51 119.09 3hbb h ILE 372 Ca 0.19 -0.50 0.12 0.00 1.00 0.00 0.00 64.86 65.67 3hbb h ILE 372 Cb -0.00 1.43 -0.11 0.00 -0.74 0.00 0.00 36.82 37.40 3hbb h ILE 372 CO -0.08 0.13 -0.12 0.58 0.00 0.00 0.00 178.15 178.66 3hbb h VAL 373 N -0.29 0.43 -0.57 1.67 2.07 -1.15 0.15 116.25 118.56 3hbb h VAL 373 Ca -0.01 -0.01 -0.07 0.00 0.82 0.00 0.00 66.70 67.44 3hbb h VAL 373 Cb 0.26 0.41 -0.02 0.00 -1.52 0.00 0.00 31.29 30.42 3hbb h VAL 373 CO 0.01 0.00 0.09 -0.08 0.02 0.00 0.00 177.57 177.62 3hbb h GLU 374 N 0.02 0.94 0.30 1.57 4.57 -1.06 -2.81 114.58 118.11 3hbb h GLU 374 Ca 0.29 -0.25 -0.01 0.00 -1.18 0.00 0.00 59.36 58.20 3hbb h GLU 374 Cb 0.44 -0.11 0.00 0.00 -0.16 0.00 0.00 28.75 28.92 3hbb h GLU 374 CO -0.58 0.90 -0.14 1.15 -1.18 0.00 0.00 179.01 179.15 3hbb h THR 375 N 0.84 0.73 -1.12 0.32 2.02 -0.33 -2.94 112.91 112.44 3hbb h THR 375 Ca 0.17 -0.27 0.33 0.00 0.77 0.00 0.00 66.41 67.41 3hbb h THR 375 Cb 0.41 0.88 -0.12 0.00 -1.74 0.00 0.00 68.15 67.59 3hbb h THR 375 CO 0.01 0.06 0.70 -0.07 0.37 0.00 0.00 175.52 176.59 3hbb h LEU 376 N -0.54 0.41 -0.68 2.58 3.38 -0.69 0.33 115.31 120.10 3hbb h LEU 376 Ca -0.04 0.12 -0.09 0.00 0.09 0.00 0.00 57.88 57.96 3hbb h LEU 376 Cb 0.40 0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.21 3hbb h LEU 376 CO 0.07 -0.03 -0.42 0.11 0.09 0.00 0.00 178.44 178.25 3hbb h LYS 377 N 0.30 0.00 0.00 1.13 1.57 -1.32 -3.33 116.57 114.91 3hbb h LYS 377 Ca 0.69 0.00 -0.23 0.00 -1.87 0.00 0.00 60.65 59.24 3hbb h LYS 377 Cb 1.85 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 34.12 3hbb h LYS 377 CO -0.40 0.42 -1.81 0.25 -0.57 0.00 0.00 179.45 177.34 3hbb n THR 378 N -3.44 0.81 -3.72 -0.16 -2.24 0.68 -4.87 114.28 101.34 3hbb n THR 378 Ca 0.00 -0.26 -0.29 0.00 -2.27 0.00 0.00 64.05 61.23 3hbb n THR 378 Cb 0.58 -1.32 -0.13 0.00 -2.10 0.00 0.00 70.33 67.36 3hbb n THR 378 CO 0.00 0.00 0.00 0.20 -0.57 0.00 0.00 175.07 174.70 3hbb s ASN 379 N -5.81 3.63 0.46 3.42 0.01 0.83 -4.96 114.94 112.52 3hbb s ASN 379 Ca -0.20 -2.88 0.31 0.00 -0.71 0.00 0.00 52.86 49.39 3hbb s ASN 379 Cb 0.06 -1.10 1.63 0.00 0.41 0.00 0.00 41.25 42.25 3hbb s ASN 379 CO 0.29 -0.23 1.96 -0.65 -1.51 0.00 0.00 177.10 176.96 3hbb h PRO 380 N 6.41 0.00 0.00 -0.60 0.11 -1.73 -2.50 132.00 133.70 3hbb h PRO 380 Ca 0.04 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.15 3hbb h PRO 380 Cb 0.90 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.01 3hbb h PRO 380 CO 0.52 0.00 -0.18 -0.25 -0.21 0.00 0.00 178.00 177.88 3hbb n ASP 381 N -2.64 0.30 -4.61 -2.05 8.00 -1.26 -4.21 116.55 110.09 3hbb n ASP 381 Ca -0.01 0.29 -0.42 0.00 0.71 0.00 0.00 54.79 55.36 3hbb n ASP 381 Cb 0.10 -0.30 0.00 0.00 -0.02 0.00 0.00 41.12 40.90 3hbb n ASP 381 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 3hbb n ASP 382 N -1.67 1.39 -0.59 -2.24 2.03 -0.94 -4.92 116.55 109.61 3hbb n ASP 382 Ca 0.06 1.09 0.08 0.00 0.52 0.00 0.00 54.79 56.54 3hbb n ASP 382 Cb 0.36 -1.34 0.19 0.00 -0.72 0.00 0.00 41.12 39.61 3hbb n ASP 382 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 3hbb n ARG 383 N 0.36 2.56 -0.01 -0.67 1.74 -1.26 -4.47 116.66 114.92 3hbb n ARG 383 Ca 0.09 -2.53 0.00 0.00 -0.77 0.00 0.00 57.85 54.65 3hbb n ARG 383 Cb 0.37 -1.59 0.01 0.00 -1.02 0.00 0.00 32.46 30.22 3hbb n ARG 383 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 3hbb n ARG 384 N -0.52 1.60 -1.89 5.56 1.74 -1.26 -4.90 116.66 116.98 3hbb n ARG 384 Ca 0.17 -1.17 -0.41 0.00 -0.77 0.00 0.00 57.85 55.66 3hbb n ARG 384 Cb 0.70 -1.01 -0.02 0.00 -1.02 0.00 0.00 32.46 31.10 3hbb n ARG 384 CO 0.00 0.00 0.00 -1.33 -1.52 0.00 0.00 177.63 174.78 3hbb n MET 385 N -0.28 2.53 -3.95 5.56 2.81 -1.26 -4.86 117.12 117.67 3hbb n MET 385 Ca 0.01 -2.62 -0.11 0.00 -1.81 0.00 0.00 57.70 53.17 3hbb n MET 385 Cb 0.17 -3.33 -0.12 0.00 -0.71 0.00 0.00 33.22 29.23 3hbb n MET 385 CO 0.00 0.00 0.00 -0.48 1.51 0.00 0.00 175.97 177.00 3hbb s LEU 386 N 3.63 2.15 0.12 4.03 2.34 -1.26 -1.21 118.68 128.47 3hbb s LEU 386 Ca 0.54 -0.31 0.10 0.00 0.06 0.00 0.00 54.13 54.51 3hbb s LEU 386 Cb 0.10 0.04 -0.04 0.00 -0.56 0.00 0.00 46.19 45.72 3hbb s LEU 386 CO 0.03 -0.17 -0.21 0.72 -1.06 0.00 0.00 176.35 175.65 3hbb s PHE 387 N -0.88 2.46 0.15 3.48 -0.71 -0.86 -4.99 117.98 116.63 3hbb s PHE 387 Ca -0.09 -0.30 0.07 0.00 -1.04 0.00 0.00 56.93 55.56 3hbb s PHE 387 Cb -0.06 -1.32 -0.04 0.00 -1.21 0.00 0.00 43.02 40.39 3hbb s PHE 387 CO -0.01 0.36 -0.16 -0.08 -1.34 0.00 0.00 175.22 174.00 3hbb s THR 388 N -1.10 1.57 -0.19 -4.49 -1.32 -1.26 -1.93 115.64 106.93 3hbb s THR 388 Ca 0.16 -1.87 0.02 0.00 -1.21 0.00 0.00 61.69 58.80 3hbb s THR 388 Cb -0.10 -1.73 0.00 0.00 -1.51 0.00 0.00 72.50 69.16 3hbb s THR 388 CO 0.08 -0.40 0.39 0.00 -2.21 0.00 0.00 174.62 172.48 3hbb n ALA 389 N 0.31 2.40 -2.69 11.08 0.00 -0.10 -4.38 