#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hb3 s PHE 18 N 0.00 1.80 0.00 1.61 -0.00 -1.26 -4.83 117.98 115.30 3hb3 s PHE 18 Ca 0.00 0.52 0.00 0.00 -0.00 0.00 0.00 56.93 57.45 3hb3 s PHE 18 Cb 0.00 -4.07 0.00 0.00 -0.00 0.00 0.00 43.02 38.95 3hb3 s PHE 18 CO 0.00 -3.23 0.00 0.34 -0.00 0.00 0.00 175.22 172.33 3hb3 n PHE 19 N 9.69 0.00 0.22 3.49 7.35 -1.26 0.37 117.46 137.31 3hb3 n PHE 19 Ca 0.22 0.00 0.05 0.00 -0.76 0.00 0.00 57.45 56.96 3hb3 n PHE 19 Cb 0.46 -0.04 0.49 0.00 0.35 0.00 0.00 39.48 40.74 3hb3 n PHE 19 CO 0.00 0.00 0.00 1.15 -0.76 0.00 0.00 176.76 177.15 3hb3 h THR 20 N 0.00 1.12 0.00 -2.13 2.02 -1.94 0.41 112.91 112.39 3hb3 h THR 20 Ca 0.00 -0.74 0.00 0.00 0.77 0.00 0.00 66.41 66.44 3hb3 h THR 20 Cb 0.00 1.40 0.00 0.00 -1.74 0.00 0.00 68.15 67.81 3hb3 h THR 20 CO 0.00 0.21 0.00 -0.09 0.37 0.00 0.00 175.52 176.01 3hb3 h ARG 21 N 0.00 0.00 0.00 6.66 1.12 0.63 -3.19 114.38 119.59 3hb3 h ARG 21 Ca -0.00 0.00 0.00 0.00 -1.11 0.00 0.00 59.98 58.87 3hb3 h ARG 21 Cb 0.39 0.00 0.00 0.00 -0.01 0.00 0.00 29.97 30.35 3hb3 h ARG 21 CO 0.03 0.00 0.00 0.91 -3.11 0.00 0.00 179.97 177.80 3hb3 n TRP 22 N -2.40 0.00 0.38 2.20 7.02 -0.97 -4.65 117.44 119.02 3hb3 n TRP 22 Ca -0.01 0.00 0.14 0.00 -1.02 0.00 0.00 57.50 56.61 3hb3 n TRP 22 Cb 0.11 0.20 0.42 0.00 -2.42 0.00 0.00 31.31 29.61 3hb3 n TRP 22 CO 0.00 0.00 0.00 0.74 -2.02 0.00 0.00 177.69 176.41 3hb3 h PHE 23 N 0.00 0.00 -0.00 -5.99 0.04 -0.39 -2.27 116.94 108.33 3hb3 h PHE 23 Ca 0.00 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.77 3hb3 h PHE 23 Cb 0.00 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.15 3hb3 h PHE 23 CO 0.00 0.00 -0.87 -0.12 -0.60 0.00 0.00 178.31 176.72 3hb3 n MET 24 N -2.70 0.01 -1.91 1.51 1.56 -1.16 -4.99 117.12 109.45 3hb3 n MET 24 Ca 0.03 -0.01 -0.41 0.00 -0.27 0.00 0.00 57.70 57.04 3hb3 n MET 24 Cb 0.39 -1.50 -0.01 0.00 2.15 0.00 0.00 33.22 34.25 3hb3 n MET 24 CO 0.00 0.00 0.00 0.45 -0.73 0.00 0.00 175.97 175.69 3hb3 s SER 25 N -2.99 6.48 -0.04 6.12 0.15 -0.86 -4.93 113.70 117.63 3hb3 s SER 25 Ca 0.09 2.93 0.19 0.00 0.70 0.00 0.00 55.95 59.87 3hb3 s SER 25 Cb 0.16 -2.66 0.62 0.00 -1.71 0.00 0.00 66.02 62.43 3hb3 s SER 25 CO 0.83 -0.76 1.53 0.35 1.20 0.00 0.00 173.24 176.38 3hb3 n THR 26 N 0.57 1.30 -2.96 6.45 -2.24 -1.26 -4.75 114.28 111.39 3hb3 n THR 26 Ca 0.01 -1.09 -0.41 0.00 -2.27 0.00 0.00 64.05 60.29 3hb3 n THR 26 Cb 0.40 0.36 -0.05 0.00 -2.10 0.00 0.00 70.33 68.95 3hb3 n THR 26 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 3hb3 s ASN 27 N -1.00 6.85 0.44 3.42 2.47 -1.26 -4.71 114.94 121.15 3hb3 s ASN 27 Ca 0.46 1.05 0.36 0.00 0.42 0.00 0.00 52.86 55.15 3hb3 s ASN 27 Cb 0.26 -2.42 1.45 0.00 -1.45 0.00 0.00 41.25 39.09 3hb3 s ASN 27 CO 0.27 -0.38 1.42 0.00 -3.72 0.00 0.00 177.10 174.70 3hb3 n HIS 28 N 5.29 0.38 0.05 0.43 1.44 -1.26 0.13 115.22 121.68 3hb3 n HIS 28 Ca 0.03 0.39 -0.08 0.00 -2.01 0.00 0.00 57.72 56.04 3hb3 n HIS 28 Cb 0.49 -0.82 -0.12 0.00 0.12 0.00 0.00 29.99 29.65 3hb3 n HIS 28 CO 0.00 0.00 0.00 0.87 -2.81 0.00 0.00 176.34 174.40 3hb3 h LYS 29 N 0.00 0.03 -0.12 -1.40 1.57 -1.86 -1.36 116.57 113.42 3hb3 h LYS 29 Ca 0.83 -0.05 -0.18 0.00 -1.87 0.00 0.00 60.65 59.37 3hb3 h LYS 29 Cb 2.94 0.02 0.01 0.00 0.08 0.00 0.00 32.23 35.27 3hb3 h LYS 29 CO -0.26 0.96 -0.63 -0.44 -0.57 0.00 0.00 179.45 178.51 3hb3 h ASP 30 N 0.01 0.76 0.19 0.86 3.32 0.67 -2.95 116.42 119.27 3hb3 h ASP 30 Ca -0.06 -0.64 -0.12 0.00 0.02 0.00 0.00 57.03 56.22 3hb3 h ASP 30 Cb 1.82 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 41.13 3hb3 h ASP 30 CO 0.13 1.28 -0.46 0.40 -1.72 0.00 0.00 179.24 178.87 3hb3 h ILE 31 N 0.29 1.33 0.00 0.35 2.04 -1.33 0.14 117.51 120.32 3hb3 h ILE 31 Ca -0.05 -1.65 -0.07 0.00 1.00 0.00 0.00 64.86 64.09 3hb3 h ILE 31 Cb 1.28 1.73 -0.01 0.00 -0.74 0.00 0.00 36.82 39.08 3hb3 h ILE 31 CO 0.13 0.50 -0.32 1.23 0.00 0.00 0.00 178.15 179.69 3hb3 h GLY 32 N 1.23 0.00 1.49 5.37 0.00 -1.30 -1.37 103.07 108.50 3hb3 h GLY 32 Ca 0.02 0.00 -0.29 0.00 0.00 0.00 0.00 47.33 47.06 3hb3 h GLY 32 CO 0.08 0.00 -1.35 -2.22 0.00 0.00 0.00 176.54 173.05 3hb3 h ILE 33 N 0.00 1.38 0.15 2.60 2.04 -0.62 -2.50 117.51 120.56 3hb3 h ILE 33 Ca -0.00 -2.96 -0.00 0.00 1.00 0.00 0.00 64.86 62.90 3hb3 h ILE 33 Cb 0.63 2.90 -0.00 0.00 -0.74 0.00 0.00 36.82 39.61 3hb3 h ILE 33 CO 0.04 0.86 -0.10 -0.07 0.00 0.00 0.00 178.15 178.89 3hb3 h LEU 34 N 0.08 -0.25 -1.66 1.44 3.38 -0.89 -2.51 115.31 114.89 3hb3 h LEU 34 Ca -0.18 0.02 0.04 0.00 0.09 0.00 0.00 57.88 57.85 3hb3 h LEU 34 Cb 2.00 0.08 -0.02 0.00 0.09 0.00 0.00 40.66 42.81 3hb3 h LEU 34 CO 0.20 -0.16 0.29 1.88 0.09 0.00 0.00 178.44 180.74 3hb3 h TYR 35 N -0.25 0.43 0.00 1.13 0.05 -1.15 -0.90 116.97 116.28 3hb3 h TYR 35 Ca -0.01 0.01 -0.16 0.00 0.05 0.00 0.00 58.73 58.62 3hb3 h TYR 35 Cb 0.22 -0.14 -0.02 0.00 1.01 0.00 0.00 36.73 37.79 3hb3 h TYR 35 CO -0.09 0.25 -0.75 -0.07 -1.05 0.00 0.00 178.16 176.44 3hb3 h LEU 36 N 0.44 0.00 0.08 3.88 3.38 -1.03 0.85 115.31 122.92 3hb3 h LEU 36 Ca 0.18 0.00 -0.28 0.00 0.09 0.00 0.00 57.88 57.87 3hb3 h LEU 36 Cb 0.16 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.90 3hb3 h LEU 36 CO -0.04 0.75 -1.51 -0.26 0.09 0.00 0.00 178.44 177.47 3hb3 h PHE 37 N 0.00 0.32 -0.08 1.13 0.04 -0.97 -2.26 116.94 115.11 3hb3 h PHE 37 Ca -0.01 -0.23 0.02 0.00 2.80 0.00 0.00 57.97 60.55 3hb3 h PHE 37 Cb 1.53 -0.01 -0.05 0.00 2.20 0.00 0.00 35.95 39.61 3hb3 h PHE 37 CO 0.00 1.59 -0.47 1.15 -0.60 0.00 0.00 178.31 179.98 3hb3 h THR 38 N -0.41 0.00 -0.34 -1.55 2.02 -1.23 0.78 112.91 112.18 3hb3 h THR 38 Ca -0.35 0.00 0.09 0.00 0.77 0.00 0.00 66.41 66.93 3hb3 h THR 38 Cb 1.69 0.00 -0.01 0.00 -1.74 0.00 0.00 68.15 68.09 3hb3 h THR 38 CO -0.01 0.00 0.24 0.00 0.37 0.00 0.00 175.52 176.12 3hb3 h ALA 39 N -0.49 2.28 0.00 6.16 0.00 -0.91 0.31 119.26 126.61 3hb3 h ALA 39 Ca 0.02 -0.01 -0.07 0.00 0.00 0.00 0.00 54.91 54.85 3hb3 h ALA 39 Cb 0.61 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.40 3hb3 h ALA 39 CO -0.36 -0.38 -0.34 0.78 0.00 0.00 0.00 179.25 178.95 3hb3 h GLY 40 N 0.03 0.00 0.07 0.00 0.00 -0.53 -0.55 103.07 102.09 3hb3 h GLY 40 Ca 0.16 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.49 3hb3 h GLY 40 CO -0.01 0.00 -0.03 -2.22 0.00 0.00 0.00 176.54 174.28 3hb3 h ILE 41 N 0.00 0.00 -0.85 2.60 2.04 0.19 -2.21 117.51 119.28 3hb3 h ILE 41 Ca -0.00 -0.88 0.16 0.00 1.00 0.00 0.00 64.86 65.14 3hb3 h ILE 41 Cb 1.13 0.00 -0.16 0.00 -0.74 0.00 0.00 36.82 37.06 3hb3 h ILE 41 CO 0.04 0.00 -0.24 0.52 0.00 0.00 0.00 178.15 178.47 3hb3 n VAL 42 N -4.70 -0.38 0.01 1.67 0.31 -0.77 -0.27 118.33 114.20 3hb3 n VAL 42 Ca -0.01 1.96 0.04 0.00 -0.01 0.00 0.00 64.34 66.32 3hb3 n VAL 42 Cb 0.04 -2.69 0.42 0.00 -0.91 0.00 0.00 33.84 30.69 3hb3 n VAL 42 CO 0.00 0.00 0.00 1.23 -1.32 0.00 0.00 176.83 176.74 3hb3 h GLY 43 N 0.00 0.56 1.05 2.92 0.00 -1.15 0.51 103.07 106.95 3hb3 h GLY 43 Ca 0.38 -0.22 -0.06 0.00 0.00 0.00 0.00 47.33 47.43 3hb3 h GLY 43 CO -0.87 0.21 0.19 -2.00 0.00 0.00 0.00 176.54 174.07 3hb3 h LEU 44 N 0.54 1.02 -0.07 3.11 5.85 0.03 -1.55 115.31 124.24 3hb3 h LEU 44 Ca 0.14 -0.22 -0.02 0.00 0.84 0.00 0.00 57.88 58.62 3hb3 h LEU 44 Cb -0.03 -0.27 -0.00 0.00 0.37 0.00 0.00 40.66 40.73 3hb3 h LEU 44 CO -0.03 0.98 -0.05 0.40 -0.34 0.00 0.00 178.44 179.40 3hb3 h ILE 45 N 1.02 1.34 -0.52 4.05 2.04 -0.78 -0.41 117.51 124.25 3hb3 h ILE 45 Ca 0.22 -1.11 0.07 0.00 1.00 0.00 0.00 64.86 65.05 3hb3 h ILE 45 Cb 0.34 1.92 -0.03 0.00 -0.74 0.00 0.00 36.82 38.32 3hb3 h ILE 45 CO -0.00 0.31 0.35 -1.28 0.00 0.00 0.00 178.15 177.52 3hb3 h SER 46 N -0.23 0.35 1.66 1.72 0.87 -0.84 0.23 113.55 117.31 3hb3 h SER 46 Ca 0.01 0.00 -0.06 0.00 -1.23 0.00 0.00 61.79 60.52 3hb3 h SER 46 Cb 0.51 -0.07 -0.01 0.00 -0.44 0.00 0.00 62.40 62.39 3hb3 h SER 46 CO 0.01 0.22 -0.34 0.58 -0.53 0.00 0.00 176.83 176.77 3hb3 h VAL 47 N 0.39 0.48 0.08 2.23 2.07 -1.01 -3.18 116.25 117.31 3hb3 h VAL 47 Ca 0.23 -1.69 -0.00 0.00 0.82 0.00 0.00 66.70 66.06 3hb3 h VAL 47 Cb 0.40 2.22 0.00 0.00 -1.52 0.00 0.00 31.29 32.39 3hb3 h VAL 47 CO -0.06 0.27 -0.04 0.00 0.02 0.00 0.00 177.57 177.77 3hb3 n PHE 49 N -5.07 0.18 -0.07 0.00 3.72 -0.97 -1.13 117.46 114.12 3hb3 n PHE 49 Ca -0.08 1.22 0.01 0.00 -0.05 0.00 0.00 57.45 58.54 3hb3 n PHE 49 Cb 0.13 -0.96 0.31 0.00 -0.94 0.00 0.00 39.48 38.03 3hb3 n PHE 49 CO 0.00 0.00 0.00 1.15 -0.05 0.00 0.00 176.76 177.86 3hb3 h THR 50 N 0.00 1.17 -0.03 4.37 2.02 -1.51 0.79 112.91 119.71 3hb3 h THR 50 Ca 0.40 -0.49 -0.16 0.00 0.77 0.00 0.00 66.41 66.93 3hb3 h THR 50 Cb 0.65 0.56 -0.01 0.00 -1.74 0.00 0.00 68.15 67.61 3hb3 h THR 50 CO -1.00 0.20 -0.72 0.58 0.37 0.00 0.00 175.52 174.95 3hb3 h VAL 51 N 0.68 1.45 0.28 3.16 2.07 -0.61 -1.60 116.25 121.68 3hb3 h VAL 51 Ca 0.17 -2.29 -0.01 0.00 0.82 0.00 0.00 66.70 65.38 3hb3 h VAL 51 Cb 0.09 2.23 0.00 0.00 -1.52 0.00 0.00 31.29 32.09 3hb3 h VAL 51 CO -0.02 0.67 -0.14 0.22 0.02 0.00 0.00 177.57 178.32 3hb3 h TYR 52 N 0.11 -0.35 -0.46 1.57 3.20 0.30 -1.16 116.97 120.18 3hb3 h TYR 52 Ca -0.02 -0.01 0.05 0.00 3.14 0.00 0.00 58.73 61.90 3hb3 h TYR 52 Cb 1.27 0.12 -0.06 0.00 1.54 0.00 0.00 36.73 39.59 3hb3 h TYR 52 CO 0.02 -0.01 -0.24 -1.33 -1.64 0.00 0.00 178.16 174.96 3hb3 n MET 53 N -5.05 -0.17 0.17 1.82 2.81 0.23 0.19 117.12 117.12 3hb3 n MET 53 Ca -0.08 0.70 0.06 0.00 -1.81 0.00 0.00 57.70 56.57 3hb3 n MET 53 Cb 0.26 -1.04 0.10 0.00 -0.71 0.00 0.00 33.22 31.82 3hb3 n MET 53 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 3hb3 h ARG 54 N 0.00 0.00 -0.51 0.03 2.47 -1.23 0.13 114.38 115.27 3hb3 h ARG 54 Ca 0.11 0.00 -0.02 0.00 -1.26 0.00 0.00 59.98 58.80 3hb3 h ARG 54 Cb 0.22 0.00 -0.02 0.00 -1.65 0.00 0.00 29.97 28.52 3hb3 h ARG 54 CO -0.44 0.34 0.23 0.52 0.56 0.00 0.00 179.97 181.17 3hb3 h MET 55 N 0.00 0.75 -0.38 0.04 2.86 0.10 0.22 114.93 118.53 3hb3 h MET 55 Ca -0.00 -0.12 -0.13 0.00 -2.06 0.00 0.00 59.70 57.39 3hb3 h MET 55 Cb 1.23 -0.13 -0.01 0.00 0.06 0.00 0.00 31.60 32.76 3hb3 h MET 55 CO 0.04 0.64 -0.26 1.49 1.06 0.00 0.00 176.91 179.89 3hb3 h GLU 56 N 0.68 0.84 0.00 1.72 4.57 -0.45 -3.04 114.58 118.91 3hb3 h GLU 56 Ca 0.17 -0.40 0.00 0.00 -1.18 0.00 0.00 59.36 57.95 3hb3 h GLU 56 Cb 0.15 -0.01 0.00 0.00 -0.16 0.00 0.00 28.75 28.74 3hb3 h GLU 56 CO -0.02 1.04 0.00 1.28 -1.18 0.00 0.00 179.01 180.13 3hb3 n LEU 57 N -4.20 0.00 -0.10 1.64 7.99 -0.04 -3.27 117.00 119.02 3hb3 n LEU 57 Ca -0.02 0.40 -0.07 0.00 -0.01 0.00 0.00 56.01 56.31 3hb3 n LEU 57 Cb 0.46 -0.40 0.00 0.00 -0.11 0.00 0.00 43.42 43.37 3hb3 n LEU 57 CO 0.46 -0.05 0.98 -0.61 -1.51 0.00 0.00 177.39 176.66 3hb3 h GLN 58 N 0.00 0.36 -5.70 3.23 4.15 -0.43 -3.42 115.11 113.30 3hb3 h GLN 58 Ca 0.00 -0.02 -0.47 0.00 0.77 0.00 0.00 58.65 58.92 3hb3 h GLN 58 Cb 0.35 -0.08 -0.21 0.00 0.21 0.00 0.00 27.48 27.76 3hb3 h GLN 58 CO 0.00 0.24 -0.79 -1.01 -1.93 0.00 0.00 178.83 175.33 3hb3 s HIS 59 N -6.16 1.51 0.46 3.99 3.76 -1.20 -3.45 115.29 114.19 3hb3 s HIS 59 Ca -0.13 -0.46 -0.24 0.00 -0.15 0.00 0.00 55.06 54.08 3hb3 s HIS 59 Cb 0.11 -0.82 -0.07 0.00 1.11 0.00 0.00 32.58 32.91 3hb3 s HIS 59 CO 0.71 0.15 1.28 -1.25 -0.85 0.00 0.00 174.74 174.78 3hb3 s PRO 60 N -2.07 3.68 0.00 8.40 0.04 -1.26 -4.75 135.00 139.03 3hb3 s PRO 60 Ca 0.05 2.06 0.00 0.00 0.04 0.00 0.00 61.00 63.15 3hb3 s PRO 60 Cb -0.09 -2.51 0.00 0.00 0.04 0.00 0.00 34.50 31.94 3hb3 s PRO 60 CO 0.03 -0.70 0.00 0.41 0.04 0.00 0.00 177.00 176.78 3hb3 n GLY 61 N 0.61 2.58 3.68 0.56 0.00 -1.26 -4.97 105.19 106.40 3hb3 n GLY 61 Ca 0.07 -1.53 -0.43 0.00 0.00 0.00 0.00 46.02 44.13 3hb3 n GLY 61 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3hb3 s VAL 62 N -0.86 4.65 0.00 1.61 1.01 -1.26 -4.95 120.40 120.59 3hb3 s VAL 62 Ca 0.00 1.94 0.00 0.00 0.00 0.00 0.00 61.98 63.92 3hb3 s VAL 62 Cb 0.00 -4.25 0.00 0.00 0.00 0.00 0.00 36.38 32.13 3hb3 s VAL 62 CO 0.00 -0.03 0.55 0.00 0.00 0.00 0.00 175.10 175.62 3hb3 n GLN 63 N 5.32 -0.60 0.03 2.72 3.00 -1.26 -4.79 117.38 121.79 3hb3 n GLN 63 Ca 0.10 -0.60 0.00 0.00 -0.01 0.00 0.00 57.00 56.49 3hb3 n GLN 63 Cb 0.48 -1.00 0.00 0.00 0.00 0.00 0.00 30.24 29.72 3hb3 n GLN 63 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.06 177.72 3hb3 n TYR 64 N -0.05 -0.49 -2.09 1.08 4.01 -1.26 -4.56 117.16 113.81 3hb3 n TYR 64 Ca 0.00 0.09 -0.40 0.00 -0.16 0.00 0.00 57.90 57.42 3hb3 n TYR 64 Cb 0.03 0.37 -0.00 0.00 -0.31 0.00 0.00 39.34 39.42 3hb3 n TYR 64 CO 0.00 0.00 0.00 -1.33 -0.46 0.00 0.00 176.86 175.07 3hb3 n MET 65 N -2.87 4.71 -2.48 -0.72 0.00 -1.26 -1.04 117.12 113.47 3hb3 n MET 65 Ca 0.00 -3.64 -0.42 0.00 0.00 0.00 0.00 57.70 53.64 3hb3 n MET 65 Cb 0.11 -2.61 -0.03 0.00 0.00 0.00 0.00 33.22 30.69 3hb3 n MET 65 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 3hb3 h LEU 67 N 5.99 0.00 0.00 0.00 5.85 -0.26 -2.08 115.31 124.82 3hb3 h LEU 67 Ca -0.43 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.29 3hb3 h LEU 67 Cb 1.21 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.24 3hb3 h LEU 67 CO 0.77 0.00 0.08 -0.62 -0.34 0.00 0.00 178.44 178.32 3hb3 n GLU 68 N -4.19 0.00 0.00 1.25 4.71 -1.26 -4.85 120.64 116.29 3hb3 n GLU 68 Ca 0.05 0.21 0.00 0.00 -0.01 0.00 0.00 57.16 57.41 3hb3 n GLU 68 Cb 0.44 -1.58 0.00 0.00 -1.01 0.00 0.00 31.44 29.30 3hb3 n GLU 68 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 3hb3 n GLY 69 N -1.15 2.42 3.66 0.62 0.00 -0.79 -5.07 105.19 104.89 3hb3 n GLY 69 Ca 0.00 -1.48 -0.50 0.00 0.00 0.00 0.00 46.02 44.04 3hb3 n GLY 69 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hb3 n ALA 70 N 1.78 0.48 -2.24 4.61 0.00 -1.21 -4.31 120.51 119.61 3hb3 n ALA 70 Ca 0.00 0.40 -0.23 0.00 0.00 0.00 0.00 53.44 53.61 3hb3 n ALA 70 Cb 0.00 -2.32 0.01 0.00 0.00 0.00 0.00 19.45 17.15 3hb3 n ALA 70 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 3hb3 s ARG 71 N 2.17 2.32 0.00 0.00 0.52 -0.21 -4.98 118.95 118.78 3hb3 s ARG 71 Ca 0.87 -1.81 0.00 0.00 -0.52 0.00 0.00 55.73 54.27 3hb3 s ARG 71 Cb -0.80 -2.34 0.00 0.00 0.52 0.00 0.00 34.95 32.33 3hb3 s ARG 71 CO 0.48 -0.63 0.00 -0.11 0.02 0.00 0.00 175.30 175.06 3hb3 n LEU 72 N -1.90 0.26 -4.57 2.53 -0.00 -1.26 -4.79 117.00 107.28 3hb3 n LEU 72 Ca 0.05 0.00 -0.29 0.00 -0.00 0.00 0.00 56.01 55.78 3hb3 n LEU 72 Cb 0.63 0.00 -0.10 0.00 -0.00 0.00 0.00 43.42 43.95 3hb3 n LEU 72 CO 0.40 0.04 -0.42 -0.63 -0.00 0.00 0.00 177.39 176.78 3hb3 s ILE 73 N -1.27 3.25 -0.19 1.96 -1.09 -1.26 -5.11 121.20 117.49 3hb3 s ILE 73 Ca 0.00 -1.44 -0.26 0.00 -2.23 0.00 0.00 60.65 56.72 3hb3 s ILE 73 Cb 0.00 -2.55 -0.01 0.00 -1.58 0.00 0.00 42.46 38.32 3hb3 s ILE 73 CO 0.00 0.03 0.88 0.00 -1.23 0.00 0.00 174.94 174.62 3hb3 s ALA 74 N -1.39 3.57 -0.36 9.38 0.00 -1.26 -4.95 121.76 126.75 3hb3 s ALA 74 Ca 0.22 0.04 -0.00 0.00 0.00 0.00 0.00 51.96 52.22 3hb3 s ALA 74 Cb -0.10 -3.32 0.10 0.00 0.00 0.00 0.00 23.12 19.80 3hb3 s ALA 74 CO 0.14 -0.79 0.11 0.34 0.00 0.00 0.00 175.76 175.56 3hb3 s ASP 75 N 1.21 5.00 0.36 0.00 2.15 -1.26 -4.99 116.67 119.14 3hb3 s ASP 75 Ca 0.39 -1.94 0.11 0.00 0.43 0.00 0.00 52.55 51.54 3hb3 s ASP 75 Cb -0.16 -1.73 0.88 0.00 -0.30 0.00 0.00 42.92 41.60 3hb3 s ASP 75 CO 0.10 -0.43 1.85 0.00 -0.17 0.00 0.00 175.17 176.52 3hb3 h ALA 76 N 7.88 1.91 -0.47 3.66 0.00 -1.98 -2.35 119.26 127.92 3hb3 h ALA 76 Ca -0.11 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.82 3hb3 h ALA 76 Cb 1.04 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.74 3hb3 h ALA 76 CO 0.60 -0.18 0.00 -1.13 0.00 0.00 0.00 179.25 178.54 3hb3 n SER 77 N -4.58 4.40 -3.87 0.00 3.41 -1.26 -4.61 113.62 107.12 3hb3 n SER 77 Ca 0.19 -2.60 -0.27 0.00 -0.26 0.00 0.00 58.87 55.93 3hb3 n SER 77 Cb 0.54 -0.60 -0.17 0.00 -0.26 0.00 0.00 64.21 63.73 3hb3 n SER 77 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3hb3 s ALA 78 N -2.17 1.28 -0.19 7.33 0.00 -0.88 -5.09 121.76 122.03 3hb3 s ALA 78 Ca 0.42 -0.62 -0.22 0.00 0.00 0.00 0.00 51.96 51.53 3hb3 s ALA 78 Cb 0.30 -1.00 -0.10 0.00 0.00 0.00 0.00 23.12 22.32 3hb3 s ALA 78 CO 0.15 -0.64 0.73 -1.91 0.00 0.00 0.00 175.76 174.10 3hb3 n GLU 79 N 4.95 0.00 -4.06 0.00 2.13 -1.26 -4.87 120.64 117.54 3hb3 n GLU 79 Ca -0.11 0.00 -0.34 0.00 0.66 0.00 0.00 57.16 57.36 3hb3 n GLU 79 Cb 0.49 -0.74 -0.14 0.00 0.27 0.00 0.00 31.44 31.31 3hb3 n GLU 79 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 3hb3 s THR 81 N 1.29 4.07 0.16 0.00 2.01 -1.26 -4.93 115.64 116.99 3hb3 s THR 81 Ca 0.03 -0.32 -0.33 0.00 0.31 0.00 0.00 61.69 61.39 3hb3 s THR 81 Cb -0.14 -2.93 -0.16 0.00 0.01 0.00 0.00 72.50 69.28 3hb3 s THR 81 CO -0.04 0.31 1.03 -2.65 -0.69 0.00 0.00 174.62 172.59 3hb3 n PRO 82 N 4.89 0.82 -3.40 4.92 -0.02 -1.26 0.42 135.00 141.38 3hb3 n PRO 82 Ca -0.16 0.29 -0.27 0.00 -2.02 0.00 0.00 63.50 61.34 3hb3 n PRO 82 Cb 0.51 -1.70 -0.08 0.00 -0.02 0.00 0.00 33.50 32.21 3hb3 n PRO 82 CO 0.00 0.00 0.00 -1.71 1.98 0.00 0.00 175.50 175.77 3hb3 n ASN 83 N 1.87 3.47 -0.68 2.55 5.15 0.82 -4.47 115.26 123.97 3hb3 n ASN 83 Ca 0.16 -3.39 0.52 0.00 -0.60 0.00 0.00 54.58 51.27 3hb3 n ASN 83 Cb 0.23 -0.67 0.80 0.00 -0.53 0.00 0.00 39.78 39.62 3hb3 n ASN 83 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 3hb3 n GLY 84 N 0.88 -0.97 0.31 8.20 0.00 -1.26 0.29 105.19 112.63 3hb3 n GLY 84 Ca 0.29 0.70 -0.04 0.00 0.00 0.00 0.00 46.02 46.98 3hb3 n GLY 84 CO 0.00 0.00 0.00 0.84 0.00 0.00 0.00 173.32 174.16 3hb3 h HIS 85 N 0.00 0.92 -0.08 1.61 6.17 -1.94 -1.71 115.15 120.12 3hb3 h HIS 85 Ca 0.93 -0.09 -0.10 0.00 0.71 0.00 0.00 60.37 61.83 3hb3 h HIS 85 Cb 3.67 -0.27 0.00 0.00 2.52 0.00 0.00 27.41 33.33 3hb3 h HIS 85 CO -0.00 0.77 -0.33 1.25 0.71 0.00 0.00 177.93 180.33 3hb3 h LEU 86 N 0.86 0.43 -0.98 0.26 6.46 -0.52 -2.50 115.31 119.31 3hb3 h LEU 86 Ca 0.19 -0.63 0.09 0.00 -0.12 0.00 0.00 57.88 57.40 3hb3 h LEU 86 Cb 0.31 -0.13 -0.12 0.00 -0.73 0.00 0.00 40.66 39.99 3hb3 h LEU 86 CO -0.00 0.99 -0.58 1.87 -0.62 0.00 0.00 178.44 180.10 3hb3 n TRP 87 N -4.41 -0.42 0.27 1.25 -0.00 -1.16 -1.09 117.44 111.88 3hb3 n TRP 87 Ca -0.08 1.23 0.14 0.00 -0.00 0.00 0.00 57.50 58.79 3hb3 n TRP 87 Cb 0.50 -0.58 0.77 0.00 -0.00 0.00 0.00 31.31 32.00 3hb3 n TRP 87 CO 0.00 0.00 0.00 -0.91 -0.00 0.00 0.00 177.69 176.78 3hb3 h ASN 88 N 0.00 0.00 -0.01 5.87 2.35 -1.16 -2.23 115.58 120.41 3hb3 h ASN 88 Ca 0.16 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.90 3hb3 h ASN 88 Cb 0.41 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.78 3hb3 h ASN 88 CO -0.92 0.09 -0.05 0.58 -1.65 0.00 0.00 177.43 175.48 3hb3 h VAL 89 N 0.00 1.56 0.37 2.81 2.07 -0.74 -2.19 116.25 120.13 3hb3 h VAL 89 Ca -0.00 -1.72 -0.01 0.00 0.82 0.00 0.00 66.70 65.79 3hb3 h VAL 89 Cb 0.32 2.69 -0.02 0.00 -1.52 0.00 0.00 31.29 32.77 3hb3 h VAL 89 CO 0.01 0.45 -0.36 0.24 0.02 0.00 0.00 177.57 177.93 3hb3 h MET 90 N -0.65 -0.71 -0.74 1.57 2.86 -0.61 -2.06 114.93 114.60 3hb3 h MET 90 Ca -0.01 0.05 0.15 0.00 -2.06 0.00 0.00 59.70 57.83 3hb3 h MET 90 Cb 0.77 0.16 -0.05 0.00 0.06 0.00 0.00 31.60 32.54 3hb3 h MET 90 CO 0.01 -0.47 0.50 -0.84 1.06 0.00 0.00 176.91 177.17 3hb3 h ILE 91 N -0.73 0.79 -0.03 -1.22 -0.00 -1.52 0.55 117.51 115.36 3hb3 h ILE 91 Ca -0.05 -0.13 -0.18 0.00 -0.00 0.00 0.00 64.86 64.50 3hb3 h ILE 91 Cb 0.63 0.38 -0.01 0.00 -0.00 0.00 0.00 36.82 37.82 3hb3 h ILE 91 CO -0.04 0.07 -0.77 0.74 -0.00 0.00 0.00 178.15 178.15 3hb3 h THR 92 N 0.38 1.44 0.02 0.16 2.02 -1.20 -2.49 112.91 113.24 3hb3 h THR 92 Ca 0.36 -2.35 -0.31 0.00 0.77 0.00 0.00 66.41 64.88 3hb3 h THR 92 Cb 0.87 2.27 -0.05 0.00 -1.74 0.00 0.00 68.15 69.50 3hb3 h THR 92 CO -0.11 0.69 -1.83 -1.22 0.37 0.00 0.00 175.52 173.43 3hb3 n TYR 93 N -3.75 0.95 -0.10 3.16 4.01 0.06 -1.19 117.16 120.30 3hb3 n TYR 93 Ca -0.03 0.31 -0.09 0.00 -0.16 0.00 0.00 57.90 57.93 3hb3 n TYR 93 Cb 0.73 -1.16 -0.03 0.00 -0.31 0.00 0.00 39.34 38.57 3hb3 n TYR 93 CO 0.00 0.00 0.00 1.25 -0.46 0.00 0.00 176.86 177.65 3hb3 h HIS 94 N 0.01 -1.04 -0.49 -0.72 -0.00 -0.03 -0.63 115.15 112.24 3hb3 h HIS 94 Ca -0.34 0.06 -0.10 0.00 -0.00 0.00 0.00 60.37 59.99 3hb3 h HIS 94 Cb 2.03 0.51 -0.02 0.00 -0.00 0.00 0.00 27.41 29.93 3hb3 h HIS 94 CO 0.01 -0.41 -0.11 0.78 -0.00 0.00 0.00 177.93 178.20 3hb3 h GLY 95 N -0.32 0.98 1.54 5.26 0.00 -1.52 -0.54 103.07 108.47 3hb3 h GLY 95 Ca 0.14 -0.77 -0.16 0.00 0.00 0.00 0.00 47.33 46.54 3hb3 h GLY 95 CO -0.52 0.70 -0.60 -2.08 0.00 0.00 0.00 176.54 174.04 3hb3 h VAL 96 N 0.81 1.34 0.08 4.60 2.07 -1.02 -2.23 116.25 121.90 3hb3 h VAL 96 Ca 0.13 -1.90 -0.00 0.00 0.82 0.00 0.00 66.70 65.75 3hb3 h VAL 96 Cb 0.63 1.88 0.00 0.00 -1.52 0.00 0.00 31.29 32.29 3hb3 h VAL 96 CO 0.04 0.58 -0.04 -0.07 0.02 0.00 0.00 177.57 178.11 3hb3 h LEU 97 N 0.36 -0.09 -0.67 2.57 3.38 -0.79 -1.44 115.31 118.62 3hb3 h LEU 97 Ca -0.00 -0.42 0.13 0.00 0.09 0.00 0.00 57.88 57.68 3hb3 h LEU 97 Cb 1.15 0.02 -0.10 0.00 0.09 0.00 0.00 40.66 41.82 3hb3 h LEU 97 CO 0.11 0.39 0.16 0.24 0.09 0.00 0.00 178.44 179.43 3hb3 h MET 98 N -0.60 0.27 0.00 1.13 2.86 -1.15 0.43 114.93 117.87 3hb3 h MET 98 Ca -0.01 -0.02 -0.14 0.00 -2.06 0.00 0.00 59.70 57.48 3hb3 h MET 98 Cb 0.50 -0.06 -0.02 0.00 0.06 0.00 0.00 31.60 32.08 3hb3 h MET 98 CO 0.02 0.18 -1.17 0.52 1.06 0.00 0.00 176.91 177.52 3hb3 h MET 99 N 0.28 0.00 -0.00 1.72 2.86 -1.35 -2.94 114.93 115.49 3hb3 h MET 99 Ca 0.36 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 58.00 3hb3 h MET 99 Cb 0.58 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.24 3hb3 h MET 99 CO -0.45 0.30 -0.34 1.19 1.06 0.00 0.00 176.91 178.67 3hb3 n PHE 100 N -2.94 0.00 -0.59 -0.22 3.72 -0.55 -4.80 117.46 112.08 3hb3 n PHE 100 Ca -0.06 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.34 3hb3 n PHE 100 Cb 0.79 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.33 3hb3 n PHE 100 CO 0.00 0.00 0.00 1.19 -0.05 0.00 0.00 176.76 177.90 3hb3 n PHE 101 N -1.09 0.00 0.00 1.38 3.72 0.14 -4.75 117.46 116.86 3hb3 n PHE 101 Ca 0.02 -0.03 0.00 0.00 -0.05 0.00 0.00 57.45 57.39 3hb3 n PHE 101 Cb 0.12 -0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.66 3hb3 n PHE 101 CO 0.00 0.00 0.00 0.28 -0.05 0.00 0.00 176.76 176.99 3hb3 n VAL 102 N -0.03 0.00 -0.23 -4.37 0.31 -0.67 -4.66 118.33 108.68 3hb3 n VAL 102 Ca 0.00 0.00 0.02 0.00 -0.01 0.00 0.00 64.34 64.35 3hb3 n VAL 102 Cb 0.19 -0.06 0.26 0.00 -0.91 0.00 0.00 33.84 33.31 3hb3 n VAL 102 CO 0.00 0.00 0.00 -0.37 -1.32 0.00 0.00 176.83 175.14 3hb3 h VAL 103 N 0.00 1.15 -0.10 2.52 -1.51 -1.82 -0.80 116.25 115.69 3hb3 h VAL 103 Ca 0.00 -0.34 -0.18 0.00 -1.23 0.00 0.00 66.70 64.95 3hb3 h VAL 103 Cb 0.00 0.07 0.01 0.00 -2.13 0.00 0.00 31.29 29.24 3hb3 h VAL 103 CO 0.00 0.18 -0.62 0.40 -1.23 0.00 0.00 177.57 176.30 3hb3 h ILE 104 N 1.00 1.34 -0.62 7.19 2.04 -1.87 -1.10 117.51 125.49 3hb3 h ILE 104 Ca 0.30 -1.91 0.07 0.00 1.00 0.00 0.00 64.86 64.32 3hb3 h ILE 104 Cb -0.02 2.18 -0.04 0.00 -0.74 0.00 0.00 36.82 38.20 3hb3 h ILE 104 CO -0.08 0.58 0.41 -0.65 0.00 0.00 0.00 178.15 178.42 3hb3 h PRO 105 N 0.24 0.56 0.34 2.37 0.11 -1.56 0.27 132.00 134.33 3hb3 h PRO 105 Ca -0.05 -0.03 -0.02 0.00 0.11 0.00 0.00 66.00 66.01 3hb3 h PRO 105 Cb 1.27 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 32.26 3hb3 h PRO 105 CO 0.13 0.37 -0.16 0.00 -0.21 0.00 0.00 178.00 178.13 3hb3 h ALA 106 N 1.67 -0.82 0.14 -0.75 0.00 -0.94 0.19 119.26 118.75 3hb3 h ALA 106 Ca 0.27 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 55.07 3hb3 h ALA 106 Cb 0.32 