120.51 127.14 3hbb n ALA 389 Ca -0.13 -0.35 -0.42 0.00 0.00 0.00 0.00 53.44 52.53 3hbb n ALA 389 Cb 0.57 -0.07 -0.03 0.00 0.00 0.00 0.00 19.45 19.93 3hbb n ALA 389 CO 0.00 0.00 0.00 -0.46 0.00 0.00 0.00 177.50 177.04 3hbb s TRP 390 N -0.51 2.71 -0.43 0.00 -0.11 -1.24 -4.80 118.94 114.55 3hbb s TRP 390 Ca 0.02 -0.96 0.02 0.00 1.22 0.00 0.00 56.10 56.40 3hbb s TRP 390 Cb 0.02 -4.54 0.12 0.00 -1.50 0.00 0.00 33.47 27.56 3hbb s TRP 390 CO 0.04 -1.79 0.18 1.21 -4.62 0.00 0.00 176.95 171.97 3hbb s ASN 391 N 4.41 4.81 0.51 5.86 3.84 -1.26 -4.99 114.94 128.12 3hbb s ASN 391 Ca 0.40 -2.44 0.30 0.00 0.21 0.00 0.00 52.86 51.33 3hbb s ASN 391 Cb -0.03 -1.70 1.42 0.00 -0.55 0.00 0.00 41.25 40.39 3hbb s ASN 391 CO -0.07 -0.37 1.87 -0.65 -2.79 0.00 0.00 177.10 175.08 3hbb h PRO 392 N 7.34 0.08 -0.22 0.43 0.11 -2.00 0.26 132.00 138.00 3hbb h PRO 392 Ca -0.07 -0.00 -0.14 0.00 0.11 0.00 0.00 66.00 65.90 3hbb h PRO 392 Cb 0.98 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 32.07 3hbb h PRO 392 CO 0.62 0.05 -0.46 0.77 -0.21 0.00 0.00 178.00 178.77 3hbb h SER 393 N 0.08 0.61 0.83 -2.05 0.02 -2.01 -3.30 113.55 107.73 3hbb h SER 393 Ca 0.46 -0.29 -0.09 0.00 -0.84 0.00 0.00 61.79 61.04 3hbb h SER 393 Cb 1.71 -0.17 -0.01 0.00 0.14 0.00 0.00 62.40 64.06 3hbb h SER 393 CO -0.05 0.98 -1.22 0.00 -1.14 0.00 0.00 176.83 175.40 3hbb n ALA 394 N -2.51 2.22 -0.27 3.77 0.00 0.70 -4.52 120.51 119.90 3hbb n ALA 394 Ca -0.02 -0.39 -0.01 0.00 0.00 0.00 0.00 53.44 53.02 3hbb n ALA 394 Cb 0.55 -1.03 0.06 0.00 0.00 0.00 0.00 19.45 19.03 3hbb n ALA 394 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 3hbb h LEU 395 N 0.00 -0.99 -0.66 0.00 4.07 -1.04 -0.45 115.31 116.25 3hbb h LEU 395 Ca -0.08 0.25 0.00 0.00 0.08 0.00 0.00 57.88 58.12 3hbb h LEU 395 Cb 1.30 0.56 0.00 0.00 1.08 0.00 0.00 40.66 43.60 3hbb h LEU 395 CO 0.02 -0.28 0.00 -2.65 -1.08 0.00 0.00 178.44 174.45 3hbb n PRO 396 N -5.49 0.09 0.03 1.13 -0.02 -1.26 -1.40 135.00 128.09 3hbb n PRO 396 Ca 0.09 0.50 0.11 0.00 -2.02 0.00 0.00 63.50 62.18 3hbb n PRO 396 Cb 0.39 -1.74 0.01 0.00 -0.02 0.00 0.00 33.50 32.14 3hbb n PRO 396 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 3hbb n ARG 397 N -1.92 0.36 -2.46 -0.52 5.12 -0.18 -4.95 116.66 112.11 3hbb n ARG 397 Ca 0.00 -0.00 -0.32 0.00 -1.93 0.00 0.00 57.85 55.61 3hbb n ARG 397 Cb 0.08 -1.62 -0.03 0.00 -1.16 0.00 0.00 32.46 29.73 3hbb n ARG 397 CO 0.00 0.00 0.00 -1.64 -1.93 0.00 0.00 177.63 174.06 3hbb s MET 398 N -3.24 3.90 0.41 5.56 -1.94 -0.49 -4.44 119.30 119.06 3hbb s MET 398 Ca 0.02 0.85 0.19 0.00 -1.71 0.00 0.00 55.69 55.05 3hbb s MET 398 Cb 0.14 -2.18 0.89 0.00 2.01 0.00 0.00 34.83 35.69 3hbb s MET 398 CO 0.81 -0.24 1.85 0.00 -0.01 0.00 0.00 175.02 177.43 3hbb h ALA 399 N 0.93 1.20 -2.15 3.03 0.00 -1.48 -3.44 119.26 117.35 3hbb h ALA 399 Ca -0.47 -0.28 -0.05 0.00 0.00 0.00 0.00 54.91 54.11 3hbb h ALA 399 Cb 1.19 -0.05 -0.22 0.00 0.00 0.00 0.00 17.79 18.71 3hbb h ALA 399 CO 0.62 0.38 0.04 -1.17 0.00 0.00 0.00 179.25 179.13 3hbb s LEU 400 N -7.50 -0.55 0.66 0.00 2.96 -1.26 -5.00 118.68 107.99 3hbb s LEU 400 Ca -0.02 1.33 -0.14 0.00 -0.22 0.00 0.00 54.13 55.08 3hbb s LEU 400 Cb 0.13 2.25 -0.00 0.00 0.50 0.00 0.00 46.19 49.06 3hbb s LEU 400 CO 0.67 -0.23 1.09 -2.16 -1.32 0.00 0.00 176.35 174.40 3hbb s PRO 401 N 0.50 2.88 0.54 0.98 0.04 -1.26 -4.92 135.00 133.76 3hbb s PRO 401 Ca -0.01 1.28 -0.21 0.00 0.04 0.00 0.00 61.00 62.10 3hbb s PRO 401 Cb -0.05 -1.97 -0.05 0.00 0.04 0.00 0.00 34.50 32.47 3hbb s PRO 401 CO -0.01 -1.17 1.22 -2.14 0.04 0.00 0.00 177.00 174.93 3hbb s PRO 402 N -4.26 3.28 -0.17 0.56 0.02 -1.26 -4.99 135.00 128.18 3hbb s PRO 402 Ca 0.65 1.87 -0.15 0.00 0.02 0.00 0.00 61.00 63.39 3hbb s PRO 402 Cb -0.18 -2.14 -0.05 0.00 0.02 0.00 0.00 34.50 32.14 3hbb s PRO 402 CO 0.43 -0.97 -0.29 0.00 -0.33 0.00 0.00 177.00 175.84 3hbb s HIS 404 N -2.67 2.74 0.00 0.00 0.00 -1.26 -1.55 115.29 112.54 3hbb s HIS 404 Ca -0.24 0.57 0.00 0.00 -3.00 0.00 0.00 55.06 52.40 3hbb s HIS 404 Cb 0.03 -4.45 0.00 0.00 -4.00 0.00 0.00 32.58 24.16 3hbb s HIS 404 CO 0.35 -1.39 0.00 1.47 -1.00 0.00 0.00 174.74 174.17 3hbb n LEU 405 N 8.05 0.00 -3.76 5.38 -0.00 -0.80 -4.85 117.00 121.01 3hbb n LEU 405 Ca 0.10 -0.26 -0.13 0.00 -0.00 0.00 0.00 56.01 55.73 3hbb n LEU 405 Cb 0.49 0.00 -0.12 0.00 -0.00 0.00 0.00 43.42 43.79 3hbb n LEU 405 CO 0.71 0.00 -0.07 -0.22 -0.00 0.00 0.00 177.39 177.81 3hbb s LEU 406 N -1.88 0.78 -0.05 1.47 2.96 -1.20 -0.92 118.68 119.84 3hbb s LEU 406 Ca 0.00 0.56 -0.02 0.00 -0.22 0.00 0.00 54.13 54.46 3hbb s LEU 406 Cb 0.00 0.92 0.03 0.00 0.50 0.00 0.00 46.19 47.64 3hbb s LEU 406 CO 0.00 -0.12 0.10 0.00 -1.32 0.00 0.00 176.35 175.01 3hbb s ALA 407 N 0.46 -0.12 -0.00 5.97 0.00 -0.81 0.10 121.76 127.36 3hbb s ALA 407 Ca -0.03 0.51 0.03 0.00 0.00 0.00 0.00 51.96 52.48 3hbb s ALA 407 Cb -0.04 -0.36 -0.03 0.00 0.00 0.00 0.00 23.12 22.69 3hbb s ALA 407 CO -0.02 -0.13 -0.08 -1.14 0.00 0.00 0.00 175.76 174.38 3hbb s GLN 408 N 1.09 2.52 0.10 0.00 0.74 0.13 -2.03 119.66 122.20 3hbb s GLN 408 Ca -0.09 -0.73 0.06 0.00 0.05 0.00 0.00 55.36 54.65 3hbb s GLN 408 Cb -0.12 -2.47 -0.04 0.00 1.10 0.00 0.00 33.01 31.48 3hbb s GLN 408 CO -0.04 0.60 -0.05 -0.06 -0.55 0.00 0.00 175.29 175.19 3hbb s PHE 409 N -0.96 2.85 -0.06 1.67 0.08 -0.35 0.13 117.98 121.35 3hbb s PHE 409 Ca 0.16 -0.10 -0.16 0.00 0.12 0.00 0.00 56.93 56.95 3hbb s PHE 409 Cb -0.11 -1.48 0.03 0.00 -0.57 0.00 0.00 43.02 40.90 3hbb s PHE 409 CO 0.06 0.45 0.37 -0.47 -0.10 0.00 0.00 175.22 175.54 3hbb s TYR 410 N -1.27 -0.31 -0.05 0.36 6.14 -0.60 -4.73 117.35 116.89 3hbb s TYR 410 Ca 0.24 0.62 0.01 0.00 0.64 0.00 0.00 57.07 58.57 3hbb s TYR 410 Cb -0.11 0.14 0.02 0.00 0.42 0.00 0.00 41.96 42.43 3hbb s TYR 410 CO 0.16 -0.35 -0.05 0.08 0.64 0.00 0.00 175.55 176.03 3hbb s VAL 411 N -0.78 0.61 -0.15 3.14 1.01 -1.26 0.12 120.40 123.09 3hbb s VAL 411 Ca -0.09 -0.15 -0.11 0.00 0.00 0.00 0.00 61.98 61.64 3hbb s VAL 411 Cb -0.04 -0.63 0.05 0.00 0.00 0.00 0.00 36.38 35.76 3hbb s VAL 411 CO 0.03 0.25 0.37 -0.94 0.00 0.00 0.00 175.10 174.81 3hbb s SER 412 N 1.00 -0.42 -1.41 3.32 1.04 -0.92 -4.88 113.70 111.43 3hbb s SER 412 Ca -0.10 0.77 -0.05 0.00 0.48 0.00 0.00 55.95 57.05 3hbb s SER 412 Cb -0.14 0.72 0.03 0.00 0.10 0.00 0.00 66.02 66.73 3hbb s SER 412 CO -0.00 -0.16 0.77 0.59 0.98 0.00 0.00 173.24 175.42 3hbb n ASN 413 N 3.54 -2.40 -0.01 7.02 3.02 -1.26 -1.94 115.26 123.23 3hbb n ASN 413 Ca -0.18 -0.83 -0.00 0.00 -0.03 0.00 0.00 54.58 53.53 3hbb n ASN 413 Cb 0.56 -3.84 -0.00 0.00 -0.61 0.00 0.00 39.78 35.89 3hbb n ASN 413 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3hbb n GLY 414 N -1.66 0.24 3.76 7.41 0.00 -1.26 -5.00 105.19 108.69 3hbb n GLY 414 Ca -0.17 -0.01 -0.36 0.00 0.00 0.00 0.00 46.02 45.48 3hbb n GLY 414 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3hbb s GLU 415 N -1.11 3.16 -0.35 1.61 2.02 -0.82 -1.83 118.70 121.38 3hbb s GLU 415 Ca 0.00 -0.30 -0.13 0.00 0.02 0.00 0.00 54.97 54.56 3hbb s GLU 415 Cb 0.00 -2.95 -0.01 0.00 0.10 0.00 0.00 34.13 31.27 3hbb s GLU 415 CO 0.00 0.73 0.24 -1.17 0.02 0.00 0.00 175.26 175.09 3hbb s LEU 416 N -0.94 4.62 0.20 1.80 2.96 0.10 -2.18 118.68 125.24 3hbb s LEU 416 Ca 0.14 -0.55 0.06 0.00 -0.22 0.00 0.00 54.13 53.56 3hbb s LEU 416 Cb -0.12 -2.13 -0.04 0.00 0.50 0.00 0.00 46.19 44.41 3hbb s LEU 416 CO 0.03 -0.28 0.15 -0.44 -1.32 0.00 0.00 176.35 174.49 3hbb s SER 417 N 1.70 5.46 -0.03 3.68 0.01 0.12 -0.51 113.70 124.13 3hbb s SER 417 Ca 0.06 -0.20 -0.02 0.00 1.31 0.00 0.00 55.95 57.10 3hbb s SER 417 Cb -0.18 -1.39 0.02 0.00 0.21 0.00 0.00 66.02 64.68 3hbb s SER 417 CO 0.10 0.03 0.06 0.00 0.41 0.00 0.00 173.24 173.84 3hbb s MET 419 N 0.42 3.84 -0.15 0.00 -1.94 0.12 0.25 119.30 121.84 3hbb s MET 419 Ca -0.03 -0.38 -0.02 0.00 -1.71 0.00 0.00 55.69 53.54 3hbb s MET 419 Cb -0.05 -3.12 -0.02 0.00 2.01 0.00 0.00 34.83 33.65 3hbb s MET 419 CO -0.01 0.31 -0.08 -1.17 -0.01 0.00 0.00 175.02 174.05 3hbb s LEU 420 N 0.25 3.02 -0.23 -0.03 2.96 0.13 -0.69 118.68 124.09 3hbb s LEU 420 Ca 0.02 -0.22 -0.07 0.00 -0.22 0.00 0.00 54.13 53.64 3hbb s LEU 420 Cb -0.13 -1.71 -0.03 0.00 0.50 0.00 0.00 46.19 44.82 3hbb s LEU 420 CO 0.01 0.16 0.07 -0.47 -1.32 0.00 0.00 176.35 174.80 3hbb s TYR 421 N 0.38 3.14 -0.14 5.38 6.14 0.11 0.17 117.35 132.54 3hbb s TYR 421 Ca -0.07 -0.23 0.00 0.00 0.64 0.00 0.00 57.07 57.42 3hbb s TYR 421 Cb -0.15 -2.19 0.02 0.00 0.42 0.00 0.00 41.96 40.07 3hbb s TYR 421 CO 0.04 -0.18 -0.12 -1.14 0.64 0.00 0.00 175.55 174.80 3hbb s GLN 422 N 1.19 2.03 0.19 4.97 0.74 0.08 -1.90 119.66 126.96 3hbb s GLN 422 Ca 0.05 -0.46 0.05 0.00 0.05 0.00 0.00 55.36 55.04 3hbb s GLN 422 Cb -0.14 -1.94 0.08 0.00 1.10 0.00 0.00 33.01 32.10 3hbb s GLN 422 CO 0.03 -0.25 1.44 0.07 -0.55 0.00 0.00 175.29 176.03 3hbb h ARG 423 N 8.09 0.14 -3.05 1.67 0.11 -1.57 0.15 114.38 119.92 3hbb h ARG 423 Ca -0.35 -0.14 -0.32 0.00 0.10 0.00 0.00 59.98 59.27 3hbb h ARG 423 Cb 1.13 0.04 -0.37 0.00 1.11 0.00 0.00 29.97 31.88 3hbb h ARG 423 CO 0.49 0.86 -0.66 0.45 0.10 0.00 0.00 179.97 181.21 3hbb s SER 424 N -6.88 1.00 -0.27 0.08 0.15 -1.26 -0.35 113.70 106.16 3hbb s SER 424 Ca -0.02 0.17 0.01 0.00 0.70 0.00 0.00 55.95 56.80 3hbb s SER 424 Cb 0.11 0.19 0.08 0.00 -1.71 0.00 0.00 66.02 64.69 3hbb s SER 424 CO 0.81 -0.26 -0.00 0.00 1.20 0.00 0.00 173.24 174.98 3hbb s ASP 426 N 1.34 6.48 0.30 0.00 2.15 -1.26 -1.04 116.67 124.63 3hbb s ASP 426 Ca 0.01 1.28 0.11 0.00 0.43 0.00 0.00 52.55 54.38 3hbb s ASP 426 Cb -0.19 -2.54 0.45 0.00 -0.30 0.00 0.00 42.92 40.34 3hbb s ASP 426 CO -0.10 -1.23 1.66 0.24 -0.17 