0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.29 3hb3 h ALA 106 CO -0.08 -0.79 -0.07 -0.07 0.00 0.00 0.00 179.25 178.24 3hb3 h LEU 107 N -0.60 -0.16 0.08 0.00 3.38 -1.13 1.06 115.31 117.94 3hb3 h LEU 107 Ca -0.05 -0.22 -0.17 0.00 0.09 0.00 0.00 57.88 57.53 3hb3 h LEU 107 Cb 0.35 0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.15 3hb3 h LEU 107 CO 0.08 0.14 -0.80 0.15 0.09 0.00 0.00 178.44 178.09 3hb3 h PHE 108 N -0.48 0.32 0.14 1.13 3.57 -1.15 -1.11 116.94 119.37 3hb3 h PHE 108 Ca -0.02 -0.24 -0.30 0.00 3.53 0.00 0.00 57.97 60.95 3hb3 h PHE 108 Cb 0.38 -0.01 0.00 0.00 2.79 0.00 0.00 35.95 39.11 3hb3 h PHE 108 CO 0.02 1.31 -1.40 0.78 -2.23 0.00 0.00 178.31 176.79 3hb3 h GLY 109 N -0.49 0.33 0.00 2.40 0.00 -1.09 -3.09 103.07 101.14 3hb3 h GLY 109 Ca -0.17 -0.85 0.00 0.00 0.00 0.00 0.00 47.33 46.31 3hb3 h GLY 109 CO 0.05 0.74 0.00 0.61 0.00 0.00 0.00 176.54 177.95 3hb3 n GLY 110 N 1.62 1.23 0.33 4.60 0.00 0.36 -3.68 105.19 109.64 3hb3 n GLY 110 Ca -0.13 0.00 0.06 0.00 0.00 0.00 0.00 46.02 45.95 3hb3 n GLY 110 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 3hb3 h PHE 111 N 0.00 0.56 -0.17 1.61 0.04 -1.36 -1.71 116.94 115.90 3hb3 h PHE 111 Ca 0.00 0.01 -0.12 0.00 2.80 0.00 0.00 57.97 60.66 3hb3 h PHE 111 Cb 0.00 -0.19 -0.01 0.00 2.20 0.00 0.00 35.95 37.95 3hb3 h PHE 111 CO 0.00 0.32 -0.42 0.78 -0.60 0.00 0.00 178.31 178.39 3hb3 h GLY 112 N 0.58 0.44 1.76 -1.45 0.00 -1.12 -0.48 103.07 102.80 3hb3 h GLY 112 Ca 0.21 -0.44 -0.23 0.00 0.00 0.00 0.00 47.33 46.87 3hb3 h GLY 112 CO -0.06 0.40 -1.07 3.43 0.00 0.00 0.00 176.54 179.24 3hb3 h ASN 113 N 0.34 0.28 0.00 0.19 2.35 -1.32 -2.72 115.58 114.70 3hb3 h ASN 113 Ca 0.03 -0.27 -0.00 0.00 -0.55 0.00 0.00 56.30 55.50 3hb3 h ASN 113 Cb 0.88 -0.09 0.00 0.00 0.05 0.00 0.00 38.32 39.16 3hb3 h ASN 113 CO 0.07 1.17 -0.00 0.22 -1.65 0.00 0.00 177.43 177.24 3hb3 h TYR 114 N 0.07 0.00 0.00 1.19 5.03 -1.03 -3.40 116.97 118.84 3hb3 h TYR 114 Ca -0.08 -0.00 -0.14 0.00 2.58 0.00 0.00 58.73 61.09 3hb3 h TYR 114 Cb 1.77 -0.00 -0.03 0.00 1.55 0.00 0.00 36.73 40.03 3hb3 h TYR 114 CO 0.04 0.81 -1.76 1.19 -1.32 0.00 0.00 178.16 177.12 3hb3 n PHE 115 N -4.70 0.45 -0.05 -3.82 3.72 -0.21 -4.15 117.46 108.71 3hb3 n PHE 115 Ca -0.09 0.15 -0.10 0.00 -0.05 0.00 0.00 57.45 57.35 3hb3 n PHE 115 Cb 0.40 -0.87 -0.04 0.00 -0.94 0.00 0.00 39.48 38.03 3hb3 n PHE 115 CO 0.00 0.00 0.00 1.98 -0.05 0.00 0.00 176.76 178.69 3hb3 h MET 116 N 0.00 0.27 -0.62 -1.08 4.05 -1.58 0.14 114.93 116.11 3hb3 h MET 116 Ca -0.18 -0.03 -0.06 0.00 -0.28 0.00 0.00 59.70 59.14 3hb3 h MET 116 Cb 1.48 -0.05 -0.03 0.00 -0.80 0.00 0.00 31.60 32.20 3hb3 h MET 116 CO 0.02 0.27 0.13 -1.35 0.23 0.00 0.00 176.91 176.22 3hb3 h PRO 117 N 0.19 0.99 -0.56 0.39 0.11 -1.79 -2.07 132.00 129.26 3hb3 h PRO 117 Ca 0.07 -0.23 0.08 0.00 0.11 0.00 0.00 66.00 66.03 3hb3 h PRO 117 Cb 0.09 -0.13 -0.07 0.00 0.11 0.00 0.00 31.00 31.00 3hb3 h PRO 117 CO -0.01 0.89 0.21 -0.07 -0.21 0.00 0.00 178.00 178.81 3hb3 h LEU 118 N 0.94 0.21 -1.73 2.35 3.38 -1.61 0.23 115.31 119.09 3hb3 h LEU 118 Ca 0.20 0.07 -0.04 0.00 0.09 0.00 0.00 57.88 58.20 3hb3 h LEU 118 Cb 0.36 0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.16 3hb3 h LEU 118 CO 0.00 0.14 -0.17 0.45 0.09 0.00 0.00 178.44 178.95 3hb3 h HIS 119 N 0.39 0.00 -0.25 1.13 3.86 -0.02 -1.60 115.15 118.67 3hb3 h HIS 119 Ca 0.28 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.49 3hb3 h HIS 119 Cb 0.32 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.79 3hb3 h HIS 119 CO -0.16 0.17 0.00 0.44 0.86 0.00 0.00 177.93 179.24 3hb3 n ILE 120 N -3.98 1.77 -3.93 2.45 -5.35 -0.94 -4.58 119.36 104.80 3hb3 n ILE 120 Ca -0.02 -1.58 -0.28 0.00 -0.27 0.00 0.00 62.75 60.60 3hb3 n ILE 120 Cb 0.26 0.03 -0.01 0.00 -1.74 0.00 0.00 39.64 38.18 3hb3 n ILE 120 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3hb3 n GLY 121 N -0.26 -0.38 3.88 3.28 0.00 -0.37 -1.51 105.19 109.82 3hb3 n GLY 121 Ca 0.17 0.21 -0.36 0.00 0.00 0.00 0.00 46.02 46.04 3hb3 n GLY 121 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hb3 s ALA 122 N -3.87 3.86 0.06 4.61 0.00 0.68 -3.73 121.76 123.36 3hb3 s ALA 122 Ca 0.11 -0.59 -0.30 0.00 0.00 0.00 0.00 51.96 51.18 3hb3 s ALA 122 Cb -0.05 -2.03 -0.18 0.00 0.00 0.00 0.00 23.12 20.86 3hb3 s ALA 122 CO 0.89 0.62 1.56 -1.00 0.00 0.00 0.00 175.76 177.84 3hb3 h PRO 123 N 4.59 -0.70 0.00 0.00 0.13 -1.79 -3.38 132.00 130.84 3hb3 h PRO 123 Ca -0.53 0.05 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 3hb3 h PRO 123 Cb 1.22 0.16 0.00 0.00 0.13 0.00 0.00 31.00 32.51 3hb3 h PRO 123 CO 0.62 -0.44 0.00 -3.47 -0.23 0.00 0.00 178.00 174.47 3hb3 n ASP 124 N -5.38 0.26 -4.89 1.44 -0.08 -1.26 -4.63 116.55 102.00 3hb3 n ASP 124 Ca -0.12 -0.95 -0.29 0.00 -1.51 0.00 0.00 54.79 51.92 3hb3 n ASP 124 Cb 0.31 0.00 0.01 0.00 2.34 0.00 0.00 41.12 43.79 3hb3 n ASP 124 CO 0.00 0.00 0.00 -0.04 0.12 0.00 0.00 177.20 177.28 3hb3 s MET 125 N -1.85 3.39 0.20 -0.67 -1.94 -1.26 -4.94 119.30 112.23 3hb3 s MET 125 Ca 0.00 0.41 -0.16 0.00 -1.71 0.00 0.00 55.69 54.24 3hb3 s MET 125 Cb 0.00 -2.20 0.20 0.00 2.01 0.00 0.00 34.83 34.84 3hb3 s MET 125 CO 0.00 -0.52 1.62 0.00 -0.01 0.00 0.00 175.02 176.11 3hb3 h ALA 126 N -0.15 0.29 -3.22 3.03 0.00 -1.93 -3.34 119.26 113.93 3hb3 h ALA 126 Ca -0.45 0.22 -0.63 0.00 0.00 0.00 0.00 54.91 54.05 3hb3 h ALA 126 Cb 1.21 0.54 -0.41 0.00 0.00 0.00 0.00 17.79 19.13 3hb3 h ALA 126 CO 0.62 -0.49 -0.66 -0.06 0.00 0.00 0.00 179.25 178.66 3hb3 s PHE 127 N -6.18 2.84 0.25 0.00 0.08 -1.26 -4.96 117.98 108.75 3hb3 s PHE 127 Ca -0.14 -2.97 0.01 0.00 0.12 0.00 0.00 56.93 53.94 3hb3 s PHE 127 Cb 0.18 -2.51 0.29 0.00 -0.57 0.00 0.00 43.02 40.41 3hb3 s PHE 127 CO 0.72 -0.73 1.64 -1.35 -0.10 0.00 0.00 175.22 175.40 3hb3 h PRO 128 N 6.43 0.51 -0.48 0.24 0.11 -1.85 -2.10 132.00 134.86 3hb3 h PRO 128 Ca -0.03 -0.24 0.05 0.00 0.11 0.00 0.00 66.00 65.89 3hb3 h PRO 128 Cb 0.89 -0.01 -0.07 0.00 0.11 0.00 0.00 31.00 31.92 3hb3 h PRO 128 CO 0.63 0.80 -0.39 0.07 -0.21 0.00 0.00 178.00 178.89 3hb3 h ARG 129 N 0.43 -0.13 -0.54 1.05 0.11 -1.93 -1.69 114.38 111.68 3hb3 h ARG 129 Ca 0.05 0.01 0.10 0.00 0.10 0.00 0.00 59.98 60.23 3hb3 h ARG 129 Cb 0.83 0.03 -0.03 0.00 1.11 0.00 0.00 29.97 31.91 3hb3 h ARG 129 CO 0.07 -0.09 0.36 -0.07 0.10 0.00 0.00 179.97 180.35 3hb3 h LEU 130 N -0.14 0.29 -0.36 0.08 3.38 -1.88 -2.05 115.31 114.63 3hb3 h LEU 130 Ca 0.08 0.01 -0.19 0.00 0.09 0.00 0.00 57.88 57.86 3hb3 h LEU 130 Cb 0.34 -0.06 -0.00 0.00 0.09 0.00 0.00 40.66 41.03 3hb3 h LEU 130 CO -0.52 0.18 -0.76 -1.13 0.09 0.00 0.00 178.44 176.29 3hb3 h ASN 131 N 0.33 0.52 -0.35 -0.43 -0.00 -0.68 -1.11 115.58 113.85 3hb3 h ASN 131 Ca 0.25 -0.35 -0.11 0.00 -0.00 0.00 0.00 56.30 56.08 3hb3 h ASN 131 Cb 0.55 -0.15 -0.02 0.00 -0.00 0.00 0.00 38.32 38.70 3hb3 h ASN 131 CO -0.06 1.10 -0.19 -1.13 -0.00 0.00 0.00 177.43 177.15 3hb3 h ASN 132 N 0.29 0.84 0.52 1.15 -0.73 -0.64 -2.90 115.58 114.10 3hb3 h ASN 132 Ca -0.04 -0.29 -0.02 0.00 1.87 0.00 0.00 56.30 57.82 3hb3 h ASN 132 Cb 1.35 -0.23 -0.01 0.00 0.27 0.00 0.00 38.32 39.69 3hb3 h ASN 132 CO 0.13 1.02 -0.40 0.25 -0.37 0.00 0.00 177.43 178.05 3hb3 h LEU 133 N 0.73 -1.06 -0.73 0.34 5.85 -1.04 -1.63 115.31 117.77 3hb3 h LEU 133 Ca 0.11 0.08 0.29 0.00 0.84 0.00 0.00 57.88 59.19 3hb3 h LEU 133 Cb 0.71 0.34 -0.13 0.00 0.37 0.00 0.00 40.66 41.95 3hb3 h LEU 133 CO 0.05 -0.59 0.35 -1.54 -0.34 0.00 0.00 178.44 176.37 3hb3 n SER 134 N -5.52 0.21 0.08 1.25 3.41 -0.46 0.50 113.62 113.09 3hb3 n SER 134 Ca -0.12 1.21 -0.13 0.00 -0.26 0.00 0.00 58.87 59.57 3hb3 n SER 134 Cb 0.41 -0.57 -0.06 0.00 -0.26 0.00 0.00 64.21 63.73 3hb3 n SER 134 CO 0.00 0.00 0.00 0.22 -0.16 0.00 0.00 175.04 175.10 3hb3 h TYR 135 N 0.00 0.55 -0.06 7.33 3.20 -1.10 -2.27 116.97 124.61 3hb3 h TYR 135 Ca 0.60 -0.32 -0.03 0.00 3.14 0.00 0.00 58.73 62.11 3hb3 h TYR 135 Cb 1.55 -0.05 -0.00 0.00 1.54 0.00 0.00 36.73 39.76 3hb3 h TYR 135 CO -0.05 1.16 -0.09 -1.49 -1.64 0.00 0.00 178.16 176.05 3hb3 h TRP 136 N 0.18 0.21 -0.71 -3.82 -0.00 0.61 -0.89 115.95 111.54 3hb3 h TRP 136 Ca -0.09 -0.07 0.13 0.00 -0.00 0.00 0.00 58.89 58.86 3hb3 h TRP 136 Cb 1.66 -0.04 -0.13 0.00 -0.00 0.00 0.00 29.16 30.64 3hb3 h TRP 136 CO 0.06 0.66 -0.25 0.52 -0.00 0.00 0.00 178.44 179.43 3hb3 h MET 137 N -0.30 -0.06 -0.69 0.49 2.86 -1.10 0.14 114.93 116.28 3hb3 h MET 137 Ca 0.01 0.00 0.12 0.00 -2.06 0.00 0.00 59.70 57.77 3hb3 h MET 137 Cb 0.64 0.01 -0.09 0.00 0.06 0.00 0.00 31.60 32.23 3hb3 h MET 137 CO 0.02 -0.04 0.25 -0.92 1.06 0.00 0.00 176.91 177.29 3hb3 h TYR 138 N -0.06 0.44 -0.40 -0.22 3.20 -0.74 0.58 116.97 119.77 3hb3 h TYR 138 Ca 0.31 0.03 -0.07 0.00 3.14 0.00 0.00 58.73 62.15 3hb3 h TYR 138 Cb 0.55 -0.09 -0.01 0.00 1.54 0.00 0.00 36.73 38.72 3hb3 h TYR 138 CO -0.63 0.07 -0.01 0.28 -1.64 0.00 0.00 178.16 176.23 3hb3 h VAL 139 N 0.41 1.26 -0.01 1.81 2.07 0.45 -1.29 116.25 120.96 3hb3 h VAL 139 Ca 0.36 -1.03 0.03 0.00 0.82 0.00 0.00 66.70 66.89 3hb3 h VAL 139 Cb 0.51 1.14 -0.04 0.00 -1.52 0.00 0.00 31.29 31.38 3hb3 h VAL 139 CO -0.37 0.35 -0.20 0.00 0.02 0.00 0.00 177.57 177.37 3hb3 h GLY 141 N -0.32 1.19 2.00 0.00 0.00 -0.74 2.05 103.07 107.25 3hb3 h GLY 141 Ca 0.06 -0.28 -0.02 0.00 0.00 0.00 0.00 47.33 47.10 3hb3 h GLY 141 CO -0.20 0.10 -0.10 -2.08 0.00 0.00 0.00 176.54 174.26 3hb3 h VAL 142 N 0.71 0.87 0.09 4.60 2.07 -0.40 -1.25 116.25 122.94 3hb3 h VAL 142 Ca 0.38 -0.38 -0.22 0.00 0.82 0.00 0.00 66.70 67.31 3hb3 h VAL 142 Cb 0.37 1.21 -0.00 0.00 -1.52 0.00 0.00 31.29 31.35 3hb3 h VAL 142 CO -0.26 0.10 -1.09 0.00 0.02 0.00 0.00 177.57 176.34 3hb3 h ALA 143 N 1.90 0.11 -0.97 1.67 0.00 0.42 -2.46 119.26 119.93 3hb3 h ALA 143 Ca -0.00 -0.94 0.19 0.00 0.00 0.00 0.00 54.91 54.16 3hb3 h ALA 143 Cb 0.21 0.37 -0.09 0.00 0.00 0.00 0.00 17.79 18.27 3hb3 h ALA 143 CO 0.01 0.61 0.61 -0.07 0.00 0.00 0.00 179.25 180.42 3hb3 h LEU 144 N -0.49 0.64 -0.48 0.00 3.38 0.33 0.15 115.31 118.84 3hb3 h LEU 144 Ca -0.24 0.07 -0.17 0.00 0.09 0.00 0.00 57.88 57.64 3hb3 h LEU 144 Cb 1.59 -0.04 -0.00 0.00 0.09 0.00 0.00 40.66 42.29 3hb3 h LEU 144 CO 0.04 0.24 -0.59 1.23 0.09 0.00 0.00 178.44 179.45 3hb3 h GLY 145 N 0.63 0.60 1.26 0.83 0.00 -1.10 -1.09 103.07 104.19 3hb3 h GLY 145 Ca 0.53 -0.73 -0.18 0.00 0.00 0.00 0.00 47.33 46.95 3hb3 h GLY 145 CO -0.29 0.66 -0.57 -2.08 0.00 0.00 0.00 176.54 174.26 3hb3 h VAL 146 N 0.41 1.29 0.13 4.60 2.07 -0.68 -1.66 116.25 122.41 3hb3 h VAL 146 Ca -0.00 -1.78 -0.00 0.00 0.82 0.00 0.00 66.70 65.74 3hb3 h VAL 146 Cb 1.14 1.70 -0.01 0.00 -1.52 0.00 0.00 31.29 32.60 3hb3 h VAL 146 CO 0.11 0.57 -0.20 0.00 0.02 0.00 0.00 177.57 178.07 3hb3 h ALA 147 N 0.76 -0.83 -0.64 1.67 0.00 -0.96 -1.54 119.26 117.72 3hb3 h ALA 147 Ca 0.01 -0.06 0.07 0.00 0.00 0.00 0.00 54.91 54.93 3hb3 h ALA 147 Cb 1.16 0.51 -0.09 0.00 0.00 0.00 0.00 17.79 19.38 3hb3 h ALA 147 CO 0.12 -0.86 -0.33 0.45 0.00 0.00 0.00 179.25 178.63 3hb3 n SER 148 N -3.54 -0.57 0.30 0.00 2.88 -0.42 0.17 113.62 112.43 3hb3 n SER 148 Ca -0.04 1.13 0.19 0.00 -1.33 0.00 0.00 58.87 58.81 3hb3 n SER 148 Cb 0.17 -0.19 0.97 0.00 -0.75 0.00 0.00 64.21 64.40 3hb3 n SER 148 CO 0.00 0.00 0.00 0.25 -1.23 0.00 0.00 175.04 174.06 3hb3 h LEU 149 N 0.00 0.00 0.00 2.46 5.85 -0.52 -2.57 115.31 120.53 3hb3 h LEU 149 Ca 0.15 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.87 3hb3 h LEU 149 Cb 0.31 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.34 3hb3 h LEU 149 CO -0.61 0.00 -0.90 0.18 -0.34 0.00 0.00 178.44 176.76 3hb3 n LEU 150 N -3.25 0.27 -4.72 2.25 4.77 0.45 -3.62 117.00 113.15 3hb3 n LEU 150 Ca -0.01 -0.29 -0.30 0.00 -0.03 0.00 0.00 56.01 55.38 3hb3 n LEU 150 Cb 0.25 