0.00 0.00 175.17 175.57 3hbb h MET 427 N 10.20 0.00 -0.06 4.34 2.86 -1.53 0.17 114.93 130.91 3hbb h MET 427 Ca -0.29 0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.34 3hbb h MET 427 Cb 1.12 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.78 3hbb h MET 427 CO 1.03 0.56 -0.01 0.78 1.06 0.00 0.00 176.91 180.33 3hbb h GLY 428 N 1.71 0.13 0.00 8.32 0.00 -1.91 -3.40 103.07 107.92 3hbb h GLY 428 Ca -0.01 -0.10 0.00 0.00 0.00 0.00 0.00 47.33 47.22 3hbb h GLY 428 CO 0.07 0.09 -0.90 1.04 0.00 0.00 0.00 176.54 176.84 3hbb n LEU 429 N -4.84 1.09 0.05 3.11 4.77 -1.24 -4.81 117.00 115.13 3hbb n LEU 429 Ca -0.07 0.00 -0.12 0.00 -0.03 0.00 0.00 56.01 55.79 3hbb n LEU 429 Cb 0.21 0.00 -0.08 0.00 -2.33 0.00 0.00 43.42 41.22 3hbb n LEU 429 CO 0.35 0.15 0.82 1.23 -1.33 0.00 0.00 177.39 178.61 3hbb h GLY 430 N 0.00 -0.06 0.91 -0.72 0.00 -1.62 -3.21 103.07 98.36 3hbb h GLY 430 Ca 0.00 0.02 -0.00 0.00 0.00 0.00 0.00 47.33 47.35 3hbb h GLY 430 CO 0.00 -0.02 -0.03 -2.08 0.00 0.00 0.00 176.54 174.40 3hbb h VAL 431 N -0.13 0.99 -0.39 4.60 2.07 -1.19 -0.29 116.25 121.91 3hbb h VAL 431 Ca -0.01 -0.21 -0.00 0.00 0.82 0.00 0.00 66.70 67.30 3hbb h VAL 431 Cb 0.12 1.13 -0.02 0.00 -1.52 0.00 0.00 31.29 31.00 3hbb h VAL 431 CO 0.01 0.05 0.23 -0.65 0.02 0.00 0.00 177.57 177.24 3hbb h PRO 432 N -0.19 0.52 -0.35 1.57 0.11 -1.78 -0.97 132.00 130.90 3hbb h PRO 432 Ca -0.01 -0.04 -0.09 0.00 0.11 0.00 0.00 66.00 65.97 3hbb h PRO 432 Cb 0.16 -0.11 -0.01 0.00 0.11 0.00 0.00 31.00 31.15 3hbb h PRO 432 CO 0.02 0.36 -0.15 0.35 -0.21 0.00 0.00 178.00 178.37 3hbb h PHE 433 N 0.53 0.82 -0.02 0.65 3.04 -1.47 -2.63 116.94 117.87 3hbb h PHE 433 Ca 0.14 -0.20 -0.15 0.00 3.98 0.00 0.00 57.97 61.74 3hbb h PHE 433 Cb -0.02 -0.19 -0.02 0.00 2.56 0.00 0.00 35.95 38.28 3hbb h PHE 433 CO 0.00 0.91 -0.69 -0.91 -2.02 0.00 0.00 178.31 175.59 3hbb h ASN 434 N 0.50 0.14 0.08 0.41 4.21 -0.55 -0.99 115.58 119.38 3hbb h ASN 434 Ca 0.08 -0.09 -0.00 0.00 1.21 0.00 0.00 56.30 57.50 3hbb h ASN 434 Cb 0.68 -0.04 0.00 0.00 -1.12 0.00 0.00 38.32 37.84 3hbb h ASN 434 CO 0.05 0.79 -0.04 0.40 -1.29 0.00 0.00 177.43 177.33 3hbb h ILE 435 N 0.08 0.93 -0.35 2.81 2.04 -1.16 -2.35 117.51 119.51 3hbb h ILE 435 Ca -0.01 -0.03 0.04 0.00 1.00 0.00 0.00 64.86 65.86 3hbb h ILE 435 Cb 1.23 0.94 -0.04 0.00 -0.74 0.00 0.00 36.82 38.22 3hbb h ILE 435 CO 0.10 0.01 0.13 0.00 0.00 0.00 0.00 178.15 178.39 3hbb h ALA 436 N 0.80 0.41 -0.10 1.87 0.00 -1.30 -1.17 119.26 119.78 3hbb h ALA 436 Ca -0.01 0.04 0.04 0.00 0.00 0.00 0.00 54.91 54.98 3hbb h ALA 436 Cb 0.10 0.01 -0.05 0.00 0.00 0.00 0.00 17.79 17.84 3hbb h ALA 436 CO 0.02 -0.26 -0.22 0.77 0.00 0.00 0.00 179.25 179.56 3hbb h SER 437 N 0.29 -0.67 1.28 0.00 0.02 -1.08 -0.68 113.55 112.71 3hbb h SER 437 Ca 0.16 0.11 -0.07 0.00 -0.84 0.00 0.00 61.79 61.14 3hbb h SER 437 Cb 0.12 0.29 -0.01 0.00 0.14 0.00 0.00 62.40 62.94 3hbb h SER 437 CO -0.15 -0.27 -0.34 1.88 -1.14 0.00 0.00 176.83 176.81 3hbb h TYR 438 N -0.30 0.00 0.57 3.45 -1.99 -1.33 0.12 116.97 117.50 3hbb h TYR 438 Ca 0.09 0.00 -0.03 0.00 2.00 0.00 0.00 58.73 60.79 3hbb h TYR 438 Cb 0.43 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.16 3hbb h TYR 438 CO -0.31 0.34 -0.29 0.00 -0.00 0.00 0.00 178.16 177.90 3hbb h ALA 439 N 1.66 -0.79 -0.71 3.88 0.00 -0.94 -0.10 119.26 122.26 3hbb h ALA 439 Ca -0.00 -0.17 0.08 0.00 0.00 0.00 0.00 54.91 54.81 3hbb h ALA 439 Cb 1.07 0.33 -0.06 0.00 0.00 0.00 0.00 17.79 19.12 3hbb h ALA 439 CO 0.04 -0.95 0.38 1.25 0.00 0.00 0.00 179.25 179.97 3hbb h LEU 440 N -0.79 0.53 -0.12 0.00 5.85 -0.64 -0.70 115.31 119.44 3hbb h LEU 440 Ca -0.08 0.05 0.00 0.00 0.84 0.00 0.00 57.88 58.69 3hbb h LEU 440 Cb 0.62 -0.05 -0.01 0.00 0.37 0.00 0.00 40.66 41.59 3hbb h LEU 440 CO 0.11 0.32 0.08 0.25 -0.34 0.00 0.00 178.44 178.86 3hbb h LEU 441 N 0.67 0.14 -0.58 2.25 5.85 -0.73 0.12 115.31 123.03 3hbb h LEU 441 Ca 0.33 -0.03 0.00 0.00 0.84 0.00 0.00 57.88 59.03 3hbb h LEU 441 Cb 0.29 -0.04 -0.03 0.00 0.37 0.00 0.00 40.66 41.25 3hbb h LEU 441 CO -0.23 0.13 0.37 0.74 -0.34 0.00 0.00 178.44 179.11 3hbb h THR 442 N 0.14 1.16 -0.03 1.05 2.02 -0.46 -0.42 112.91 116.37 3hbb h THR 442 Ca 0.04 -0.31 0.02 0.00 0.77 0.00 0.00 66.41 66.94 3hbb h THR 442 Cb 0.01 0.33 -0.02 0.00 -1.74 0.00 0.00 68.15 66.72 3hbb h THR 442 CO -0.01 0.15 -0.09 0.40 0.37 0.00 0.00 175.52 176.34 3hbb h ILE 443 N 0.78 0.75 -0.64 3.11 2.04 -0.91 -0.39 117.51 122.25 3hbb h ILE 443 Ca 0.21 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 66.06 3hbb h ILE 443 Cb -0.07 0.75 -0.03 0.00 -0.74 0.00 0.00 36.82 36.73 3hbb h ILE 443 CO -0.04 0.00 0.37 -0.07 0.00 0.00 0.00 178.15 178.41 3hbb h LEU 444 N -0.15 0.77 -0.90 1.44 3.38 -0.58 -1.65 115.31 117.63 3hbb h LEU 444 Ca 0.05 -0.07 -0.11 0.00 0.09 0.00 0.00 57.88 57.84 3hbb h LEU 444 Cb 0.21 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.75 3hbb h LEU 444 CO -0.12 0.62 -0.35 0.40 0.09 0.00 0.00 178.44 179.09 3hbb h ILE 445 N 0.86 1.29 -0.41 1.22 1.08 -0.94 -1.61 117.51 119.00 3hbb h ILE 445 Ca 0.23 -1.42 0.02 0.00 -0.39 0.00 0.00 64.86 63.29 3hbb h ILE 445 Cb 0.00 1.53 -0.03 0.00 -3.07 0.00 0.00 36.82 35.25 3hbb h ILE 445 CO -0.04 0.44 0.24 0.00 -0.69 0.00 0.00 178.15 178.10 3hbb h ALA 446 N 1.30 0.52 -0.90 1.87 0.00 -0.70 -1.98 119.26 119.36 3hbb h ALA 446 Ca 0.04 -0.01 0.01 0.00 0.00 0.00 0.00 54.91 54.95 3hbb h ALA 446 Cb 0.77 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 18.40 3hbb h ALA 446 CO 0.06 -0.09 0.58 0.87 0.00 0.00 0.00 179.25 180.68 3hbb h LYS 447 N 0.49 1.20 0.00 0.00 1.57 -0.99 -0.26 116.57 118.58 3hbb h LYS 447 Ca 0.16 -0.08 0.00 0.00 -1.87 0.00 0.00 60.65 58.86 3hbb h LYS 447 Cb 0.01 -0.27 0.00 0.00 0.08 0.00 0.00 32.23 32.05 3hbb h LYS 447 CO -0.07 0.81 0.00 0.00 -0.57 0.00 0.00 179.45 179.61 3hbb h ALA 448 N 1.41 1.00 -0.00 3.86 0.00 -0.86 -3.29 119.26 121.38 3hbb h ALA 448 Ca 0.33 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.24 3hbb h ALA 448 Cb -0.12 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.67 3hbb h ALA 448 CO -0.07 0.00 0.00 0.25 0.00 0.00 0.00 179.25 179.43 3hbb n THR 449 N -2.87 0.12 -3.03 0.00 -2.24 -0.79 -4.36 114.28 101.12 3hbb n THR 449 Ca 0.02 -0.56 -0.12 0.00 -2.27 0.00 0.00 64.05 61.12 3hbb n THR 449 Cb 0.32 0.95 0.04 0.00 -2.10 0.00 0.00 70.33 69.54 3hbb n THR 449 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3hbb n GLY 450 N -0.04 0.21 3.43 3.38 0.00 -0.53 -4.71 105.19 106.93 3hbb n GLY 450 Ca 0.00 -0.22 -0.22 0.00 0.00 0.00 0.00 46.02 45.59 3hbb n GLY 450 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3hbb s LEU 451 N -4.10 2.52 0.07 0.99 1.43 -0.22 -5.02 118.68 114.34 3hbb s LEU 451 Ca 0.28 -1.16 -0.11 0.00 -1.03 0.00 0.00 54.13 52.11 3hbb s LEU 451 Cb -0.12 -0.70 -0.06 0.00 0.03 0.00 0.00 46.19 45.33 3hbb s LEU 451 CO 0.36 -0.29 0.41 -0.13 0.23 0.00 0.00 176.35 176.93 3hbb s ARG 452 N -3.69 3.79 0.41 1.70 0.52 -0.76 -4.23 118.95 116.69 3hbb s ARG 452 Ca 0.29 0.23 -0.27 0.00 -0.52 0.00 0.00 55.73 55.46 3hbb s ARG 452 Cb 0.03 -3.03 -0.10 0.00 0.52 0.00 0.00 34.95 32.37 3hbb s ARG 452 CO 0.12 0.58 1.43 -2.30 0.02 0.00 0.00 175.30 175.15 3hbb n PRO 453 N 1.06 2.40 0.00 3.54 -0.02 -1.26 0.03 135.00 140.74 3hbb n PRO 453 Ca -0.09 0.85 0.00 0.00 -2.02 0.00 0.00 63.50 62.24 3hbb n PRO 453 Cb 0.52 -2.61 0.00 0.00 -0.02 0.00 0.00 33.50 31.40 3hbb n PRO 453 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3hbb n GLY 454 N 0.56 0.79 3.35 -1.23 0.00 0.34 -4.13 105.19 104.86 3hbb n GLY 454 Ca 0.04 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.80 3hbb n GLY 454 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3hbb s GLU 455 N 1.69 1.31 -0.22 1.61 2.02 -1.26 -0.64 118.70 123.22 3hbb s GLU 455 Ca 0.00 -1.35 -0.05 0.00 0.02 0.00 0.00 54.97 53.59 3hbb s GLU 455 Cb 0.00 -1.59 -0.02 0.00 0.10 0.00 0.00 34.13 32.62 3hbb s GLU 455 CO 0.00 0.36 -0.00 -1.17 0.02 0.00 0.00 175.26 174.46 3hbb s LEU 456 N -2.30 3.15 -0.19 1.80 2.96 0.60 -0.77 118.68 123.92 3hbb s LEU 456 Ca 0.14 -0.28 -0.06 0.00 -0.22 0.00 0.00 54.13 53.71 3hbb s LEU 456 Cb -0.08 -1.81 -0.03 0.00 0.50 0.00 0.00 46.19 44.76 3hbb s LEU 456 CO 0.06 0.01 0.04 -0.69 -1.32 0.00 0.00 176.35 174.45 3hbb s VAL 457 N 1.30 4.38 -0.24 1.68 1.01 0.14 -0.25 120.40 128.43 3hbb s VAL 457 Ca 0.04 -0.17 -0.06 0.00 0.00 0.00 0.00 61.98 61.79 3hbb s VAL 457 Cb -0.15 -2.98 -0.02 0.00 0.00 0.00 0.00 36.38 33.23 3hbb s VAL 457 CO 0.00 0.43 0.03 -2.28 0.00 0.00 0.00 175.10 173.29 3hbb s HIS 458 N 0.75 3.04 -0.21 5.22 2.46 0.90 0.18 115.29 127.63 3hbb s HIS 458 Ca 0.02 -0.58 -0.06 0.00 0.47 0.00 0.00 55.06 54.92 3hbb s HIS 458 Cb -0.14 -2.18 -0.03 0.00 -0.13 0.00 0.00 32.58 30.10 3hbb s HIS 458 CO 0.02 -0.40 0.02 0.99 -2.47 0.00 0.00 174.74 172.90 3hbb s THR 459 N 1.50 4.05 -0.10 0.89 2.01 0.13 -0.89 115.64 123.22 3hbb s THR 459 Ca 0.06 -0.27 -0.01 0.00 0.31 0.00 0.00 61.69 61.77 3hbb s THR 459 Cb -0.15 -2.85 -0.03 0.00 0.01 0.00 0.00 72.50 69.49 3hbb s THR 459 CO 0.01 0.41 -0.04 -0.76 -0.69 0.00 0.00 174.62 173.55 3hbb s LEU 460 N 1.13 3.27 0.00 4.42 1.02 -0.72 -0.75 118.68 127.05 3hbb s LEU 460 Ca 0.03 -0.03 0.00 0.00 0.02 0.00 0.00 54.13 54.15 3hbb s LEU 460 Cb -0.14 -1.75 0.00 0.00 0.02 0.00 0.00 46.19 44.32 3hbb s LEU 460 CO 0.02 0.29 0.00 0.61 0.02 0.00 0.00 176.35 177.29 3hbb n GLY 461 N 2.70 0.97 3.48 -3.19 0.00 0.52 -2.01 105.19 107.66 3hbb n GLY 461 Ca -0.18 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.41 3hbb n GLY 461 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3hbb s ASP 462 N -1.00 6.44 -0.17 1.61 -1.08 0.52 -0.40 116.67 122.59 