0.00 0.13 0.00 -2.33 0.00 0.00 43.42 41.48 3hb3 n LEU 150 CO 0.20 0.07 0.67 0.00 -1.33 0.00 0.00 177.39 177.00 3hb3 s ALA 151 N -2.28 1.62 -0.03 -1.18 0.00 0.17 -4.75 121.76 115.32 3hb3 s ALA 151 Ca 0.01 -0.02 -0.30 0.00 0.00 0.00 0.00 51.96 51.65 3hb3 s ALA 151 Cb 0.07 -3.20 -0.04 0.00 0.00 0.00 0.00 23.12 19.95 3hb3 s ALA 151 CO 0.42 -2.29 1.28 -2.14 0.00 0.00 0.00 175.76 173.03 3hb3 s PRO 152 N -4.92 4.33 0.00 0.00 0.02 -1.26 -0.27 135.00 132.89 3hb3 s PRO 152 Ca 0.63 1.78 0.00 0.00 0.02 0.00 0.00 61.00 63.43 3hb3 s PRO 152 Cb -0.18 -3.56 0.00 0.00 0.02 0.00 0.00 34.50 30.78 3hb3 s PRO 152 CO 0.57 -0.50 0.00 0.41 -0.33 0.00 0.00 177.00 177.15 3hb3 n GLY 153 N 3.47 5.27 3.70 0.52 0.00 0.67 0.01 105.19 118.83 3hb3 n GLY 153 Ca 0.12 -1.47 -0.31 0.00 0.00 0.00 0.00 46.02 44.36 3hb3 n GLY 153 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3hb3 s GLY 154 N 0.00 1.75 -1.30 -0.02 0.00 -1.26 -3.15 107.32 103.33 3hb3 s GLY 154 Ca 0.00 0.54 0.00 0.00 0.00 0.00 0.00 44.72 45.26 3hb3 s GLY 154 CO 0.00 0.94 0.00 0.70 0.00 0.00 0.00 173.10 174.74 3hb3 n ASN 155 N -3.93 -4.45 -3.66 1.64 4.13 -1.26 -1.90 115.26 105.84 3hb3 n ASN 155 Ca 0.11 0.11 -0.21 0.00 1.68 0.00 0.00 54.58 56.27 3hb3 n ASN 155 Cb 0.52 -3.47 0.04 0.00 -1.54 0.00 0.00 39.78 35.34 3hb3 n ASN 155 CO 0.00 0.00 0.00 0.47 0.28 0.00 0.00 177.26 178.01 3hb3 n ASP 156 N -0.55 -1.45 -3.89 6.41 8.00 -1.26 -4.98 116.55 118.83 3hb3 n ASP 156 Ca -0.16 -0.78 -0.09 0.00 0.71 0.00 0.00 54.79 54.47 3hb3 n ASP 156 Cb 0.57 -4.25 -0.06 0.00 -0.02 0.00 0.00 41.12 37.35 3hb3 n ASP 156 CO 0.00 0.00 0.00 -1.10 -0.39 0.00 0.00 177.20 175.71 3hb3 s GLN 157 N -5.89 1.15 -0.01 -1.24 -0.21 -0.80 -5.07 119.66 107.60 3hb3 s GLN 157 Ca 0.03 -1.06 -0.30 0.00 0.02 0.00 0.00 55.36 54.05 3hb3 s GLN 157 Cb -0.01 0.40 -0.03 0.00 1.00 0.00 0.00 33.01 34.37 3hb3 s GLN 157 CO 0.80 -0.43 1.00 -1.64 -2.12 0.00 0.00 175.29 172.90 3hb3 s MET 158 N -3.93 4.53 0.00 2.91 -1.94 -1.26 -0.24 119.30 119.38 3hb3 s MET 158 Ca 0.13 1.45 0.00 0.00 -1.71 0.00 0.00 55.69 55.56 3hb3 s MET 158 Cb 0.03 -3.46 0.00 0.00 2.01 0.00 0.00 34.83 33.41 3hb3 s MET 158 CO -0.03 -0.10 0.00 0.41 -0.01 0.00 0.00 175.02 175.29 3hb3 n GLY 159 N 2.95 -2.16 3.75 -0.03 0.00 0.63 -4.71 105.19 105.63 3hb3 n GLY 159 Ca 0.07 -1.33 -0.38 0.00 0.00 0.00 0.00 46.02 44.37 3hb3 n GLY 159 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3hb3 s SER 160 N -2.45 5.22 -0.12 1.61 0.01 -1.26 -4.25 113.70 112.46 3hb3 s SER 160 Ca 0.00 2.71 0.18 0.00 1.31 0.00 0.00 55.95 60.15 3hb3 s SER 160 Cb 0.00 -2.63 0.43 0.00 0.21 0.00 0.00 66.02 64.03 3hb3 s SER 160 CO 0.00 -1.60 1.19 0.61 0.41 0.00 0.00 173.24 173.85 3hb3 n GLY 161 N 0.72 3.13 0.46 3.44 0.00 -1.26 -4.00 105.19 107.68 3hb3 n GLY 161 Ca 0.11 -1.16 0.04 0.00 0.00 0.00 0.00 46.02 45.00 3hb3 n GLY 161 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 3hb3 n VAL 162 N -0.33 0.35 -1.44 1.61 0.24 -1.26 -4.72 118.33 112.78 3hb3 n VAL 162 Ca 0.14 -0.31 0.18 0.00 -2.04 0.00 0.00 64.34 62.30 3hb3 n VAL 162 Cb 0.92 0.10 -0.09 0.00 -1.47 0.00 0.00 33.84 33.30 3hb3 n VAL 162 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3hb3 n GLY 163 N 0.80 -3.16 0.30 7.63 0.00 -1.26 -3.79 105.19 105.71 3hb3 n GLY 163 Ca 0.08 -1.06 0.19 0.00 0.00 0.00 0.00 46.02 45.22 3hb3 n GLY 163 CO 0.00 0.00 0.00 0.11 0.00 0.00 0.00 173.32 173.43 3hb3 h TRP 164 N -1.41 0.00 -0.63 1.61 5.08 -1.83 -1.66 115.95 117.10 3hb3 h TRP 164 Ca -0.16 0.00 0.00 0.00 1.08 0.00 0.00 58.89 59.81 3hb3 h TRP 164 Cb 1.37 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 27.53 3hb3 h TRP 164 CO 0.04 0.03 0.00 1.33 -1.28 0.00 0.00 178.44 178.55 3hb3 n VAL 165 N -3.22 2.04 -3.90 0.12 0.24 -1.26 -4.78 118.33 107.57 3hb3 n VAL 165 Ca -0.02 -1.25 -0.25 0.00 -2.04 0.00 0.00 64.34 60.78 3hb3 n VAL 165 Cb 0.19 0.04 -0.01 0.00 -1.47 0.00 0.00 33.84 32.59 3hb3 n VAL 165 CO 0.00 0.00 0.00 0.18 -2.14 0.00 0.00 176.83 174.87 3hb3 n LEU 166 N 1.01 -2.42 -4.69 1.34 4.77 -0.63 -4.90 117.00 111.48 3hb3 n LEU 166 Ca 0.26 -0.96 -0.42 0.00 -0.03 0.00 0.00 56.01 54.87 3hb3 n LEU 166 Cb 0.96 -2.33 -0.03 0.00 -2.33 0.00 0.00 43.42 39.69 3hb3 n LEU 166 CO 0.26 0.42 1.30 -0.31 -1.33 0.00 0.00 177.39 177.73 3hb3 s TYR 167 N -3.84 2.44 0.83 -1.77 1.51 -1.25 -4.69 117.35 110.58 3hb3 s TYR 167 Ca 0.06 0.37 -0.11 0.00 -1.01 0.00 0.00 57.07 56.38 3hb3 s TYR 167 Cb -0.03 -3.92 0.09 0.00 -0.11 0.00 0.00 41.96 37.99 3hb3 s TYR 167 CO 0.87 -3.69 1.09 -1.25 -1.11 0.00 0.00 175.55 171.47 3hb3 s PRO 168 N 2.71 1.75 0.01 -1.71 0.04 -1.26 -1.25 135.00 135.28 3hb3 s PRO 168 Ca 0.73 1.08 0.28 0.00 0.04 0.00 0.00 61.00 63.13 3hb3 s PRO 168 Cb -0.38 -1.85 1.14 0.00 0.04 0.00 0.00 34.50 33.46 3hb3 s PRO 168 CO 0.31 -1.97 1.87 -2.30 0.04 0.00 0.00 177.00 174.95 3hb3 n PRO 169 N -3.74 0.01 -0.34 0.56 -0.02 -1.26 -4.76 135.00 125.45 3hb3 n PRO 169 Ca 0.08 0.01 0.26 0.00 -2.02 0.00 0.00 63.50 61.83 3hb3 n PRO 169 Cb 0.54 -1.51 0.51 0.00 -0.02 0.00 0.00 33.50 33.02 3hb3 n PRO 169 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 3hb3 h LEU 170 N 0.00 0.47 0.00 2.45 5.85 -1.94 -0.37 115.31 121.76 3hb3 h LEU 170 Ca 0.00 0.20 -0.21 0.00 0.84 0.00 0.00 57.88 58.70 3hb3 h LEU 170 Cb 0.51 0.15 -0.04 0.00 0.37 0.00 0.00 40.66 41.65 3hb3 h LEU 170 CO 0.00 -0.18 -1.46 0.77 -0.34 0.00 0.00 178.44 177.22 3hb3 h SER 171 N 0.26 0.00 0.08 1.25 4.64 -1.45 -2.00 113.55 116.32 3hb3 h SER 171 Ca 0.76 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 62.08 3hb3 h SER 171 Cb 1.83 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.92 3hb3 h SER 171 CO -0.61 0.76 -0.01 0.35 -0.87 0.00 0.00 176.83 176.44 3hb3 n THR 172 N -2.99 0.00 -0.08 2.95 -2.24 -0.77 -4.02 114.28 107.13 3hb3 n THR 172 Ca -0.11 -0.07 -0.09 0.00 -2.27 0.00 0.00 64.05 61.50 3hb3 n THR 172 Cb 0.92 -0.20 -0.11 0.00 -2.10 0.00 0.00 70.33 68.85 3hb3 n THR 172 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 175.07 174.91 3hb3 n THR 173 N -0.72 1.03 -1.30 4.28 -1.04 -0.22 -4.72 114.28 111.58 3hb3 n THR 173 Ca 0.21 -0.55 -0.38 0.00 -2.04 0.00 0.00 64.05 61.29 3hb3 n THR 173 Cb 0.20 -0.81 0.03 0.00 -1.82 0.00 0.00 70.33 67.93 3hb3 n THR 173 CO 0.00 0.00 0.00 1.21 -0.64 0.00 0.00 175.07 175.64 3hb3 n GLU 174 N -2.72 0.21 0.04 -2.82 2.13 -0.76 -4.94 120.64 111.78 3hb3 n GLU 174 Ca -0.27 0.09 -0.02 0.00 0.66 0.00 0.00 57.16 57.61 3hb3 n GLU 174 Cb 0.93 -1.35 -0.01 0.00 0.27 0.00 0.00 31.44 31.28 3hb3 n GLU 174 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 3hb3 h ALA 175 N -0.05 -0.26 -3.00 4.31 0.00 -1.93 -3.47 119.26 114.86 3hb3 h ALA 175 Ca -0.43 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.44 3hb3 h ALA 175 Cb 1.41 0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.25 3hb3 h ALA 175 CO 0.42 -0.25 0.00 0.41 0.00 0.00 0.00 179.25 179.83 3hb3 n GLY 176 N 1.18 -0.75 0.00 0.00 0.00 -1.19 -4.93 105.19 99.49 3hb3 n GLY 176 Ca -0.02 -0.51 0.00 0.00 0.00 0.00 0.00 46.02 45.49 3hb3 n GLY 176 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 173.32 174.90 3hb3 n TYR 177 N 0.00 0.00 -0.23 1.61 4.11 0.10 -4.76 117.16 117.98 3hb3 n TYR 177 Ca 0.00 -0.30 0.12 0.00 -0.00 0.00 0.00 57.90 57.72 3hb3 n TYR 177 Cb 0.00 -0.03 0.40 0.00 -0.00 0.00 0.00 39.34 39.71 3hb3 n TYR 177 CO 0.00 0.00 0.00 1.03 -0.00 0.00 0.00 176.86 177.89 3hb3 h SER 178 N 0.00 0.60 0.29 9.48 0.87 -1.45 -0.93 113.55 122.41 3hb3 h SER 178 Ca 0.00 0.03 -0.14 0.00 -1.23 0.00 0.00 61.79 60.45 3hb3 h SER 178 Cb 0.59 -0.09 -0.01 0.00 -0.44 0.00 0.00 62.40 62.45 3hb3 h SER 178 CO 0.00 0.32 -0.57 0.24 -0.53 0.00 0.00 176.83 176.28 3hb3 h MET 179 N 0.64 0.30 0.00 2.24 2.86 -1.86 -1.49 114.93 117.62 3hb3 h MET 179 Ca 0.41 -0.19 -0.04 0.00 -2.06 0.00 0.00 59.70 57.82 3hb3 h MET 179 Cb 0.69 0.02 -0.01 0.00 0.06 0.00 0.00 31.60 32.36 3hb3 h MET 179 CO -0.17 0.79 -0.20 -0.44 1.06 0.00 0.00 176.91 177.94 3hb3 h ASP 180 N 0.22 0.00 -0.01 1.22 3.32 -1.54 -2.38 116.42 117.25 3hb3 h ASP 180 Ca -0.00 0.00 -0.10 0.00 0.02 0.00 0.00 57.03 56.95 3hb3 h ASP 180 Cb 1.07 0.00 0.01 0.00 0.22 0.00 0.00 39.33 40.63 3hb3 h ASP 180 CO 0.09 0.20 -0.37 -0.07 -1.72 0.00 0.00 179.24 177.38 3hb3 h LEU 181 N 0.00 0.34 -0.97 1.55 3.38 -0.87 -2.25 115.31 116.48 3hb3 h LEU 181 Ca -0.00 -0.76 0.19 0.00 0.09 0.00 0.00 57.88 57.39 3hb3 h LEU 181 Cb 0.86 -0.10 -0.18 0.00 0.09 0.00 0.00 40.66 41.33 3hb3 h LEU 181 CO 0.03 1.05 -0.27 0.00 0.09 0.00 0.00 178.44 179.34 3hb3 n ALA 182 N -2.55 0.16 -0.03 1.53 0.00 -0.60 0.28 120.51 119.31 3hb3 n ALA 182 Ca -0.10 1.05 -0.02 0.00 0.00 0.00 0.00 53.44 54.37 3hb3 n ALA 182 Cb 0.56 -0.60 0.24 0.00 0.00 0.00 0.00 19.45 19.65 3hb3 n ALA 182 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 3hb3 h ILE 183 N 0.00 1.22 -0.05 0.00 2.04 -1.32 0.80 117.51 120.20 3hb3 h ILE 183 Ca 0.44 -0.94 -0.19 0.00 1.00 0.00 0.00 64.86 65.17 3hb3 h ILE 183 Cb 0.68 1.00 -0.00 0.00 -0.74 0.00 0.00 36.82 37.76 3hb3 h ILE 183 CO -0.99 0.32 -0.79 -0.26 0.00 0.00 0.00 178.15 176.42 3hb3 h PHE 184 N 0.56 0.54 0.11 1.37 0.04 0.45 -1.80 116.94 118.20 3hb3 h PHE 184 Ca 0.11 -0.26 -0.01 0.00 2.80 0.00 0.00 57.97 60.62 3hb3 h PHE 184 Cb 0.43 -0.08 0.00 0.00 2.20 0.00 0.00 35.95 38.50 3hb3 h PHE 184 CO 0.02 1.03 -0.05 0.00 -0.60 0.00 0.00 178.31 178.71 3hb3 h ALA 185 N 0.90 -0.14 -0.83 2.45 0.00 0.52 -1.39 119.26 120.77 3hb3 h ALA 185 Ca -0.04 -0.12 0.06 0.00 0.00 0.00 0.00 54.91 54.80 3hb3 h ALA 185 Cb 1.38 0.06 -0.05 0.00 0.00 0.00 0.00 17.79 19.18 3hb3 h ALA 185 CO 0.13 -0.48 0.54 0.28 0.00 0.00 0.00 179.25 179.73 3hb3 h VAL 186 N -0.35 1.07 -0.02 0.00 2.07 -0.89 0.01 116.25 118.13 3hb3 h VAL 186 Ca -0.01 -0.32 -0.10 0.00 0.82 0.00 0.00 66.70 67.09 3hb3 h VAL 186 Cb 0.29 0.05 -0.01 0.00 -1.52 0.00 0.00 31.29 30.10 3hb3 h VAL 186 CO 0.02 0.17 -0.43 0.45 0.02 0.00 0.00 177.57 177.80 3hb3 h HIS 187 N 0.93 0.06 0.00 1.57 -0.00 -0.92 -1.80 115.15 114.99 3hb3 h HIS 187 Ca 0.35 -0.02 -0.00 0.00 -0.00 0.00 0.00 60.37 60.70 3hb3 h HIS 187 Cb 0.18 -0.01 0.00 0.00 -0.00 0.00 0.00 27.41 27.58 3hb3 h HIS 187 CO -0.00 0.48 -0.00 0.28 -0.00 0.00 0.00 177.93 178.69 3hb3 h VAL 188 N 0.04 1.53 -0.64 2.45 2.07 0.07 -2.76 116.25 119.00 3hb3 h VAL 188 Ca 0.00 -2.12 0.06 0.00 0.82 0.00 0.00 66.70 65.46 3hb3 h VAL 188 Cb 0.78 2.87 -0.08 0.00 -1.52 0.00 0.00 31.29 33.35 3hb3 h VAL 188 CO 0.06 0.51 -0.38 -0.24 0.02 0.00 0.00 177.57 177.54 3hb3 n SER 189 N -4.64 -0.68 -0.36 0.57 2.88 -0.48 -1.60 113.62 109.30 3hb3 n SER 189 Ca -0.09 1.24 0.28 0.00 -1.33 0.00 0.00 58.87 58.97 3hb3 n SER 189 Cb 0.40 -0.20 0.57 0.00 -0.75 0.00 0.00 64.21 64.24 3hb3 n SER 189 CO 0.00 0.00 0.00 1.23 -1.23 0.00 0.00 175.04 175.04 3hb3 h GLY 190 N 0.00 1.13 1.42 0.46 0.00 -1.26 0.07 103.07 104.89 3hb3 h GLY 190 Ca 0.10 -0.16 -0.28 0.00 0.00 0.00 0.00 47.33 46.99 3hb3 h GLY 190 CO -0.60 -0.19 -1.40 0.00 0.00 0.00 0.00 176.54 174.34 3hb3 h ALA 191 N 1.60 0.35 0.70 3.60 0.00 -1.00 -1.01 119.26 123.50 3hb3 h ALA 191 Ca 0.65 -1.10 -0.03 0.00 0.00 0.00 0.00 54.91 54.43 3hb3 h ALA 191 Cb 1.86 0.18 0.00 0.00 0.00 0.00 0.00 17.79 19.83 3hb3 h ALA 191 CO -0.30 1.22 -0.37 1.03 0.00 0.00 0.00 179.25 180.83 3hb3 h SER 192 N 0.04 -0.90 -0.97 0.00 0.87 -0.53 -0.38 113.55 111.68 3hb3 h SER 192 Ca -0.18 0.04 0.12 0.00 -1.23 0.00 0.00 61.79 60.54 3hb3 h SER 192 Cb 1.95 0.24 -0.14 0.00 -0.44 0.00 0.00 62.40 64.02 3hb3 h SER 192 CO 0.15 -0.60 -0.48 0.28 -0.53 0.00 0.00 176.83 175.64 3hb3 h SER 193 N -0.98 -1.77 -0.99 6.23 0.02 -1.13 0.25 113.55 115.17 3hb3 h SER 193 Ca -0.10 0.32 0.08 0.00 -0.84 0.00 0.00 61.79 61.25 3hb3 h SER 193 Cb 0.76 0.84 -0.07 0.00 0.14 0.00 0.00 62.40 64.08 3hb3 h SER 193 CO 0.14 -0.27 0.64 0.40 -1.14 0.00 0.00 176.83 176.60 3hb3 h ILE 194 N -0.02 1.04 -0.55 3.27 2.04 -1.06 -0.98 117.51 121.25 3hb3 h ILE 194 Ca 0.25 -0.38 -0.07 0.00 1.00 0.00 0.00 64.86 65.66 3hb3 h ILE 194 Cb 0.51 -0.16 -0.02 0.00 -0.74 0.00 0.00 36.82 36.41 3hb3 h ILE 194 CO -0.95 0.20 0.06 -0.07 0.00 0.00 0.00 178.15 177.39 3hb3 h LEU 195 N 1.10 0.86 -0.08 1.44 3.38 0.11 -1.72 115.31 120.41 3hb3 h LEU 195 Ca 0.44 -0.20 0.03 0.00 0.09 0.00 0.00 57.88 58.25 3hb3 h LEU 195 Cb 0.26 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 40.76 3hb3 h LEU 195 CO -0.19 0.88 -0.09 1.23 0.09 0.00 0.00 178.44 180.37 3hb3 h GLY 196 N 1.00 -0.02 0.97 0.83 0.00 0.13 -2.69 103.07 103.28 3hb3 h GLY 196 Ca 0.17 0.10 0.04 0.00 0.00 0.00 0.00 47.33 47.64 3hb3 h GLY 196 CO 0.01 -0.10 0.60 0.00 0.00 0.00 0.00 176.54 177.06 3hb3 h ALA 197 N 0.95 1.42 -0.17 3.60 0.00 -0.63 -0.63 119.26 123.80 3hb3 h ALA 197 Ca 0.06 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.91 3hb3 h ALA 197 Cb 0.20 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 3hb3 h ALA 197 CO -0.15 0.49 0.03 0.82 0.00 0.00 0.00 179.25 180.44 3hb3 h ILE 198 N 1.15 1.21 0.75 0.00 2.04 -0.99 -1.12 117.51 120.54 3hb3 h ILE 198 Ca 0.37 -0.69 -0.03 0.00 1.00 0.00 0.00 64.86 65.51 3hb3 h ILE 198 Cb 0.02 1.35 -0.01 0.00 -0.74 0.00 0.00 36.82 37.45 3hb3 h ILE 198 CO -0.11 0.21 -0.50 0.78 0.00 0.00 0.00 178.15 178.53 3hb3 h ASN 199 N 0.07 -1.29 -0.97 1.72 2.35 -1.35 -0.92 115.58 115.19 3hb3 h ASN 199 Ca 0.05 0.08 0.28 0.00 -0.55 0.00 0.00 56.30 56.16 3hb3 h ASN 199 Cb 0.29 0.39 -0.04 0.00 0.05 0.00 0.00 38.32 39.01 3hb3 h ASN 199 CO 0.00 -0.75 0.71 0.40 -1.65 0.00 0.00 177.43 176.15 3hb3 h ILE 200 N -1.18 0.48 0.03 2.81 5.03 -1.01 -0.05 117.51 123.62 3hb3 h ILE 200 Ca -0.10 0.00 -0.29 0.00 -0.12 0.00 0.00 64.86 64.35 3hb3 h ILE 200 Cb 0.96 0.50 -0.04 0.00 -3.03 0.00 0.00 36.82 35.21 3hb3 h ILE 200 CO 0.07 0.00 -1.64 0.40 -0.68 0.00 0.00 178.15 176.31 3hb3 h ILE 201 N 0.00 0.96 0.00 -0.67 2.04 -0.78 -2.89 117.51 116.17 3hb3 h ILE 201 Ca 0.46 -2.76 -0.00 0.00 1.00 0.00 0.00 64.86 63.56 3hb3 h ILE 201 Cb 1.88 2.52 -0.00 0.00 -0.74 0.00 0.00 36.82 40.48 3hb3 h ILE 201 CO -0.00 0.64 -0.00 0.74 0.00 0.00 0.00 178.15 179.52 3hb3 h THR 202 N 0.02 0.22 -0.42 -0.27 2.02 -0.03 -2.51 112.91 111.94 3hb3 h THR 202 Ca -0.26 -1.16 0.04 0.00 0.77 0.00 0.00 66.41 65.79 3hb3 h THR 202 Cb 1.99 0.42 -0.05 0.00 -1.74 0.00 0.00 68.15 68.76 3hb3 h THR 202 CO 0.10 0.07 -0.25 0.41 0.37 0.00 0.00 175.52 176.23 3hb3 n THR 203 N -4.76 -0.28 -0.24 3.16 -1.04 -0.14 -0.50 114.28 110.48 3hb3 n THR 203 Ca -0.01 1.79 0.04 0.00 -2.04 0.00 0.00 64.05 63.83 3hb3 n THR 203 Cb 0.06 -2.29 0.16 0.00 -1.82 0.00 0.00 70.33 66.44 3hb3 n THR 203 CO 0.00 0.00 0.00 0.15 -0.64 0.00 0.00 175.07 174.58 3hb3 h PHE 204 N 0.00 0.13 -0.53 -1.42 3.04 -1.63 0.22 116.94 116.75 3hb3 h PHE 204 Ca 0.07 0.05 -0.12 0.00 3.98 0.00 0.00 57.97 61.95 3hb3 h PHE 204 Cb 0.17 0.05 -0.02 0.00 2.56 0.00 0.00 35.95 38.72 3hb3 h PHE 204 CO -0.92 -0.14 -0.12 -0.07 -2.02 0.00 0.00 178.31 175.04 3hb3 h LEU 205 N 0.19 1.02 0.00 0.59 3.38 -0.46 -3.39 115.31 116.65 3hb3 h LEU 205 Ca 0.39 -0.36 0.00 0.00 0.09 0.00 0.00 57.88 58.01 3hb3 h LEU 205 Cb 0.67 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 41.14 3hb3 h LEU 205 CO -0.55 1.14 -0.83 0.59 0.09 0.00 0.00 178.44 178.88 3hb3 n ASN 206 N -4.16 1.28 -0.67 -0.43 3.02 0.35 -4.72 115.26 109.93 3hb3 n ASN 206 Ca 0.01 -0.46 0.05 0.00 -0.03 0.00 0.00 54.58 54.15 3hb3 n ASN 206 Cb 0.41 1.17 0.10 0.00 -0.61 0.00 0.00 39.78 40.85 3hb3 n ASN 206 CO 0.00 0.00 0.00 0.23 -2.62 0.00 0.00 177.26 174.87 3hb3 n MET 207 N -1.46 0.78 -2.26 3.52 2.81 0.63 -5.02 117.12 116.12 3hb3 n MET 207 Ca 0.00 -2.31 -0.41 0.00 -1.81 0.00 0.00 57.70 53.18 3hb3 n MET 207 Cb 0.19 -0.95 -0.03 0.00 -0.71 0.00 0.00 33.22 31.72 3hb3 n MET 207 CO 0.00 0.00 0.00 1.03 1.51 0.00 0.00 175.97 178.51 3hb3 s ARG 208 N -1.65 4.45 0.33 0.03 0.52 -1.26 -4.00 118.95 117.36 3hb3 s ARG 208 Ca 0.27 2.03 -0.29 0.00 -0.52 0.00 0.00 55.73 57.23 3hb3 s ARG 208 Cb 0.27 -3.16 -0.10 0.00 0.52 0.00 0.00 34.95 32.48 3hb3 s ARG 208 CO -0.05 -0.11 1.34 0.00 0.02 0.00 0.00 175.30 176.50 3hb3 s ALA 209 N -0.61 3.52 0.21 2.13 0.00 -0.57 -4.93 121.76 121.52 3hb3 s ALA 209 Ca 0.51 1.31 -0.32 0.00 0.00 0.00 0.00 51.96 53.47 3hb3 s ALA 209 Cb -0.36 -3.50 -0.14 0.00 0.00 0.00 0.00 23.12 19.11 3hb3 s ALA 209 CO 0.44 -0.71 1.32 -0.35 0.00 0.00 0.00 175.76 176.45 3hb3 n PRO 210 N 0.83 1.71 -0.00 0.00 -0.04 -1.26 -1.80 135.00 134.44 3hb3 n PRO 210 Ca 0.00 0.61 0.00 0.00 -0.04 0.00 0.00 63.50 64.07 3hb3 n PRO 210 Cb 0.41 -2.21 0.00 0.00 -0.04 0.00 0.00 33.50 31.67 3hb3 n PRO 210 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3hb3 n GLY 211 N 2.12 0.14 3.20 0.55 0.00 -1.26 -5.01 105.19 104.93 3hb3 n GLY 211 Ca 0.13 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.75 3hb3 n GLY 211 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 3hb3 s MET 212 N -0.98 3.35 0.67 1.61 0.00 -0.74 -4.98 119.30 118.22 3hb3 s MET 212 Ca 0.00 -2.91 -0.14 0.00 0.00 0.00 0.00 55.69 52.64 3hb3 s MET 212 Cb 0.00 -4.12 0.00 0.00 0.00 0.00 0.00 34.83 30.71 3hb3 s MET 212 CO 0.00 -1.24 1.09 0.95 0.00 0.00 0.00 175.02 175.82 3hb3 s THR 213 N -0.68 3.41 0.41 10.11 -4.23 -1.26 -4.83 115.64 118.56 3hb3 s THR 213 Ca 0.23 0.61 0.26 0.00 -1.18 0.00 0.00 61.69 61.62 3hb3 s THR 213 Cb -0.12 -3.14 0.43 0.00 1.34 0.00 0.00 72.50 71.01 3hb3 s THR 213 CO -0.09 -0.45 1.60 -0.07 -0.54 0.00 0.00 174.62 175.08 3hb3 h LEU 214 N -0.11 0.29 -1.51 4.79 4.07 -1.98 0.25 115.31 121.10 3hb3 h LEU 214 Ca -0.46 0.19 0.00 0.00 0.08 0.00 0.00 57.88 57.69 3hb3 h LEU 214 Cb 1.24 0.18 0.00 0.00 1.08 0.00 0.00 40.66 43.16 3hb3 h LEU 214 CO 0.54 -0.28 0.00 0.49 -1.08 0.00 0.00 178.44 178.12 3hb3 n PHE 215 N -4.92 0.45 0.46 1.13 3.72 -1.26 -3.05 117.46 113.99 3hb3 n PHE 215 Ca 0.38 -0.23 0.05 0.00 -0.05 0.00 0.00 57.45 57.60 3hb3 n PHE 215 Cb 1.37 0.00 -0.01 0.00 -0.94 0.00 0.00 39.48 39.91 3hb3 n PHE 215 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 176.76 178.34 3hb3 n LYS 216 N 0.70 2.26 -1.91 -1.08 5.02 0.84 -5.02 118.16 118.96 3hb3 n LYS 216 Ca 0.16 -0.54 -0.42 0.00 -2.02 0.00 0.00 58.31 55.48 3hb3 n LYS 216 Cb 0.38 -1.08 -0.03 0.00 -0.02 0.00 0.00 35.03 34.28 3hb3 n LYS 216 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 3hb3 s VAL 217 N -1.46 2.59 0.50 -0.18 1.01 -0.89 -4.90 120.40 117.06 3hb3 s VAL 217 Ca 0.08 0.40 -0.23 0.00 0.00 0.00 0.00 61.98 62.22 3hb3 s VAL 217 Cb 0.08 -3.26 -0.06 0.00 0.00 0.00 0.00 36.38 33.14 3hb3 s VAL 217 CO 0.28 0.03 1.39 -2.84 0.00 0.00 0.00 175.10 173.96 3hb3 s PRO 218 N 1.27 3.41 0.29 2.72 0.02 -1.26 -4.85 135.00 136.61 3hb3 s PRO 218 Ca 0.71 2.31 0.01 0.00 0.02 0.00 0.00 61.00 64.05 3hb3 s PRO 218 Cb -0.44 -2.45 0.70 0.00 0.02 0.00 0.00 34.50 32.33 3hb3 s PRO 218 CO 0.31 -1.00 1.61 -0.07 -0.33 0.00 0.00 177.00 177.53 3hb3 h LEU 219 N 1.89 -0.23 -0.21 -5.54 3.38 -1.93 -1.62 115.31 111.04 3hb3 h LEU 219 Ca -0.51 0.23 -0.01 0.00 0.09 0.00 0.00 57.88 57.69 3hb3 h LEU 219 Cb 1.28 0.36 -0.01 0.00 0.09 0.00 0.00 40.66 42.39 3hb3 h LEU 219 CO 0.59 -0.25 0.11 0.15 0.09 0.00 0.00 178.44 179.14 3hb3 h PHE 220 N 0.11 0.30 -0.90 1.13 3.57 -1.91 0.63 116.94 119.86 3hb3 h PHE 220 Ca 0.56 -0.01 0.17 0.00 3.53 0.00 0.00 57.97 62.22 3hb3 h PHE 220 Cb 1.13 -0.09 -0.07 0.00 2.79 0.00 0.00 35.95 39.71 3hb3 h PHE 220 CO -0.37 0.28 0.58 0.00 -2.23 0.00 0.00 178.31 176.57 3hb3 h ALA 221 N 0.99 1.98 0.15 2.41 0.00 -1.68 -2.17 119.26 120.95 3hb3 h ALA 221 Ca 0.07 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 3hb3 h ALA 221 Cb 0.08 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.80 3hb3 h ALA 221 CO -0.01 -0.25 -0.07 -1.49 0.00 0.00 0.00 179.25 177.43 3hb3 h TRP 222 N 0.57 -0.19 -1.05 0.00 4.06 0.02 -2.45 115.95 116.91 3hb3 h TRP 222 Ca 0.47 -0.00 0.27 0.00 2.06 0.00 0.00 58.89 61.69 3hb3 h TRP 222 Cb 0.93 0.06 -0.09 0.00 -1.00 0.00 0.00 29.16 29.05 3hb3 h TRP 222 CO -0.00 0.25 0.68 0.66 -3.56 0.00 0.00 178.44 176.47 3hb3 h SER 223 N -0.75 0.43 0.77 -3.49 4.64 0.74 0.23 113.55 116.13 3hb3 h SER 223 Ca -0.02 0.08 -0.14 0.00 -0.47 0.00 0.00 61.79 61.24 3hb3 h SER 223 Cb 0.52 0.02 -0.02 0.00 -0.31 0.00 0.00 62.40 62.61 3hb3 h SER 223 CO 0.03 0.07 -1.32 0.58 -0.87 0.00 0.00 176.83 175.33 3hb3 h VAL 224 N 0.37 0.43 0.10 0.95 2.07 -1.51 -1.81 116.25 116.85 3hb3 h VAL 224 Ca 0.60 -1.85 -0.29 0.00 0.82 0.00 0.00 66.70 65.99 3hb3 h VAL 224 Cb 1.56 1.96 -0.01 0.00 -1.52 0.00 0.00 31.29 33.28 3hb3 h VAL 224 CO -0.30 0.24 -1.45 0.15 0.02 0.00 0.00 177.57 176.24 3hb3 h PHE 225 N 0.00 0.37 -0.15 1.57 3.57 -0.11 -2.34 116.94 119.84 3hb3 h PHE 225 Ca -0.13 -0.27 -0.07 0.00 3.53 0.00 0.00 57.97 61.02 3hb3 h PHE 225 Cb 1.49 -0.01 -0.00 0.00 2.79 0.00 0.00 35.95 40.21 3hb3 h PHE 225 CO 0.00 1.29 -0.19 0.82 -2.23 0.00 0.00 178.31 178.00 3hb3 h ILE 226 N 0.06 1.35 -1.00 1.41 2.04 -1.10 -2.92 117.51 117.34 3hb3 h ILE 226 Ca -0.20 -1.39 0.22 0.00 1.00 0.00 0.00 64.86 64.49 3hb3 h ILE 226 Cb 1.98 1.90 -0.12 0.00 -0.74 0.00 0.00 36.82 39.85 3hb3 h ILE 226 CO 0.16 0.41 0.60 0.74 0.00 0.00 0.00 178.15 180.06 3hb3 h THR 227 N 0.02 0.61 -0.03 -0.27 2.02 -1.34 0.92 112.91 114.85 3hb3 h THR 227 Ca 0.02 -0.23 -0.10 0.00 0.77 0.00 0.00 66.41 66.87 3hb3 h THR 227 Cb 0.74 -0.11 -0.01 0.00 -1.74 0.00 0.00 68.15 67.03 3hb3 h THR 227 CO 0.05 0.12 -0.46 0.00 0.37 0.00 0.00 175.52 175.60 3hb3 h ALA 228 N 1.69 1.19 -0.28 6.16 0.00 -1.24 -0.68 119.26 126.10 3hb3 h ALA 228 Ca 0.62 -0.43 -0.13 0.00 0.00 0.00 0.00 54.91 54.97 3hb3 h ALA 228 Cb 1.08 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.79 3hb3 h ALA 228 CO -0.44 0.59 -0.33 -1.49 0.00 0.00 0.00 179.25 177.58 3hb3 h TRP 229 N 0.05 0.87 -0.91 0.00 4.06 -0.72 -1.95 115.95 117.36 3hb3 h TRP 229 Ca 0.00 -0.28 0.09 0.00 2.06 0.00 0.00 58.89 60.76 3hb3 h TRP 229 Cb 0.83 -0.18 -0.07 0.00 -1.00 0.00 0.00 29.16 28.74 3hb3 h TRP 229 CO 0.00 1.04 0.56 -0.07 -3.56 0.00 0.00 178.44 176.41 3hb3 h LEU 230 N 0.46 0.85 -0.02 -4.49 3.38 -0.44 -2.46 115.31 112.58 3hb3 h LEU 230 Ca 0.04 0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.04 3hb3 h LEU 230 Cb 0.92 -0.14 -0.00 0.00 0.09 0.00 0.00 40.66 41.52 3hb3 h LEU 230 CO 0.08 0.50 0.01 0.40 0.09 0.00 0.00 178.44 179.52 3hb3 h ILE 231 N 0.96 1.01 0.00 1.22 2.04 -0.91 -1.55 117.51 120.28 3hb3 h ILE 231 Ca 0.43 -0.02 -0.01 0.00 1.00 0.00 0.00 64.86 66.26 3hb3 h ILE 231 Cb 0.31 0.99 -0.00 0.00 -0.74 0.00 0.00 36.82 37.38 3hb3 h ILE 231 CO -0.22 0.01 -0.03 -0.07 0.00 0.00 0.00 178.15 177.84 3hb3 h LEU 232 N 0.02 0.00 0.13 1.44 3.38 -0.89 -1.71 115.31 117.68 3hb3 h LEU 232 Ca 0.01 0.00 -0.34 0.00 0.09 0.00 0.00 57.88 57.64 3hb3 h LEU 232 Cb 0.00 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.74 3hb3 h LEU 232 CO -0.00 0.03 -1.80 0.25 0.09 0.00 0.00 178.44 177.01 3hb3 h LEU 233 N 0.00 0.42 0.06 1.67 6.46 -1.31 -3.41 115.31 119.21 3hb3 h LEU 233 Ca -0.00 -0.90 -0.34 0.00 -0.12 0.00 0.00 57.88 56.52 3hb3 h LEU 233 Cb 0.06 -0.14 -0.04 0.00 -0.73 0.00 0.00 40.66 39.81 3hb3 h LEU 233 CO 0.00 1.78 -1.93 -1.54 -0.62 0.00 0.00 178.44 176.13 3hb3 n SER 234 N -3.66 1.52 -0.08 1.25 3.41 -0.60 -4.37 113.62 111.10 3hb3 n SER 234 Ca -0.29 0.26 -0.07 0.00 -0.26 0.00 0.00 58.87 58.51 3hb3 n SER 234 Cb 1.00 -0.43 0.11 0.00 -0.26 0.00 0.00 64.21 64.63 3hb3 n SER 234 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 3hb3 h LEU 235 N 0.04 0.75 -2.26 1.04 -0.00 -1.53 -1.72 115.31 111.61 3hb3 h LEU 235 Ca -0.39 -0.25 0.03 0.00 -0.00 0.00 0.00 57.88 57.27 3hb3 h LEU 235 Cb 2.03 -0.20 -0.00 0.00 -0.00 0.00 0.00 40.66 42.48 3hb3 h LEU 235 CO 0.07 0.93 0.10 -0.65 -0.00 0.00 0.00 178.44 178.89 3hb3 h PRO 236 N 0.66 0.00 -0.03 1.13 0.11 -1.79 -0.50 132.00 131.58 3hb3 h PRO 236 Ca 0.10 0.00 -0.10 0.00 0.11 0.00 0.00 66.00 66.11 3hb3 h PRO 236 Cb 0.69 0.00 0.01 0.00 0.11 0.00 0.00 31.00 31.80 3hb3 h PRO 236 CO 0.05 0.00 -0.37 0.28 -0.21 0.00 0.00 178.00 177.76 3hb3 h VAL 237 N 0.00 1.47 -0.96 3.15 2.07 -1.53 -2.16 116.25 118.29 3hb3 h VAL 237 Ca 0.05 -1.89 0.15 0.00 0.82 0.00 0.00 66.70 65.82 3hb3 h VAL 237 Cb 0.24 2.56 -0.08 0.00 -1.52 0.00 0.00 31.29 32.49 3hb3 h VAL 237 CO -0.00 0.54 0.61 0.25 0.02 0.00 0.00 177.57 178.98 3hb3 h LEU 238 N -0.27 0.77 -0.88 2.57 5.85 -1.03 -0.23 115.31 122.09 3hb3 h LEU 238 Ca -0.04 0.05 -0.02 0.00 0.84 0.00 0.00 57.88 58.72 3hb3 h LEU 238 Cb 1.07 -0.10 -0.04 0.00 0.37 0.00 0.00 40.66 41.96 3hb3 h LEU 238 CO 0.07 0.37 0.48 0.00 -0.34 0.00 0.00 178.44 179.02 3hb3 h ALA 239 N 1.59 1.13 0.69 1.25 0.00 -0.87 -1.08 119.26 121.97 3hb3 h ALA 239 Ca 0.50 -0.13 -0.03 0.00 0.00 0.00 0.00 54.91 55.24 3hb3 h ALA 239 Cb 0.70 -0.35 0.01 0.00 0.00 0.00 0.00 17.79 18.14 3hb3 h ALA 239 CO -0.26 0.64 -0.33 0.78 0.00 0.00 0.00 179.25 180.07 3hb3 h GLY 240 N 1.23 -0.97 -0.88 0.00 0.00 -0.41 -1.68 103.07 100.36 3hb3 h GLY 240 Ca 0.31 0.36 0.18 0.00 0.00 0.00 0.00 47.33 48.18 3hb3 h GLY 240 CO -0.05 -0.35 -0.27 0.00 0.00 0.00 0.00 176.54 175.87 3hb3 h ALA 241 N -1.48 0.51 0.00 3.60 0.00 -1.20 0.95 119.26 121.64 3hb3 h ALA 241 Ca -0.10 0.34 -0.02 0.00 0.00 0.00 0.00 54.91 55.13 3hb3 h ALA 241 Cb 0.71 0.77 -0.00 0.00 0.00 0.00 0.00 17.79 19.27 3hb3 h ALA 241 CO 0.16 -0.44 -0.41 -0.84 0.00 0.00 0.00 179.25 177.72 3hb3 h ILE 242 N -0.01 0.15 0.00 0.00 3.07 -1.19 -2.51 117.51 117.03 3hb3 h ILE 242 Ca 0.42 -1.23 -0.02 0.00 1.55 0.00 0.00 64.86 65.58 3hb3 h ILE 242 Cb 0.67 1.94 -0.00 0.00 -0.27 0.00 0.00 36.82 39.15 3hb3 h ILE 242 CO -0.96 0.09 -0.31 0.71 -1.05 0.00 0.00 178.15 176.62 3hb3 h THR 243 N 0.00 0.14 -0.61 0.16 1.35 0.07 -2.19 112.91 111.83 3hb3 h THR 243 Ca -0.01 -1.21 -0.02 0.00 -0.55 0.00 0.00 66.41 64.62 3hb3 h THR 243 Cb 1.09 1.97 -0.03 0.00 -1.73 0.00 0.00 68.15 69.44 3hb3 h THR 243 CO 0.01 0.08 0.30 0.24 -0.25 0.00 0.00 175.52 175.90 3hb3 h MET 244 N 0.00 0.86 -0.24 4.72 2.86 -0.83 -1.33 114.93 120.97 3hb3 h MET 244 Ca -0.01 -0.11 -0.12 0.00 -2.06 0.00 0.00 59.70 57.40 3hb3 h MET 244 Cb 1.08 -0.17 -0.01 0.00 0.06 0.00 0.00 31.60 32.56 3hb3 h MET 244 CO 0.01 0.67 -0.36 -0.07 1.06 0.00 0.00 176.91 178.22 3hb3 h LEU 245 N 0.86 0.56 -0.66 1.22 3.38 -1.10 -1.93 115.31 117.63 3hb3 h LEU 245 Ca 0.21 -0.23 -0.13 0.00 0.09 0.00 0.00 57.88 57.82 3hb3 h LEU 245 Cb 0.09 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 40.66 3hb3 h LEU 245 CO -0.03 0.87 -0.62 0.25 0.09 0.00 0.00 178.44 179.01 3hb3 h LEU 246 N 0.45 0.00 0.11 1.67 5.85 -1.05 -1.99 115.31 120.35 3hb3 h LEU 246 Ca 0.05 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.76 3hb3 h LEU 246 Cb 0.84 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.87 3hb3 h LEU 246 CO 0.07 0.62 -0.05 0.24 -0.34 0.00 0.00 178.44 178.98 3hb3 h MET 247 N 0.00 -0.14 -0.93 1.25 2.86 -1.07 -2.77 114.93 114.13 3hb3 h MET 247 Ca -0.01 0.01 0.34 0.00 -2.06 0.00 0.00 59.70 57.98 3hb3 h MET 247 Cb 1.16 0.03 -0.11 0.00 0.06 0.00 0.00 31.60 32.74 3hb3 h MET 247 CO 0.08 0.13 0.57 -0.25 1.06 0.00 0.00 176.91 178.50 3hb3 n ASP 248 N -4.85 0.19 0.08 1.22 9.92 -0.74 0.18 116.55 122.54 3hb3 n ASP 248 Ca -0.04 1.08 0.06 0.00 -0.53 0.00 0.00 54.79 55.36 3hb3 n ASP 248 Cb 0.17 -0.53 -0.03 0.00 -0.64 0.00 0.00 41.12 40.09 3hb3 n ASP 248 CO 0.00 0.00 0.00 0.03 0.13 0.00 0.00 177.20 177.36 3hb3 h ARG 249 N 0.00 0.00 0.00 -1.24 3.08 -1.36 -3.42 114.38 111.45 3hb3 h ARG 249 Ca 0.64 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.69 3hb3 h ARG 249 Cb 1.95 0.00 0.00 0.00 0.08 0.00 0.00 29.97 32.00 3hb3 h ARG 249 CO -0.41 0.15 0.00 0.09 -1.07 0.00 0.00 179.97 178.73 3hb3 n ASN 250 N -2.82 0.00 -0.15 7.04 3.02 -0.17 -4.88 115.26 117.31 3hb3 n ASN 250 Ca -0.04 0.00 0.02 0.00 -0.03 0.00 0.00 54.58 54.53 3hb3 n ASN 250 Cb 0.68 0.00 0.03 0.00 -0.61 0.00 0.00 39.78 39.88 3hb3 n ASN 250 CO 0.00 0.00 0.00 0.49 -2.62 0.00 0.00 177.26 175.13 3hb3 n PHE 251 N -0.09 0.06 -0.02 3.10 3.72 0.13 -5.01 117.46 119.35 3hb3 n PHE 251 Ca 0.00 -0.24 0.00 0.00 -0.05 0.00 0.00 57.45 57.16 3hb3 n PHE 251 Cb 0.00 -0.02 0.00 0.00 -0.94 0.00 0.00 39.48 38.52 3hb3 n PHE 251 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3hb3 n GLY 252 N -0.01 0.83 3.65 1.37 0.00 -1.02 -4.95 105.19 105.05 3hb3 n GLY 252 Ca 0.02 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.75 3hb3 n GLY 252 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3hb3 s THR 253 N -2.30 2.37 -0.42 2.61 -4.23 -1.25 -4.94 115.64 107.47 3hb3 s THR 253 Ca 0.00 0.12 0.10 0.00 -1.18 0.00 0.00 61.69 60.73 3hb3 s THR 253 Cb 0.00 -2.39 0.37 0.00 1.34 0.00 0.00 72.50 71.82 3hb3 s THR 253 CO 0.00 -0.16 0.84 0.00 -0.54 0.00 0.00 174.62 174.76 3hb3 n GLN 254 N -4.23 1.75 -0.25 3.99 6.02 -1.26 -4.15 117.38 119.24 3hb3 n GLN 254 Ca 0.07 -3.83 0.05 0.00 -0.01 0.00 0.00 57.00 53.28 3hb3 n GLN 254 Cb 0.54 -1.83 0.29 0.00 1.02 0.00 0.00 30.24 30.27 3hb3 n GLN 254 CO 0.00 0.00 0.00 0.74 -1.01 0.00 0.00 177.06 176.79 3hb3 h PHE 255 N 2.97 0.92 0.00 1.08 0.04 -1.94 -3.05 116.94 116.96 3hb3 h PHE 255 Ca 0.10 0.02 -0.00 0.00 2.80 0.00 0.00 57.97 60.89 3hb3 h PHE 255 Cb 0.87 -0.30 -0.01 0.00 2.20 0.00 0.00 35.95 38.71 3hb3 h PHE 255 CO 0.59 0.47 -0.15 1.19 -0.60 0.00 0.00 178.31 179.81 3hb3 n PHE 256 N -4.49 0.00 -3.63 -0.55 3.72 -1.26 -2.70 117.46 108.55 3hb3 n PHE 256 Ca 0.13 -0.92 -0.40 0.00 -0.05 0.00 0.00 57.45 56.21 3hb3 n PHE 256 Cb 0.23 -0.15 -0.11 0.00 -0.94 0.00 0.00 39.48 38.51 3hb3 n PHE 256 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 176.76 177.05 3hb3 s ASP 257 N -2.66 5.62 0.25 4.37 3.68 -1.15 -3.41 116.67 123.37 3hb3 s ASP 257 Ca 0.29 -1.24 -0.05 0.00 2.13 0.00 0.00 52.55 53.67 3hb3 s ASP 257 Cb 0.26 -1.98 0.30 0.00 -1.45 0.00 0.00 42.92 40.05 3hb3 s ASP 257 CO 0.01 -0.44 1.91 1.55 0.13 0.00 0.00 175.17 178.32 3hb3 h PRO 258 N 8.38 1.22 0.00 4.34 0.13 -1.83 -0.94 132.00 143.31 3hb3 h PRO 258 Ca -0.24 -0.07 0.00 0.00 -0.87 0.00 0.00 66.00 64.82 3hb3 h PRO 258 Cb 1.09 -0.28 0.00 0.00 0.13 0.00 0.00 31.00 31.94 3hb3 h PRO 258 CO 0.69 0.81 0.52 0.00 -0.23 0.00 0.00 178.00 179.79 3hb3 h ALA 259 N 1.39 1.44 0.00 -0.56 0.00 -1.93 0.40 119.26 120.01 3hb3 h ALA 259 Ca 0.38 0.00 -0.04 0.00 0.00 0.00 0.00 54.91 55.26 3hb3 h ALA 259 Cb -0.03 0.00 -0.08 0.00 0.00 0.00 0.00 17.79 17.68 3hb3 h ALA 259 CO -0.11 -0.44 -0.47 0.41 0.00 0.00 0.00 179.25 178.64 3hb3 n GLY 260 N -1.30 3.62 1.41 0.00 0.00 -0.77 -5.00 105.19 103.14 3hb3 n GLY 260 Ca -0.01 -0.99 0.00 0.00 0.00 0.00 0.00 46.02 45.02 3hb3 n GLY 260 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hb3 n GLY 261 N -0.74 1.04 0.00 -0.02 0.00 0.14 -4.89 105.19 100.72 3hb3 n GLY 261 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.15 3hb3 n GLY 261 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hb3 n GLY 262 N -2.00 2.02 2.91 -0.02 0.00 -0.43 -4.92 105.19 102.75 3hb3 n GLY 262 Ca 0.00 -2.11 -0.15 0.00 0.00 0.00 0.00 46.02 43.76 3hb3 n GLY 262 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3hb3 s ASP 263 N -0.98 0.67 0.67 1.61 -1.08 -1.10 -2.77 116.67 113.69 3hb3 s ASP 263 Ca 0.00 0.34 0.40 0.00 -0.52 0.00 0.00 52.55 52.77 3hb3 s ASP 263 Cb 0.00 0.55 2.16 0.00 -1.46 0.00 0.00 42.92 44.18 3hb3 s ASP 263 CO 0.00 -0.26 2.22 -0.65 0.52 0.00 0.00 175.17 177.00 3hb3 h PRO 264 N 8.31 0.00 0.00 4.34 0.11 -1.86 -2.63 132.00 140.27 3hb3 h PRO 264 Ca -0.15 0.00 -0.05 0.00 0.11 0.00 0.00 66.00 65.91 3hb3 h PRO 264 Cb 1.12 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.23 3hb3 h PRO 264 CO 0.17 0.00 -0.97 0.28 -0.21 0.00 0.00 178.00 177.27 3hb3 h VAL 265 N 0.00 0.19 -0.81 3.15 2.07 -1.92 -3.20 116.25 115.73 3hb3 h VAL 265 Ca 0.00 -1.35 0.09 0.00 0.82 0.00 0.00 66.70 66.26 3hb3 h VAL 265 Cb 0.23 1.76 -0.07 0.00 -1.52 0.00 0.00 31.29 31.69 3hb3 h VAL 265 CO -0.00 0.11 0.47 0.25 0.02 0.00 0.00 177.57 178.42 3hb3 h LEU 266 N 0.00 0.69 -0.34 2.57 5.85 -1.84 -2.51 115.31 119.74 3hb3 h LEU 266 Ca -0.04 0.04 0.04 0.00 0.84 0.00 0.00 57.88 58.75 3hb3 h LEU 266 Cb 1.19 -0.09 -0.04 0.00 0.37 0.00 0.00 40.66 42.09 3hb3 h LEU 266 CO 0.02 0.40 0.12 0.22 -0.34 0.00 0.00 178.44 178.86 3hb3 h TYR 267 N 0.81 0.21 -0.32 1.25 3.20 -1.68 -1.85 116.97 118.59 3hb3 h TYR 267 Ca 0.38 0.02 0.02 0.00 3.14 0.00 0.00 58.73 62.29 3hb3 h TYR 267 Cb 0.32 -0.04 -0.02 0.00 1.54 0.00 0.00 36.73 38.52 3hb3 h TYR 267 CO -0.06 0.09 0.21 1.96 -1.64 0.00 0.00 178.16 178.72 3hb3 h GLN 268 N 0.26 0.34 0.12 1.82 4.20 -1.55 0.57 115.11 120.87 3hb3 h GLN 268 Ca 0.15 -0.02 -0.01 0.00 0.06 0.00 0.00 58.65 58.84 3hb3 h GLN 268 Cb 0.12 -0.08 0.00 0.00 0.30 0.00 0.00 27.48 27.83 3hb3 h GLN 268 CO -0.16 0.22 -0.06 0.45 -0.67 0.00 0.00 178.83 178.62 3hb3 h HIS 269 N 0.35 -0.15 -0.55 2.96 3.86 -1.06 0.22 115.15 120.78 3hb3 h HIS 269 Ca 0.13 -0.00 -0.00 0.00 -1.16 0.00 0.00 60.37 59.33 3hb3 h HIS 269 Cb 0.07 0.05 -0.03 0.00 1.06 0.00 0.00 27.41 28.57 3hb3 h HIS 269 CO -0.00 0.19 0.33 0.82 0.86 0.00 0.00 177.93 180.13 3hb3 h ILE 270 N -0.50 1.17 -0.19 2.45 2.04 -1.07 0.19 117.51 121.60 3hb3 h ILE 270 Ca -0.02 -0.39 -0.00 0.00 1.00 0.00 0.00 64.86 65.45 3hb3 h ILE 270 Cb 0.40 0.43 -0.01 0.00 -0.74 0.00 0.00 36.82 36.91 3hb3 h ILE 270 CO 0.03 0.17 0.11 0.25 0.00 0.00 0.00 178.15 178.71 3hb3 h LEU 271 N 0.74 0.22 -0.18 1.44 5.85 0.23 -2.57 115.31 121.05 3hb3 h LEU 271 Ca 0.20 -0.06 -0.04 0.00 0.84 0.00 0.00 57.88 58.82 3hb3 h LEU 271 Cb -0.00 -0.06 -0.01 0.00 0.37 0.00 0.00 40.66 40.96 3hb3 h LEU 271 CO -0.04 0.21 -0.18 -0.50 -0.34 0.00 0.00 178.44 177.60 3hb3 h TRP 272 N 0.22 0.00 -0.75 1.25 -0.00 -0.23 -1.19 115.95 115.25 3hb3 h TRP 272 Ca 0.07 0.00 0.19 0.00 -0.00 0.00 0.00 58.89 59.14 3hb3 h TRP 272 Cb 0.03 0.00 -0.04 0.00 -0.00 0.00 0.00 29.16 29.15 3hb3 h TRP 272 CO -0.05 0.18 0.52 0.35 -0.00 0.00 0.00 178.44 179.44 3hb3 h PHE 273 N 0.00 0.23 0.12 0.49 3.04 -0.20 -0.56 116.94 120.06 3hb3 h PHE 273 Ca -0.00 0.01 -0.32 0.00 3.98 0.00 0.00 57.97 61.63 3hb3 h PHE 273 Cb 1.07 -0.07 -0.01 0.00 2.56 0.00 0.00 35.95 39.50 3hb3 h PHE 273 CO 0.00 0.07 -1.66 0.35 -2.02 0.00 0.00 178.31 175.05 3hb3 h PHE 274 N 0.19 0.48 0.00 0.41 3.57 -1.21 -3.41 116.94 116.96 3hb3 h PHE 274 Ca 0.37 -0.35 -0.02 0.00 3.53 0.00 0.00 57.97 61.50 3hb3 h PHE 274 Cb 1.17 -0.02 -0.00 0.00 2.79 0.00 0.00 35.95 39.89 3hb3 h PHE 274 CO -0.00 1.47 -0.56 0.78 -2.23 0.00 0.00 178.31 177.78 3hb3 h GLY 275 N 1.53 0.00 0.70 2.40 0.00 -0.19 -0.35 103.07 107.16 3hb3 h GLY 275 Ca -0.29 0.00 -0.03 0.00 0.00 0.00 0.00 47.33 47.00 3hb3 h GLY 275 CO 0.15 0.00 -0.33 0.84 0.00 0.00 0.00 176.54 177.19 3hb3 h HIS 276 N 0.00 -0.87 -0.81 5.60 -0.00 -1.58 -3.28 115.15 114.22 3hb3 h HIS 276 Ca -0.01 -0.02 0.19 0.00 -0.00 0.00 0.00 60.37 60.53 3hb3 h HIS 276 Cb 1.07 0.29 -0.14 0.00 -0.00 0.00 0.00 27.41 28.63 3hb3 h HIS 276 CO 0.00 -0.54 0.04 -1.35 -0.00 0.00 0.00 177.93 176.08 3hb3 h PRO 277 N -1.14 0.10 -0.84 5.26 0.11 -1.52 0.34 132.00 134.31 3hb3 h PRO 277 Ca -0.10 -0.01 0.17 0.00 0.11 0.00 0.00 66.00 66.18 3hb3 h PRO 277 Cb 0.72 -0.02 -0.16 0.00 0.11 0.00 0.00 31.00 31.64 3hb3 h PRO 277 CO 0.16 0.07 -0.20 -1.91 -0.21 0.00 0.00 178.00 175.91 3hb3 n GLU 278 N -5.35 -0.07 0.15 1.05 4.07 -0.15 0.17 120.64 120.51 3hb3 n GLU 278 Ca 0.16 1.30 0.13 0.00 -0.06 0.00 0.00 57.16 58.68 3hb3 n GLU 278 Cb 0.54 -1.95 0.31 0.00 -0.06 0.00 0.00 31.44 30.28 3hb3 n GLU 278 CO 0.00 0.00 0.00 -0.39 -0.06 0.00 