3hbb s ASP 462 Ca 0.00 -1.53 -0.18 0.00 -0.52 0.00 0.00 52.55 50.32 3hbb s ASP 462 Cb 0.00 -2.44 -0.04 0.00 -1.46 0.00 0.00 42.92 38.98 3hbb s ASP 462 CO 0.00 -1.30 0.50 0.00 0.52 0.00 0.00 175.17 174.89 3hbb s ALA 463 N 3.67 3.52 0.04 3.66 0.00 -0.43 -1.71 121.76 130.50 3hbb s ALA 463 Ca 0.32 -0.33 -0.01 0.00 0.00 0.00 0.00 51.96 51.94 3hbb s ALA 463 Cb -0.08 -2.75 -0.03 0.00 0.00 0.00 0.00 23.12 20.26 3hbb s ALA 463 CO -0.02 -0.28 -0.03 -3.38 0.00 0.00 0.00 175.76 172.04 3hbb s HIS 464 N 1.27 0.43 -0.03 0.00 -3.43 -0.20 -1.10 115.29 112.23 3hbb s HIS 464 Ca 0.24 -0.86 0.06 0.00 -0.80 0.00 0.00 55.06 53.71 3hbb s HIS 464 Cb -0.15 -0.32 -0.01 0.00 -1.43 0.00 0.00 32.58 30.67 3hbb s HIS 464 CO 0.10 -0.30 -0.22 0.08 -2.00 0.00 0.00 174.74 172.40 3hbb s VAL 465 N -2.96 1.75 0.25 -5.38 1.01 -0.19 -1.13 120.40 113.74 3hbb s VAL 465 Ca -0.02 -0.93 -0.30 0.00 0.00 0.00 0.00 61.98 60.74 3hbb s VAL 465 Cb 0.01 -1.47 -0.09 0.00 0.00 0.00 0.00 36.38 34.83 3hbb s VAL 465 CO -0.06 0.49 1.11 -0.31 0.00 0.00 0.00 175.10 176.33 3hbb s TYR 466 N -0.36 3.58 0.30 5.22 2.02 -1.26 -0.51 117.35 126.33 3hbb s TYR 466 Ca 0.04 1.66 0.02 0.00 -0.37 0.00 0.00 57.07 58.42 3hbb s TYR 466 Cb -0.10 -3.29 0.74 0.00 -0.40 0.00 0.00 41.96 38.91 3hbb s TYR 466 CO 0.01 -0.60 1.60 0.77 -1.57 0.00 0.00 175.55 175.75 3hbb h SER 467 N 4.27 -0.29 -0.26 2.29 0.02 -1.62 0.84 113.55 118.81 3hbb h SER 467 Ca -0.46 0.25 -0.14 0.00 -0.84 0.00 0.00 61.79 60.60 3hbb h SER 467 Cb 1.21 0.40 -0.01 0.00 0.14 0.00 0.00 62.40 64.14 3hbb h SER 467 CO 0.69 -0.29 -0.35 -0.55 -1.14 0.00 0.00 176.83 175.19 3hbb h ASN 468 N 0.07 0.82 0.04 3.07 7.08 -1.92 -3.10 115.58 121.65 3hbb h ASN 468 Ca 0.58 -0.35 0.00 0.00 -3.08 0.00 0.00 56.30 53.45 3hbb h ASN 468 Cb 1.20 -0.23 0.00 0.00 -2.08 0.00 0.00 38.32 37.21 3hbb h ASN 468 CO -0.81 1.09 0.00 1.41 -2.08 0.00 0.00 177.43 177.04 3hbb n HIS 469 N -4.06 0.00 -0.11 4.14 8.25 0.29 -3.80 115.22 119.92 3hbb n HIS 469 Ca -0.01 0.00 -0.11 0.00 -0.26 0.00 0.00 57.72 57.33 3hbb n HIS 469 Cb 0.51 -0.11 -0.03 0.00 1.12 0.00 0.00 29.99 31.47 3hbb n HIS 469 CO 0.00 0.00 0.00 0.28 0.64 0.00 0.00 176.34 177.26 3hbb h VAL 470 N 0.00 1.27 0.07 1.59 2.07 -1.53 0.19 116.25 119.90 3hbb h VAL 470 Ca 0.00 -1.07 -0.00 0.00 0.82 0.00 0.00 66.70 66.44 3hbb h VAL 470 Cb 0.02 1.32 0.00 0.00 -1.52 0.00 0.00 31.29 31.12 3hbb h VAL 470 CO 0.00 0.35 -0.03 -0.33 0.02 0.00 0.00 177.57 177.58 3hbb h GLU 471 N 0.38 -0.08 -0.43 1.57 5.08 -1.84 -1.29 114.58 117.97 3hbb h GLU 471 Ca 0.08 0.01 -0.00 0.00 -1.00 0.00 0.00 59.36 58.45 3hbb h GLU 471 Cb 0.53 0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.78 3hbb h GLU 471 CO 0.03 0.15 0.26 -1.00 -1.00 0.00 0.00 179.01 177.45 3hbb h PRO 472 N -0.32 0.57 -0.54 2.33 0.13 -1.79 -2.20 132.00 130.18 3hbb h PRO 472 Ca -0.01 -0.04 -0.10 0.00 -0.87 0.00 0.00 66.00 64.98 3hbb h PRO 472 Cb 0.28 -0.12 -0.02 0.00 0.13 0.00 0.00 31.00 31.26 3hbb h PRO 472 CO 0.01 0.39 -0.05 0.00 -0.23 0.00 0.00 178.00 178.12 3hbb h ASN 474 N 0.87 0.39 0.42 0.00 2.35 -0.96 -1.13 115.58 117.52 3hbb h ASN 474 Ca 0.15 -0.11 -0.02 0.00 -0.55 0.00 0.00 56.30 55.77 3hbb h ASN 474 Cb 0.59 -0.11 0.00 0.00 0.05 0.00 0.00 38.32 38.85 3hbb h ASN 474 CO 0.04 0.61 -0.21 -0.33 -1.65 0.00 0.00 177.43 175.88 3hbb h GLU 475 N 0.36 -0.56 -0.15 0.81 4.39 -1.18 -3.12 114.58 115.13 3hbb h GLU 475 Ca 0.06 0.04 -0.00 0.00 0.34 0.00 0.00 59.36 59.80 3hbb h GLU 475 Cb 0.56 0.13 -0.01 0.00 -0.10 0.00 0.00 28.75 29.33 3hbb h GLU 475 CO 0.04 -0.37 0.09 0.37 -1.16 0.00 0.00 179.01 177.97 3hbb h GLN 476 N -0.58 0.20 0.00 2.33 4.15 -0.87 -1.51 115.11 118.83 3hbb h GLN 476 Ca -0.06 -0.01 0.00 0.00 0.77 0.00 0.00 58.65 59.35 3hbb h GLN 476 Cb 0.45 -0.05 0.00 0.00 0.21 0.00 0.00 27.48 28.09 3hbb h GLN 476 CO 0.09 0.15 0.00 -0.07 -1.93 0.00 0.00 178.83 177.07 3hbb h LEU 477 N 0.21 0.00 -2.41 -2.39 3.38 -1.15 -2.13 115.31 110.81 3hbb h LEU 477 Ca 0.06 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.02 3hbb h LEU 477 Cb 0.00 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.75 3hbb h LEU 477 CO -0.01 0.00 -0.03 0.11 0.09 0.00 0.00 178.44 178.60 3hbb h LYS 478 N 0.00 0.00 -6.06 1.13 1.57 -1.29 -3.45 116.57 108.47 3hbb h LYS 478 Ca 0.00 0.00 -0.56 0.00 -1.87 0.00 0.00 60.65 58.22 3hbb h LYS 478 Cb 0.37 0.00 -0.05 0.00 0.08 0.00 0.00 32.23 32.62 3hbb h LYS 478 CO 0.00 0.03 0.09 1.03 -0.57 0.00 0.00 179.45 180.02 3hbb s ARG 479 N -4.14 4.44 -0.11 3.15 0.52 -0.80 -5.03 118.95 116.97 3hbb s ARG 479 Ca -0.03 0.89 -0.30 0.00 -0.52 0.00 0.00 55.73 55.77 3hbb s ARG 479 Cb 0.13 -3.43 -0.02 0.00 0.52 0.00 0.00 34.95 32.14 3hbb s ARG 479 CO 0.49 0.10 1.18 0.08 0.02 0.00 0.00 175.30 177.18 3hbb s VAL 480 N 0.65 4.36 0.59 3.52 1.01 -1.26 -5.00 120.40 124.28 3hbb s VAL 480 Ca 0.37 1.67 -0.20 0.00 0.00 0.00 0.00 61.98 63.82 3hbb s VAL 480 Cb -0.18 -4.07 -0.03 0.00 0.00 0.00 0.00 36.38 32.10 3hbb s VAL 480 CO 0.19 -0.06 1.33 -2.65 0.00 0.00 0.00 175.10 173.91 3hbb n PRO 481 N 5.75 1.44 -3.02 2.72 -0.02 -1.26 -4.95 135.00 135.67 3hbb n PRO 481 Ca 0.12 0.54 -0.19 0.00 -2.02 0.00 0.00 63.50 61.95 3hbb n PRO 481 Cb 0.46 -2.56 0.04 0.00 -0.02 0.00 0.00 33.50 31.42 3hbb n PRO 481 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 3hbb s ARG 482 N -3.11 2.50 0.44 -0.52 0.52 -1.26 -4.41 118.95 113.11 3hbb s ARG 482 Ca 0.77 -1.47 -0.24 0.00 -0.52 0.00 0.00 55.73 54.26 3hbb s ARG 482 Cb -0.40 -2.69 -0.08 0.00 0.52 0.00 0.00 34.95 32.31 3hbb s ARG 482 CO 0.45 -0.64 1.21 0.00 0.02 0.00 0.00 175.30 176.34 3hbb s ALA 483 N -2.55 3.08 0.75 2.13 0.00 -1.26 -4.72 121.76 119.18 3hbb s ALA 483 Ca 0.59 1.03 -0.12 0.00 0.00 0.00 0.00 51.96 53.47 3hbb s ALA 483 Cb -0.07 -3.42 0.05 0.00 0.00 0.00 0.00 23.12 19.67 3hbb s ALA 483 CO 0.37 -0.70 1.10 -0.06 0.00 0.00 0.00 175.76 176.46 3hbb s PHE 484 N -1.43 2.54 0.35 0.00 0.08 -1.26 -4.78 117.98 113.50 3hbb s PHE 484 Ca 0.61 1.56 -0.06 0.00 0.12 0.00 0.00 56.93 59.16 3hbb s PHE 484 Cb -0.32 -3.10 0.08 0.00 -0.57 0.00 0.00 43.02 39.12 3hbb s PHE 484 CO 0.40 -1.82 0.43 -0.35 -0.10 0.00 0.00 175.22 173.78 3hbb n PRO 485 N -3.26 -0.76 -4.23 0.24 -0.04 -1.25 -4.89 135.00 120.82 3hbb n PRO 485 Ca 0.10 -0.67 -0.18 0.00 -0.04 0.00 0.00 63.50 62.70 3hbb n PRO 485 Cb 0.53 -0.49 -0.11 0.00 -0.04 0.00 0.00 33.50 33.38 3hbb n PRO 485 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 3hbb s TYR 486 N -1.91 1.37 -0.18 0.54 1.51 -0.57 -1.93 117.35 116.18 3hbb s TYR 486 Ca 0.25 -0.53 -0.04 0.00 -1.01 0.00 0.00 57.07 55.74 3hbb s TYR 486 Cb -0.01 -0.73 -0.03 0.00 -0.11 0.00 0.00 41.96 41.08 3hbb s TYR 486 CO 0.18 0.13 -0.02 -1.17 -1.11 0.00 0.00 175.55 173.56 3hbb s LEU 487 N -2.29 3.26 0.13 -1.29 2.96 0.23 -1.63 118.68 120.05 3hbb s LEU 487 Ca 0.07 -0.16 0.09 0.00 -0.22 0.00 0.00 54.13 53.90 3hbb s LEU 487 Cb -0.06 -1.81 -0.04 0.00 0.50 0.00 0.00 46.19 44.79 3hbb s LEU 487 CO 0.03 0.12 -0.22 0.68 -1.32 0.00 0.00 176.35 175.63 3hbb s VAL 488 N 0.69 1.93 -0.36 1.68 -7.23 -0.38 -4.77 120.40 111.96 3hbb s VAL 488 Ca -0.01 -1.71 -0.06 0.00 -1.81 0.00 0.00 61.98 58.38 3hbb s VAL 488 Cb -0.14 -1.77 0.06 0.00 0.56 0.00 0.00 36.38 35.08 3hbb s VAL 488 CO 0.02 -0.08 0.14 -0.36 -0.31 0.00 0.00 175.10 174.52 3hbb s PHE 489 N -1.35 3.32 -0.84 2.82 0.40 -1.26 -0.75 117.98 120.31 3hbb s PHE 489 Ca 0.11 -1.62 0.20 0.00 -0.60 0.00 0.00 56.93 55.02 3hbb s PHE 489 Cb -0.09 -2.53 0.81 0.00 0.51 0.00 0.00 43.02 41.72 3hbb s PHE 489 CO 0.06 -0.79 1.61 2.89 0.70 0.00 0.00 175.22 179.69 3hbb n ARG 490 N 4.79 0.07 -3.63 0.44 1.85 -0.17 -4.81 116.66 115.20 3hbb n ARG 490 Ca -0.11 0.26 -0.16 0.00 -1.00 0.00 0.00 57.85 56.85 3hbb n ARG 490 Cb 0.44 -1.62 -0.07 0.00 -1.05 0.00 0.00 32.46 30.15 3hbb n ARG 490 CO 0.00 0.00 0.00 0.50 -0.01 0.00 0.00 177.63 178.12 3hbb s ARG 491 N -3.09 0.85 0.50 2.89 3.52 -1.13 -5.06 118.95 117.42 3hbb s ARG 491 Ca 0.07 0.28 0.06 0.00 -0.13 0.00 0.00 55.73 56.01 3hbb s ARG 491 Cb 0.11 0.40 0.01 0.00 -1.56 0.00 0.00 34.95 33.91 3hbb s ARG 491 CO 0.36 -0.22 0.34 -1.21 -0.81 0.00 0.00 175.30 173.75 3hbb s GLU 492 N -0.83 2.29 0.07 5.12 0.41 -1.26 -4.83 118.70 119.66 3hbb s GLU 492 Ca -0.09 -1.93 0.01 0.00 -0.41 0.00 0.00 54.97 52.55 3hbb s GLU 492 Cb -0.03 -2.09 -0.04 0.00 -1.78 0.00 0.00 34.13 30.20 3hbb s GLU 492 CO 0.06 -0.45 -0.06 1.03 -0.49 0.00 0.00 175.26 175.35 3hbb s ARG 493 N -4.17 0.68 0.21 1.61 1.81 -1.26 -5.04 118.95 112.79 3hbb s ARG 493 Ca 0.36 -1.13 -0.05 0.00 -1.72 0.00 0.00 55.73 53.19 3hbb s ARG 493 Cb -0.01 -0.12 0.17 0.00 -0.45 0.00 0.00 34.95 34.53 3hbb s ARG 493 CO 0.21 -0.02 1.63 1.49 -0.68 0.00 0.00 175.30 177.93 3hbb h GLU 494 N 3.47 0.82 -6.48 3.54 4.81 -1.95 -3.42 114.58 115.37 3hbb h GLU 494 Ca -0.35 -0.32 -0.61 0.00 -0.13 0.00 0.00 59.36 57.95 3hbb h GLU 494 Cb 1.17 -0.04 -0.22 0.00 0.63 0.00 0.00 28.75 30.29 3hbb h GLU 494 CO 0.58 0.95 -0.84 -0.06 -0.73 0.00 0.00 179.01 178.90 3hbb s PHE 495 N -4.66 2.02 0.23 0.92 0.08 -1.26 -0.63 117.98 114.68 3hbb s PHE 495 Ca -0.10 -0.40 -0.07 0.00 0.12 0.00 0.00 56.93 56.48 3hbb s PHE 495 Cb 0.13 -1.09 0.21 0.00 -0.57 0.00 0.00 43.02 41.70 3hbb s PHE 495 CO 0.84 0.28 1.87 1.25 -0.10 0.00 0.00 175.22 179.36 3hbb h LEU 496 N 3.93 1.09 0.00 -0.37 5.85 -1.09 -2.13 115.31 122.59 3hbb h LEU 496 Ca -0.48 -0.08 0.00 0.00 0.84 0.00 0.00 57.88 58.16 3hbb h LEU 496 Cb 1.18 -0.28 0.00 0.00 0.37 0.00 0.00 40.66 41.93 3hbb h LEU 496 CO 0.40 0.85 0.00 -0.62 -0.34 0.00 0.00 178.44 178.73 3hbb n GLU 497 N -4.38 0.29 0.00 1.25 4.71 -1.26 -2.68 120.64 118.57 3hbb n GLU 497 Ca 0.10 0.09 0.12 0.00 -0.01 0.00 0.00 57.16 57.45 3hbb n GLU 