0.00 177.13 176.68 3hb3 h VAL 279 N 0.00 0.00 0.18 6.31 -1.51 -0.38 -2.05 116.25 118.81 3hb3 h VAL 279 Ca 0.41 -0.69 -0.27 0.00 -1.23 0.00 0.00 66.70 64.93 3hb3 h VAL 279 Cb 0.63 1.68 0.03 0.00 -2.13 0.00 0.00 31.29 31.50 3hb3 h VAL 279 CO -0.86 0.00 -1.15 1.88 -1.23 0.00 0.00 177.57 176.21 3hb3 h TYR 280 N 0.00 0.81 -0.98 5.19 0.05 0.20 -2.98 116.97 119.26 3hb3 h TYR 280 Ca 0.00 -0.57 0.24 0.00 0.05 0.00 0.00 58.73 58.45 3hb3 h TYR 280 Cb 0.84 -0.04 -0.12 0.00 1.01 0.00 0.00 36.73 38.41 3hb3 h TYR 280 CO 0.00 1.44 0.55 0.82 -1.05 0.00 0.00 178.16 179.91 3hb3 h ILE 281 N -0.05 0.52 0.03 -2.88 2.04 -0.86 0.72 117.51 117.03 3hb3 h ILE 281 Ca -0.20 -0.18 -0.00 0.00 1.00 0.00 0.00 64.86 65.48 3hb3 h ILE 281 Cb 1.89 -0.06 0.00 0.00 -0.74 0.00 0.00 36.82 37.91 3hb3 h ILE 281 CO 0.22 0.10 -0.01 0.40 0.00 0.00 0.00 178.15 178.85 3hb3 h ILE 282 N 0.53 1.14 0.00 -0.67 2.04 -1.34 -3.34 117.51 115.88 3hb3 h ILE 282 Ca 0.63 -0.53 0.00 0.00 1.00 0.00 0.00 64.86 65.95 3hb3 h ILE 282 Cb 1.19 1.50 0.00 0.00 -0.74 0.00 0.00 36.82 38.78 3hb3 h ILE 282 CO -0.49 0.14 -0.66 -0.29 0.00 0.00 0.00 178.15 176.85 3hb3 h ILE 283 N -0.27 0.00 0.00 -0.67 6.09 -0.75 -3.38 117.51 118.54 3hb3 h ILE 283 Ca -0.00 -0.53 -0.00 0.00 -1.37 0.00 0.00 64.86 62.96 3hb3 h ILE 283 Cb 0.25 1.09 0.00 0.00 0.47 0.00 0.00 36.82 38.63 3hb3 h ILE 283 CO 0.01 0.00 -0.00 -0.07 -3.07 0.00 0.00 178.15 175.01 3hb3 h LEU 284 N 0.00 -0.00 -2.03 2.19 3.38 -1.40 0.76 115.31 118.21 3hb3 h LEU 284 Ca 0.00 -0.83 0.09 0.00 0.09 0.00 0.00 57.88 57.23 3hb3 h LEU 284 Cb 0.76 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.50 3hb3 h LEU 284 CO 0.00 0.84 0.22 -0.65 0.09 0.00 0.00 178.44 178.94 3hb3 h PRO 285 N -0.85 0.00 -0.23 1.13 0.11 -1.76 0.21 132.00 130.61 3hb3 h PRO 285 Ca -0.00 0.00 -0.13 0.00 0.11 0.00 0.00 66.00 65.98 3hb3 h PRO 285 Cb 0.83 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.94 3hb3 h PRO 285 CO 0.00 0.00 -0.35 0.78 -0.21 0.00 0.00 178.00 178.22 3hb3 h GLY 286 N 0.00 0.71 -0.01 -0.55 0.00 -1.56 -2.52 103.07 99.15 3hb3 h GLY 286 Ca 0.14 -0.80 0.08 0.00 0.00 0.00 0.00 47.33 46.76 3hb3 h GLY 286 CO -0.00 0.72 -0.21 0.74 0.00 0.00 0.00 176.54 177.78 3hb3 h PHE 287 N 0.36 -0.55 -0.94 5.60 0.04 0.17 -1.39 116.94 120.22 3hb3 h PHE 287 Ca 0.02 0.05 0.22 0.00 2.80 0.00 0.00 57.97 61.06 3hb3 h PHE 287 Cb 0.94 0.30 -0.12 0.00 2.20 0.00 0.00 35.95 39.28 3hb3 h PHE 287 CO 0.08 -0.29 0.50 0.78 -0.60 0.00 0.00 178.31 178.78 3hb3 h GLY 288 N -0.14 1.70 1.75 -1.45 0.00 -0.79 -2.16 103.07 101.97 3hb3 h GLY 288 Ca 0.19 -0.25 -0.24 0.00 0.00 0.00 0.00 47.33 47.03 3hb3 h GLY 288 CO -0.49 -0.22 -1.17 -2.22 0.00 0.00 0.00 176.54 172.44 3hb3 h ILE 289 N 0.53 1.54 -0.38 2.60 2.04 -0.93 -3.09 117.51 119.83 3hb3 h ILE 289 Ca 0.59 -3.21 -0.10 0.00 1.00 0.00 0.00 64.86 63.13 3hb3 h ILE 289 Cb 1.07 2.84 -0.02 0.00 -0.74 0.00 0.00 36.82 39.97 3hb3 h ILE 289 CO -0.48 0.90 -0.18 0.40 0.00 0.00 0.00 178.15 178.80 3hb3 h ILE 290 N 0.03 1.26 0.76 -0.67 1.08 -0.65 -1.38 117.51 117.95 3hb3 h ILE 290 Ca -0.09 -1.23 -0.03 0.00 -0.39 0.00 0.00 64.86 63.11 3hb3 h ILE 290 Cb 1.87 1.16 -0.00 0.00 -3.07 0.00 0.00 36.82 36.78 3hb3 h ILE 290 CO 0.15 0.41 -0.44 0.28 -0.69 0.00 0.00 178.15 177.86 3hb3 h SER 291 N 0.63 -1.09 -0.80 1.72 0.02 -1.39 -0.29 113.55 112.35 3hb3 h SER 291 Ca 0.10 0.06 0.19 0.00 -0.84 0.00 0.00 61.79 61.29 3hb3 h SER 291 Cb 0.65 0.31 -0.12 0.00 0.14 0.00 0.00 62.40 63.37 3hb3 h SER 291 CO 0.05 -0.70 0.20 0.45 -1.14 0.00 0.00 176.83 175.69 3hb3 h HIS 292 N -1.12 0.30 -0.10 3.45 3.86 -1.53 -1.07 115.15 118.94 3hb3 h HIS 292 Ca -0.10 0.05 -0.19 0.00 -1.16 0.00 0.00 60.37 58.97 3hb3 h HIS 292 Cb 0.89 -0.01 -0.00 0.00 1.06 0.00 0.00 27.41 29.35 3hb3 h HIS 292 CO -0.08 -0.13 -0.72 0.28 0.86 0.00 0.00 177.93 178.13 3hb3 h VAL 293 N 0.25 1.35 -0.15 2.45 2.07 -0.99 -2.26 116.25 118.98 3hb3 h VAL 293 Ca 0.47 -2.08 -0.10 0.00 0.82 0.00 0.00 66.70 65.81 3hb3 h VAL 293 Cb 0.86 2.05 0.00 0.00 -1.52 0.00 0.00 31.29 32.69 3hb3 h VAL 293 CO -0.57 0.63 -0.31 0.40 0.02 0.00 0.00 177.57 177.74 3hb3 h ILE 294 N 0.34 1.36 -0.22 4.57 2.04 -0.66 -2.63 117.51 122.31 3hb3 h ILE 294 Ca -0.03 -1.57 0.06 0.00 1.00 0.00 0.00 64.86 64.31 3hb3 h ILE 294 Cb 1.31 2.00 -0.07 0.00 -0.74 0.00 0.00 36.82 39.32 3hb3 h ILE 294 CO 0.13 0.47 -0.21 -1.28 0.00 0.00 0.00 178.15 177.26 3hb3 h SER 295 N 0.09 -0.68 -0.76 1.72 0.87 -1.16 -0.76 113.55 112.87 3hb3 h SER 295 Ca 0.00 0.13 0.06 0.00 -1.23 0.00 0.00 61.79 60.75 3hb3 h SER 295 Cb 0.91 0.33 -0.06 0.00 -0.44 0.00 0.00 62.40 63.13 3hb3 h SER 295 CO 0.07 -0.25 0.45 0.74 -0.53 0.00 0.00 176.83 177.30 3hb3 h THR 296 N -0.22 1.00 -0.00 2.23 2.02 -1.37 0.82 112.91 117.38 3hb3 h THR 296 Ca 0.13 -0.28 0.00 0.00 0.77 0.00 0.00 66.41 67.03 3hb3 h THR 296 Cb 0.42 0.11 0.00 0.00 -1.74 0.00 0.00 68.15 66.94 3hb3 h THR 296 CO -0.36 0.15 -0.85 0.49 0.37 0.00 0.00 175.52 175.32 3hb3 n PHE 297 N -4.71 0.00 0.09 3.16 3.01 -1.00 -3.53 117.46 114.49 3hb3 n PHE 297 Ca 0.10 0.00 -0.19 0.00 1.01 0.00 0.00 57.45 58.37 3hb3 n PHE 297 Cb 0.18 -0.07 -0.15 0.00 -0.01 0.00 0.00 39.48 39.44 3hb3 n PHE 297 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 3hb3 h ALA 298 N 3.03 0.11 -2.79 4.37 0.00 -0.50 -2.99 119.26 120.50 3hb3 h ALA 298 Ca 0.00 -0.99 0.00 0.00 0.00 0.00 0.00 54.91 53.92 3hb3 h ALA 298 Cb 0.51 0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.49 3hb3 h ALA 298 CO 0.00 0.98 0.00 1.63 0.00 0.00 0.00 179.25 181.86 3hb3 n LYS 299 N -3.55 0.00 0.00 0.00 5.02 0.22 0.46 118.16 120.31 3hb3 n LYS 299 Ca -0.15 0.09 0.00 0.00 -2.02 0.00 0.00 58.31 56.23 3hb3 n LYS 299 Cb 1.06 -1.39 0.00 0.00 -0.02 0.00 0.00 35.03 34.67 3hb3 n LYS 299 CO 0.00 0.00 0.00 1.17 -0.52 0.00 0.00 177.40 178.05 3hb3 n LYS 300 N -1.31 0.00 -1.26 1.97 4.81 -1.23 -4.67 118.16 116.48 3hb3 n LYS 300 Ca 0.00 0.00 -0.30 0.00 -0.87 0.00 0.00 58.31 57.14 3hb3 n LYS 300 Cb 0.46 0.00 0.22 0.00 0.02 0.00 0.00 35.03 35.74 3hb3 n LYS 300 CO 0.00 0.00 0.00 -1.25 1.17 0.00 0.00 177.40 177.32 3hb3 s PRO 301 N 0.00 -0.70 -0.07 1.64 0.04 -1.26 -4.51 135.00 130.14 3hb3 s PRO 301 Ca 0.00 -0.08 -0.30 0.00 0.04 0.00 0.00 61.00 60.66 3hb3 s PRO 301 Cb 0.00 -1.66 -0.02 0.00 0.04 0.00 0.00 34.50 32.86 3hb3 s PRO 301 CO 0.00 -3.36 1.01 -1.50 0.04 0.00 0.00 177.00 173.19 3hb3 s ILE 302 N -3.18 4.77 0.14 0.56 1.10 -1.26 -4.76 121.20 118.57 3hb3 s ILE 302 Ca 0.71 2.02 -0.31 0.00 -0.51 0.00 0.00 60.65 62.56 3hb3 s ILE 302 Cb -0.09 -4.30 -0.09 0.00 0.15 0.00 0.00 42.46 38.13 3hb3 s ILE 302 CO 0.55 0.05 1.46 0.12 -2.11 0.00 0.00 174.94 175.02 3hb3 s PHE 303 N 1.70 3.17 -1.27 3.50 2.19 -1.26 -3.73 117.98 122.29 3hb3 s PHE 303 Ca 0.50 0.83 -0.14 0.00 0.33 0.00 0.00 56.93 58.45 3hb3 s PHE 303 Cb -0.20 -3.78 0.00 0.00 -1.31 0.00 0.00 43.02 37.74 3hb3 s PHE 303 CO 0.21 -2.79 0.61 0.41 1.83 0.00 0.00 175.22 175.49 3hb3 n GLY 304 N 3.57 -0.64 0.25 13.12 0.00 -1.26 -4.81 105.19 115.42 3hb3 n GLY 304 Ca 0.12 0.31 -0.01 0.00 0.00 0.00 0.00 46.02 46.44 3hb3 n GLY 304 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 3hb3 n TYR 305 N -4.39 -0.01 -0.05 1.61 4.19 -1.24 -1.45 117.16 115.82 3hb3 n TYR 305 Ca -0.19 0.78 -0.13 0.00 3.31 0.00 0.00 57.90 61.67 3hb3 n TYR 305 Cb 0.63 -0.72 -0.07 0.00 0.49 0.00 0.00 39.34 39.67 3hb3 n TYR 305 CO 0.00 0.00 0.00 1.25 0.91 0.00 0.00 176.86 179.02 3hb3 h LEU 306 N 0.00 0.37 -1.80 2.98 5.85 -1.95 0.26 115.31 121.02 3hb3 h LEU 306 Ca 0.21 -0.49 0.33 0.00 0.84 0.00 0.00 57.88 58.77 3hb3 h LEU 306 Cb 0.37 -0.10 -0.06 0.00 0.37 0.00 0.00 40.66 41.23 3hb3 h LEU 306 CO -0.63 0.79 0.81 -0.65 -0.34 0.00 0.00 178.44 178.42 3hb3 h PRO 307 N -0.04 0.10 -0.17 5.25 0.11 -1.89 -0.26 132.00 135.10 3hb3 h PRO 307 Ca 0.02 -0.01 -0.20 0.00 0.11 0.00 0.00 66.00 65.93 3hb3 h PRO 307 Cb 0.69 -0.02 0.01 0.00 0.11 0.00 0.00 31.00 31.78 3hb3 h PRO 307 CO 0.04 0.07 -0.66 0.52 -0.21 0.00 0.00 178.00 177.76 3hb3 h MET 308 N 0.11 0.75 -0.43 1.05 2.86 0.65 0.98 114.93 120.90 3hb3 h MET 308 Ca 0.59 -0.57 -0.09 0.00 -2.06 0.00 0.00 59.70 57.56 3hb3 h MET 308 Cb 2.10 0.11 -0.01 0.00 0.06 0.00 0.00 31.60 33.86 3hb3 h MET 308 CO -0.10 1.19 -0.09 0.28 1.06 0.00 0.00 176.91 179.24 3hb3 h VAL 309 N 0.46 1.27 -0.15 -2.22 2.07 -0.44 -2.78 116.25 114.46 3hb3 h VAL 309 Ca -0.03 -1.19 -0.22 0.00 0.82 0.00 0.00 66.70 66.07 3hb3 h VAL 309 Cb 1.28 1.17 0.01 0.00 -1.52 0.00 0.00 31.29 32.23 3hb3 h VAL 309 CO 0.14 0.40 -0.78 -0.07 0.02 0.00 0.00 177.57 177.28 3hb3 h LEU 310 N 0.64 0.94 -1.29 2.57 3.38 -0.96 -2.17 115.31 118.42 3hb3 h LEU 310 Ca 0.11 -0.62 0.14 0.00 0.09 0.00 0.00 57.88 57.60 3hb3 h LEU 310 Cb 0.62 -0.28 -0.07 0.00 0.09 0.00 0.00 40.66 41.03 3hb3 h LEU 310 CO 0.04 1.42 0.57 0.00 0.09 0.00 0.00 178.44 180.56 3hb3 h ALA 311 N 0.56 1.82 -0.18 1.53 0.00 -0.77 -0.98 119.26 121.24 3hb3 h ALA 311 Ca -0.05 0.01 -0.07 0.00 0.00 0.00 0.00 54.91 54.80 3hb3 h ALA 311 Cb 1.41 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 19.07 3hb3 h ALA 311 CO 0.16 -0.05 -0.15 0.52 0.00 0.00 0.00 179.25 179.73 3hb3 h MET 312 N 0.70 0.42 -0.68 0.00 2.86 -1.13 -0.75 114.93 116.34 3hb3 h MET 312 Ca 0.44 -0.21 -0.00 0.00 -2.06 0.00 0.00 59.70 57.86 3hb3 h MET 312 Cb 0.68 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 32.31 3hb3 h MET 312 CO -0.20 0.77 0.41 0.00 1.06 0.00 0.00 176.91 178.95 3hb3 h ALA 313 N 0.64 1.45 0.10 6.32 0.00 -1.00 -0.54 119.26 126.24 3hb3 h ALA 313 Ca 0.03 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 3hb3 h ALA 313 Cb 0.68 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 18.20 3hb3 h ALA 313 CO 0.04 0.48 -0.05 0.00 0.00 0.00 0.00 179.25 179.72 3hb3 h ALA 314 N 1.52 -0.14 -0.93 0.00 0.00 -0.98 -0.93 119.26 117.81 3hb3 h ALA 314 Ca 0.24 -0.26 0.26 0.00 0.00 0.00 0.00 54.91 55.16 3hb3 h ALA 314 Cb -0.04 0.05 -0.14 0.00 0.00 0.00 0.00 17.79 17.67 3hb3 h ALA 314 CO -0.05 -0.27 0.39 0.82 0.00 0.00 0.00 179.25 180.14 3hb3 h ILE 315 N -0.75 0.36 0.58 0.00 2.04 -1.09 -0.40 117.51 118.25 3hb3 h ILE 315 Ca -0.01 -0.10 -0.03 0.00 1.00 0.00 0.00 64.86 65.72 3hb3 h ILE 315 Cb 0.56 0.03 0.00 0.00 -0.74 0.00 0.00 36.82 36.66 3hb3 h ILE 315 CO 0.02 0.06 -0.31 1.23 0.00 0.00 0.00 178.15 179.15 3hb3 h GLY 316 N 0.30 -0.87 1.95 5.37 0.00 -0.75 -0.48 103.07 108.59 3hb3 h GLY 316 Ca 0.61 0.34 -0.18 0.00 0.00 0.00 0.00 47.33 48.10 3hb3 h GLY 316 CO -0.60 -0.32 -0.86 0.16 0.00 0.00 0.00 176.54 174.92 3hb3 h ILE 317 N -0.83 1.58 -0.72 2.60 -0.00 -0.83 -3.16 117.51 116.15 3hb3 h ILE 317 Ca -0.07 -2.83 -0.06 0.00 -0.00 0.00 0.00 64.86 61.89 3hb3 h ILE 317 Cb 0.65 2.55 -0.03 0.00 -0.00 0.00 0.00 36.82 39.99 3hb3 h ILE 317 CO 0.10 0.81 0.20 -0.07 -0.00 0.00 0.00 178.15 179.19 3hb3 h LEU 318 N 0.02 1.07 0.00 0.16 3.38 -1.03 -2.38 115.31 116.53 3hb3 h LEU 318 Ca -0.02 -0.22 0.00 0.00 0.09 0.00 0.00 57.88 57.74 3hb3 h LEU 318 Cb 1.50 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 41.97 3hb3 h LEU 318 CO 0.12 1.01 0.05 0.61 0.09 0.00 0.00 178.44 180.32 3hb3 n GLY 319 N -0.72 -0.16 0.58 0.83 0.00 -0.19 -1.30 105.19 104.23 3hb3 n GLY 319 Ca 0.06 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.17 3hb3 n GLY 319 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3hb3 n PHE 320 N -1.09 0.00 -1.98 1.61 3.01 -0.89 -3.30 117.46 114.82 3hb3 n PHE 320 Ca 0.00 0.00 0.05 0.00 1.01 0.00 0.00 57.45 58.51 3hb3 n PHE 320 Cb 0.05 0.00 0.11 0.00 -0.01 0.00 0.00 39.48 39.63 3hb3 n PHE 320 CO 0.00 0.00 0.00 1.33 1.01 0.00 0.00 176.76 179.10 3hb3 n VAL 321 N 0.43 1.08 -1.20 -4.37 0.24 -0.42 -4.77 118.33 109.33 3hb3 n VAL 321 Ca 0.09 -1.98 0.00 0.00 -2.04 0.00 0.00 64.34 60.42 3hb3 n VAL 321 Cb 0.44 0.34 0.00 0.00 -1.47 0.00 