497 Cb 0.07 -1.50 0.23 0.00 -1.01 0.00 0.00 31.44 29.23 3hbb n GLU 497 CO 0.00 0.00 0.00 -0.25 0.09 0.00 0.00 177.13 176.97 3hbb n ASP 498 N -1.30 1.22 -4.76 1.62 8.00 -0.80 -4.94 116.55 115.59 3hbb n ASP 498 Ca 0.10 -0.98 -0.38 0.00 0.71 0.00 0.00 54.79 54.24 3hbb n ASP 498 Cb 0.18 0.29 0.01 0.00 -0.02 0.00 0.00 41.12 41.58 3hbb n ASP 498 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 3hbb s TYR 499 N -2.59 2.63 0.10 1.24 2.02 -1.09 -4.97 117.35 114.69 3hbb s TYR 499 Ca 0.20 1.44 0.04 0.00 -0.37 0.00 0.00 57.07 58.39 3hbb s TYR 499 Cb 0.19 -3.61 -0.04 0.00 -0.40 0.00 0.00 41.96 38.10 3hbb s TYR 499 CO 0.58 -2.18 -0.11 -1.21 -1.57 0.00 0.00 175.55 171.06 3hbb s GLU 500 N -2.68 0.89 0.34 -0.62 2.02 -1.26 -5.01 118.70 112.38 3hbb s GLU 500 Ca 0.65 -1.17 0.06 0.00 0.02 0.00 0.00 54.97 54.53 3hbb s GLU 500 Cb -0.35 -0.64 0.72 0.00 0.10 0.00 0.00 34.13 33.96 3hbb s GLU 500 CO 0.43 0.11 1.88 1.49 0.02 0.00 0.00 175.26 179.19 3hbb h GLU 501 N 3.57 0.78 0.00 1.61 4.22 -1.93 -0.29 114.58 122.54 3hbb h GLU 501 Ca -0.38 -0.05 -0.01 0.00 0.08 0.00 0.00 59.36 59.00 3hbb h GLU 501 Cb 1.19 -0.18 -0.00 0.00 0.50 0.00 0.00 28.75 30.26 3hbb h GLU 501 CO 0.52 0.51 -0.05 0.78 -2.18 0.00 0.00 179.01 178.59 3hbb h GLY 502 N 0.80 0.00 2.00 1.92 0.00 -2.01 -2.86 103.07 102.91 3hbb h GLY 502 Ca 0.43 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.76 3hbb h GLY 502 CO -0.20 0.00 0.00 -0.55 0.00 0.00 0.00 176.54 175.79 3hbb h ASP 503 N 0.00 0.00 -4.24 0.19 3.32 -1.39 -3.45 116.42 110.84 3hbb h ASP 503 Ca -0.00 0.00 -0.43 0.00 0.02 0.00 0.00 57.03 56.62 3hbb h ASP 503 Cb 0.15 0.00 -0.20 0.00 0.22 0.00 0.00 39.33 39.50 3hbb h ASP 503 CO 0.01 0.00 -0.77 0.00 -1.72 0.00 0.00 179.24 176.75 3hbb s MET 504 N -3.43 0.95 -0.02 3.56 0.23 -1.08 -1.00 119.30 118.51 3hbb s MET 504 Ca 0.04 -1.11 0.02 0.00 -1.03 0.00 0.00 55.69 53.60 3hbb s MET 504 Cb 0.09 -0.93 0.00 0.00 -1.53 0.00 0.00 34.83 32.47 3hbb s MET 504 CO 0.46 0.19 -0.06 -2.00 -2.03 0.00 0.00 175.02 171.58 3hbb s GLU 505 N -2.20 0.66 -0.40 3.16 2.56 0.07 -4.94 118.70 117.61 3hbb s GLU 505 Ca 0.04 -0.22 -0.12 0.00 0.00 0.00 0.00 54.97 54.67 3hbb s GLU 505 Cb -0.08 -0.64 0.04 0.00 2.00 0.00 0.00 34.13 35.45 3hbb s GLU 505 CO 0.03 0.09 0.27 0.08 -0.56 0.00 0.00 175.26 175.16 3hbb s VAL 506 N 0.13 4.80 0.16 3.70 1.01 -1.26 -1.25 120.40 127.69 3hbb s VAL 506 Ca -0.01 -0.91 0.05 0.00 0.00 0.00 0.00 61.98 61.10 3hbb s VAL 506 Cb -0.06 -3.74 -0.04 0.00 0.00 0.00 0.00 36.38 32.54 3hbb s VAL 506 CO -0.00 -0.34 0.11 0.27 0.00 0.00 0.00 175.10 175.14 3hbb s ILE 507 N 1.58 4.39 -1.49 2.22 -0.00 -0.64 -4.57 121.20 122.69 3hbb s ILE 507 Ca 0.03 -1.09 -0.06 0.00 -0.00 0.00 0.00 60.65 59.53 3hbb s ILE 507 Cb -0.20 -3.22 0.01 0.00 -0.00 0.00 0.00 42.46 39.04 3hbb s ILE 507 CO 0.07 -0.08 0.79 0.47 -0.00 0.00 0.00 174.94 176.18 3hbb n ASP 508 N -0.23 -6.21 -4.56 4.36 8.00 -1.26 -1.52 116.55 115.13 3hbb n ASP 508 Ca -0.09 -0.36 -0.42 0.00 0.71 0.00 0.00 54.79 54.63 3hbb n ASP 508 Cb 0.54 -4.97 -0.07 0.00 -0.02 0.00 0.00 41.12 36.61 3hbb n ASP 508 CO 0.00 0.00 0.00 -0.47 -0.39 0.00 0.00 177.20 176.34 3hbb s TYR 509 N -3.22 3.13 -0.58 1.24 5.04 -1.26 -4.15 117.35 117.54 3hbb s TYR 509 Ca 0.39 0.27 0.06 0.00 -2.44 0.00 0.00 57.07 55.35 3hbb s TYR 509 Cb -0.17 -3.19 0.29 0.00 0.35 0.00 0.00 41.96 39.23 3hbb s TYR 509 CO 0.48 -0.68 0.79 0.00 -1.34 0.00 0.00 175.55 174.80 3hbb n ALA 510 N 6.10 3.97 -1.68 3.97 0.00 -1.26 -5.07 120.51 126.54 3hbb n ALA 510 Ca -0.01 -4.52 -0.31 0.00 0.00 0.00 0.00 53.44 48.60 3hbb n ALA 510 Cb 0.48 -0.84 0.05 0.00 0.00 0.00 0.00 19.45 19.15 3hbb n ALA 510 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 3hbb s PRO 511 N -2.67 2.79 0.69 0.00 0.04 -1.26 -4.97 135.00 129.62 3hbb s PRO 511 Ca 0.42 0.73 -0.13 0.00 0.04 0.00 0.00 61.00 62.06 3hbb s PRO 511 Cb 0.21 -1.99 0.02 0.00 0.04 0.00 0.00 34.50 32.77 3hbb s PRO 511 CO -0.07 -1.15 1.10 0.71 0.04 0.00 0.00 177.00 177.63 3hbb s TYR 512 N -3.16 2.66 1.22 0.56 1.51 -0.11 -4.98 117.35 115.04 3hbb s TYR 512 Ca 0.58 1.54 -0.18 0.00 -1.01 0.00 0.00 57.07 58.01 3hbb s TYR 512 Cb -0.13 -3.10 0.29 0.00 -0.11 0.00 0.00 41.96 38.91 3hbb s TYR 512 CO 0.54 -1.66 1.04 -2.14 -1.11 0.00 0.00 175.55 172.22 3hbb s PRO 513 N -4.41 -1.32 0.19 -1.71 0.02 -1.26 -4.39 135.00 122.11 3hbb s PRO 513 Ca 0.64 0.26 -0.06 0.00 0.02 0.00 0.00 61.00 61.86 3hbb s PRO 513 Cb -0.19 -1.55 -0.06 0.00 0.02 0.00 0.00 34.50 32.72 3hbb s PRO 513 CO 0.47 -3.85 0.45 -1.25 -0.33 0.00 0.00 177.00 172.49 3hbb s PRO 514 N -5.05 3.68 0.00 5.54 0.04 -1.26 -4.88 135.00 133.07 3hbb s PRO 514 Ca 0.69 0.03 0.00 0.00 0.04 0.00 0.00 61.00 61.76 3hbb s PRO 514 Cb -0.15 -2.76 0.00 0.00 0.04 0.00 0.00 34.50 31.63 3hbb s PRO 514 CO 0.59 0.39 0.08 -0.89 0.04 0.00 0.00 177.00 177.21