0.00 33.84 33.16 3hb3 n VAL 321 CO 0.00 0.00 0.00 1.33 -2.14 0.00 0.00 176.83 176.02 3hb3 n VAL 322 N -0.37 0.12 0.13 3.34 0.24 -1.25 -4.84 118.33 115.70 3hb3 n VAL 322 Ca 0.12 -0.13 0.04 0.00 -2.04 0.00 0.00 64.34 62.33 3hb3 n VAL 322 Cb 0.88 0.80 0.46 0.00 -1.47 0.00 0.00 33.84 34.52 3hb3 n VAL 322 CO 0.00 0.00 0.00 4.11 -2.14 0.00 0.00 176.83 178.80 3hb3 h TRP 323 N 0.00 0.23 -0.05 6.34 0.09 -1.86 -3.14 115.95 117.56 3hb3 h TRP 323 Ca 0.00 -0.01 0.00 0.00 0.09 0.00 0.00 58.89 58.97 3hb3 h TRP 323 Cb 1.07 -0.07 0.00 0.00 0.08 0.00 0.00 29.16 30.24 3hb3 h TRP 323 CO 0.03 0.26 0.00 0.00 0.09 0.00 0.00 178.44 178.82 3hb3 n ALA 324 N -2.50 2.55 0.70 0.11 0.00 -1.26 -2.32 120.51 117.79 3hb3 n ALA 324 Ca -0.01 -0.13 0.13 0.00 0.00 0.00 0.00 53.44 53.44 3hb3 n ALA 324 Cb 0.18 -1.00 0.47 0.00 0.00 0.00 0.00 19.45 19.10 3hb3 n ALA 324 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 177.50 175.11 3hb3 n HIS 325 N -0.15 0.58 1.73 0.00 1.44 -1.19 -2.17 115.22 115.47 3hb3 n HIS 325 Ca 0.02 0.18 0.06 0.00 -2.01 0.00 0.00 57.72 55.97 3hb3 n HIS 325 Cb 0.18 -0.79 0.30 0.00 0.12 0.00 0.00 29.99 29.80 3hb3 n HIS 325 CO 0.00 0.00 0.00 0.72 -2.81 0.00 0.00 176.34 174.25 3hb3 n HIS 326 N -1.98 0.09 -1.98 -1.40 8.25 -0.98 -4.33 115.22 112.89 3hb3 n HIS 326 Ca 0.05 -0.05 0.00 0.00 -0.26 0.00 0.00 57.72 57.47 3hb3 n HIS 326 Cb 0.36 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.47 3hb3 n HIS 326 CO 0.00 0.00 0.00 -1.33 0.64 0.00 0.00 176.34 175.65 3hb3 n MET 327 N -0.35 0.00 0.24 -0.41 2.00 -0.92 -4.88 117.12 112.80 3hb3 n MET 327 Ca 0.10 -0.80 0.08 0.00 0.00 0.00 0.00 57.70 57.07 3hb3 n MET 327 Cb 0.12 -0.41 0.58 0.00 0.00 0.00 0.00 33.22 33.51 3hb3 n MET 327 CO 0.00 0.00 0.00 1.88 0.00 0.00 0.00 175.97 177.85 3hb3 h TYR 328 N 0.00 0.00 -0.42 2.03 0.05 -1.74 -2.59 116.97 114.29 3hb3 h TYR 328 Ca 0.00 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.78 3hb3 h TYR 328 Cb 1.32 0.00 0.00 0.00 1.01 0.00 0.00 36.73 39.06 3hb3 h TYR 328 CO 0.03 0.16 0.00 0.25 -1.05 0.00 0.00 178.16 177.55 3hb3 n THR 329 N -4.09 1.31 0.95 -2.88 -2.24 -1.26 -4.45 114.28 101.62 3hb3 n THR 329 Ca -0.02 -1.17 0.12 0.00 -2.27 0.00 0.00 64.05 60.71 3hb3 n THR 329 Cb 0.24 0.33 0.25 0.00 -2.10 0.00 0.00 70.33 69.05 3hb3 n THR 329 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3hb3 n ALA 330 N 0.57 3.45 0.00 6.98 0.00 -0.98 -4.87 120.51 125.67 3hb3 n ALA 330 Ca 0.17 -0.33 0.00 0.00 0.00 0.00 0.00 53.44 53.27 3hb3 n ALA 330 Cb 0.59 -1.13 0.00 0.00 0.00 0.00 0.00 19.45 18.90 3hb3 n ALA 330 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3hb3 n GLY 331 N 1.48 0.62 3.46 0.00 0.00 -1.26 -5.01 105.19 104.48 3hb3 n GLY 331 Ca 0.05 -0.77 -0.30 0.00 0.00 0.00 0.00 46.02 45.01 3hb3 n GLY 331 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 3hb3 s MET 332 N -0.70 1.81 0.69 1.61 0.00 -1.26 -5.11 119.30 116.33 3hb3 s MET 332 Ca 0.00 -1.15 -0.17 0.00 0.00 0.00 0.00 55.69 54.38 3hb3 s MET 332 Cb 0.00 -2.10 -0.01 0.00 0.00 0.00 0.00 34.83 32.72 3hb3 s MET 332 CO 0.00 0.49 0.96 -1.13 0.00 0.00 0.00 175.02 175.35 3hb3 n SER 333 N 1.07 0.57 -0.25 -1.18 3.41 -1.26 -4.79 113.62 111.19 3hb3 n SER 333 Ca -0.16 0.71 0.05 0.00 -0.26 0.00 0.00 58.87 59.21 3hb3 n SER 333 Cb 0.53 -1.40 0.18 0.00 -0.26 0.00 0.00 64.21 63.25 3hb3 n SER 333 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 175.04 175.13 3hb3 h LEU 334 N -0.02 0.11 0.02 1.04 5.85 -1.99 -0.49 115.31 119.84 3hb3 h LEU 334 Ca -0.48 0.13 0.03 0.00 0.84 0.00 0.00 57.88 58.40 3hb3 h LEU 334 Cb 1.34 0.15 -0.05 0.00 0.37 0.00 0.00 40.66 42.48 3hb3 h LEU 334 CO 0.48 0.02 -0.31 0.74 -0.34 0.00 0.00 178.44 179.02 3hb3 h THR 335 N 0.33 0.32 -0.81 1.05 2.02 -1.99 0.96 112.91 114.78 3hb3 h THR 335 Ca 0.41 0.00 0.09 0.00 0.77 0.00 0.00 66.41 67.67 3hb3 h THR 335 Cb 0.66 0.32 -0.07 0.00 -1.74 0.00 0.00 68.15 67.32 3hb3 h THR 335 CO -0.46 0.00 0.47 1.56 0.37 0.00 0.00 175.52 177.45 3hb3 h GLN 336 N -0.48 0.77 -0.04 6.66 4.20 -1.86 0.13 115.11 124.50 3hb3 h GLN 336 Ca 0.05 -0.05 -0.00 0.00 0.06 0.00 0.00 58.65 58.72 3hb3 h GLN 336 Cb 0.55 -0.17 -0.00 0.00 0.30 0.00 0.00 27.48 28.16 3hb3 h GLN 336 CO -0.25 0.51 0.02 1.96 -0.67 0.00 0.00 178.83 180.40 3hb3 h GLN 337 N 0.80 0.05 -0.22 1.46 4.20 -0.24 -1.97 115.11 119.18 3hb3 h GLN 337 Ca 0.38 -0.01 0.01 0.00 0.06 0.00 0.00 58.65 59.09 3hb3 h GLN 337 Cb 0.32 -0.01 -0.01 0.00 0.30 0.00 0.00 27.48 28.08 3hb3 h GLN 337 CO -0.23 0.13 0.13 0.00 -0.67 0.00 0.00 178.83 178.19 3hb3 h ALA 338 N 0.91 0.28 0.16 3.87 0.00 -0.69 -0.71 119.26 123.09 3hb3 h ALA 338 Ca 0.01 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 3hb3 h ALA 338 Cb 0.10 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 3hb3 h ALA 338 CO -0.00 -0.27 -0.17 -0.92 0.00 0.00 0.00 179.25 177.89 3hb3 h TYR 339 N 0.27 -0.48 -1.22 0.00 3.20 -0.66 -2.37 116.97 115.72 3hb3 h TYR 339 Ca 0.09 0.00 0.35 0.00 3.14 0.00 0.00 58.73 62.31 3hb3 h TYR 339 Cb -0.01 0.19 -0.06 0.00 1.54 0.00 0.00 36.73 38.39 3hb3 h TYR 339 CO -0.08 -0.23 0.87 0.74 -1.64 0.00 0.00 178.16 177.83 3hb3 h PHE 340 N -0.34 0.08 -0.26 -3.82 0.04 -1.42 0.13 116.94 111.35 3hb3 h PHE 340 Ca -0.02 0.00 -0.19 0.00 2.80 0.00 0.00 57.97 60.56 3hb3 h PHE 340 Cb 0.29 -0.02 0.00 0.00 2.20 0.00 0.00 35.95 38.42 3hb3 h PHE 340 CO -0.14 0.00 -0.58 1.98 -0.60 0.00 0.00 178.31 178.97 3hb3 h MET 341 N 0.04 0.84 -0.01 1.51 4.05 -0.76 -2.63 114.93 117.97 3hb3 h MET 341 Ca 0.60 -0.56 -0.15 0.00 -0.28 0.00 0.00 59.70 59.31 3hb3 h MET 341 Cb 2.29 0.07 0.01 0.00 -0.80 0.00 0.00 31.60 33.17 3hb3 h MET 341 CO -0.05 1.19 -0.59 -0.07 0.23 0.00 0.00 176.91 177.62 3hb3 h LEU 342 N 0.64 0.54 -1.21 3.39 3.38 -0.32 -2.44 115.31 119.29 3hb3 h LEU 342 Ca 0.00 -0.75 0.10 0.00 0.09 0.00 0.00 57.88 57.33 3hb3 h LEU 342 Cb 1.19 -0.16 -0.07 0.00 0.09 0.00 0.00 40.66 41.71 3hb3 h LEU 342 CO 0.13 1.22 0.57 0.00 0.09 0.00 0.00 178.44 180.45 3hb3 h ALA 343 N 0.34 1.66 0.01 1.53 0.00 -1.14 -2.29 119.26 119.36 3hb3 h ALA 343 Ca -0.07 -0.00 -0.23 0.00 0.00 0.00 0.00 54.91 54.61 3hb3 h ALA 343 Cb 1.30 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.89 3hb3 h ALA 343 CO 0.12 0.15 -0.96 1.15 0.00 0.00 0.00 179.25 179.71 3hb3 h THR 344 N 0.86 1.42 -0.62 0.00 2.02 -1.44 -2.86 112.91 112.29 3hb3 h THR 344 Ca 0.42 -2.53 0.07 0.00 0.77 0.00 0.00 66.41 65.13 3hb3 h THR 344 Cb 0.44 2.48 -0.04 0.00 -1.74 0.00 0.00 68.15 69.30 3hb3 h THR 344 CO -0.18 0.75 0.41 0.24 0.37 0.00 0.00 175.52 177.11 3hb3 h MET 345 N 0.20 0.56 0.00 6.66 2.07 -0.90 -2.82 114.93 120.70 3hb3 h MET 345 Ca -0.08 -0.03 -0.02 0.00 -2.07 0.00 0.00 59.70 57.50 3hb3 h MET 345 Cb 1.61 -0.13 -0.00 0.00 -1.87 0.00 0.00 31.60 31.21 3hb3 h MET 345 CO 0.16 0.37 -0.07 1.79 1.07 0.00 0.00 176.91 180.23 3hb3 h THR 346 N 0.58 0.61 0.00 2.22 1.35 -1.41 -2.19 112.91 114.07 3hb3 h THR 346 Ca 0.27 -0.31 -0.03 0.00 -0.55 0.00 0.00 66.41 65.80 3hb3 h THR 346 Cb 0.32 1.19 -0.00 0.00 -1.73 0.00 0.00 68.15 67.93 3hb3 h THR 346 CO -0.08 0.07 -0.13 0.40 -0.25 0.00 0.00 175.52 175.53 3hb3 h ILE 347 N 0.00 1.02 0.00 6.82 2.04 -1.67 0.21 117.51 125.93 3hb3 h ILE 347 Ca -0.00 -0.45 0.00 0.00 1.00 0.00 0.00 64.86 65.41 3hb3 h ILE 347 Cb 0.19 1.25 0.00 0.00 -0.74 0.00 0.00 36.82 37.52 3hb3 h ILE 347 CO 0.01 0.13 0.00 0.00 0.00 0.00 0.00 178.15 178.29 3hb3 n ALA 348 N -2.48 1.13 -0.06 1.87 0.00 -0.82 -3.34 120.51 116.81 3hb3 n ALA 348 Ca -0.03 0.13 -0.02 0.00 0.00 0.00 0.00 53.44 53.52 3hb3 n ALA 348 Cb 0.20 -1.25 -0.01 0.00 0.00 0.00 0.00 19.45 18.40 3hb3 n ALA 348 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 3hb3 h VAL 349 N 0.00 0.00 -0.06 0.00 2.07 -0.78 -2.66 116.25 114.81 3hb3 h VAL 349 Ca 0.00 -1.00 0.02 0.00 0.82 0.00 0.00 66.70 66.54 3hb3 h VAL 349 Cb 0.05 0.00 -0.00 0.00 -1.52 0.00 0.00 31.29 29.82 3hb3 h VAL 349 CO 0.00 0.00 0.15 -0.65 0.02 0.00 0.00 177.57 177.09 3hb3 h PRO 350 N -1.00 0.00 0.16 1.57 0.11 -1.72 -0.14 132.00 130.99 3hb3 h PRO 350 Ca 0.00 0.00 -0.30 0.00 0.11 0.00 0.00 66.00 65.81 3hb3 h PRO 350 Cb 0.26 0.00 0.01 0.00 0.11 0.00 0.00 31.00 31.38 3hb3 h PRO 350 CO 0.00 0.00 -1.38 1.15 -0.21 0.00 0.00 178.00 177.56 3hb3 h THR 351 N 0.00 1.36 -0.54 -1.15 2.02 -1.67 -2.74 112.91 110.19 3hb3 h THR 351 Ca 0.03 -2.90 -0.06 0.00 0.77 0.00 0.00 66.41 64.25 3hb3 h THR 351 Cb 0.33 2.93 -0.02 0.00 -1.74 0.00 0.00 68.15 69.64 3hb3 h THR 351 CO -0.00 0.86 0.10 1.23 0.37 0.00 0.00 175.52 178.08 3hb3 h GLY 352 N 1.22 0.90 0.43 2.16 0.00 -0.68 -0.38 103.07 106.73 3hb3 h GLY 352 Ca -0.19 -0.54 0.03 0.00 0.00 0.00 0.00 47.33 46.62 3hb3 h GLY 352 CO 0.21 0.51 -0.27 -2.22 0.00 0.00 0.00 176.54 174.77 3hb3 h ILE 353 N 0.80 0.39 -0.29 2.60 2.04 -1.12 0.82 117.51 122.75 3hb3 h ILE 353 Ca 0.17 0.00 0.02 0.00 1.00 0.00 0.00 64.86 66.05 3hb3 h ILE 353 Cb 0.34 0.39 -0.02 0.00 -0.74 0.00 0.00 36.82 36.79 3hb3 h ILE 353 CO 0.00 0.00 0.15 0.11 0.00 0.00 0.00 178.15 178.41 3hb3 h LYS 354 N -0.44 0.30 -0.40 2.37 1.57 -1.25 0.35 116.57 119.07 3hb3 h LYS 354 Ca 0.05 -0.02 -0.02 0.00 -1.87 0.00 0.00 60.65 58.79 3hb3 h LYS 354 Cb 0.51 -0.07 -0.02 0.00 0.08 0.00 0.00 32.23 32.73 3hb3 h LYS 354 CO -0.21 0.20 0.16 0.28 -0.57 0.00 0.00 179.45 179.31 3hb3 h VAL 355 N 0.31 1.19 0.37 0.50 2.07 -0.08 -0.19 116.25 120.41 3hb3 h VAL 355 Ca 0.12 -0.59 -0.01 0.00 0.82 0.00 0.00 66.70 67.04 3hb3 h VAL 355 Cb 0.03 0.84 -0.00 0.00 -1.52 0.00 0.00 31.29 30.64 3hb3 h VAL 355 CO -0.08 0.21 -0.22 -0.26 0.02 0.00 0.00 177.57 177.25 3hb3 h PHE 356 N 0.50 -0.57 -0.70 1.57 0.04 -0.40 -1.84 116.94 115.54 3hb3 h PHE 356 Ca 0.13 -0.01 0.10 0.00 2.80 0.00 0.00 57.97 60.99 3hb3 h PHE 356 Cb 0.18 0.20 -0.12 0.00 2.20 0.00 0.00 35.95 38.42 3hb3 h PHE 356 CO -0.00 -0.34 -0.46 0.77 -0.60 0.00 0.00 178.31 177.68 3hb3 h SER 357 N -0.56 -1.62 -0.72 2.17 0.02 -0.14 0.46 113.55 113.16 3hb3 h SER 357 Ca -0.04 0.27 0.13 0.00 -0.84 0.00 0.00 61.79 61.31 3hb3 h SER 357 Cb 0.46 0.74 -0.09 0.00 0.14 0.00 0.00 62.40 63.65 3hb3 h SER 357 CO 0.05 -0.32 0.26 -0.50 -1.14 0.00 0.00 176.83 175.18 3hb3 h TRP 358 N -0.17 0.44 0.00 3.45 6.55 -0.99 0.78 115.95 126.02 3hb3 h TRP 358 Ca 0.20 0.04 -0.08 0.00 0.95 0.00 0.00 58.89 60.00 3hb3 h TRP 358 Cb 0.55 -0.09 -0.01 0.00 -0.86 0.00 0.00 29.16 28.75 3hb3 h TRP 358 CO -0.79 0.05 -0.36 0.82 -1.05 0.00 0.00 178.44 177.11 3hb3 h ILE 359 N 0.41 1.18 -0.30 1.49 2.04 -0.11 -2.56 117.51 119.65 3hb3 h ILE 359 Ca 0.39 -1.26 -0.15 0.00 1.00 0.00 0.00 64.86 64.84 3hb3 h ILE 359 Cb 0.58 1.69 -0.00 0.00 -0.74 0.00 0.00 36.82 38.35 3hb3 h ILE 359 CO -0.40 0.35 -0.39 0.00 0.00 0.00 0.00 178.15 177.71 3hb3 h ALA 360 N 1.64 0.45 -0.37 1.87 0.00 0.48 -1.10 119.26 122.23 3hb3 h ALA 360 Ca -0.00 -0.45 0.06 0.00 0.00 0.00 0.00 54.91 54.51 3hb3 h ALA 360 Cb 0.67 -0.09 -0.05 0.00 0.00 0.00 0.00 17.79 18.31 3hb3 h ALA 360 CO 0.05 0.55 0.05 1.15 0.00 0.00 0.00 179.25 181.05 3hb3 h THR 361 N 0.56 0.78 0.00 0.00 2.02 0.34 0.64 112.91 117.25 3hb3 h THR 361 Ca 0.04 -0.06 0.00 0.00 0.77 0.00 0.00 66.41 67.16 3hb3 h THR 361 Cb 0.99 0.61 0.00 0.00 -1.74 0.00 0.00 68.15 68.00 3hb3 h THR 361 CO 0.09 0.03 0.00 0.23 0.37 0.00 0.00 175.52 176.24 3hb3 n MET 362 N -5.12 0.19 -2.19 6.66 2.81 -0.96 -4.63 117.12 113.88 3hb3 n MET 362 Ca 0.02 0.36 -0.42 0.00 -1.81 0.00 0.00 57.70 55.85 3hb3 n MET 362 Cb 0.18 -1.82 -0.03 0.00 -0.71 0.00 0.00 33.22 30.83 3hb3 n MET 362 CO 0.00 0.00 0.00 -0.46 1.51 0.00 0.00 175.97 177.02 3hb3 s TRP 363 N -3.24 3.06 -1.55 2.03 -0.11 0.21 -2.19 118.94 117.16 3hb3 s TRP 363 Ca 0.06 0.89 -0.05 0.00 1.22 0.00 0.00 56.10 58.22 3hb3 s TRP 363 Cb 0.10 -3.67 0.01 0.00 -1.50 0.00 0.00 33.47 28.41 3hb3 s TRP 363 CO 0.43 -2.42 0.62 0.41 -4.62 0.00 0.00 176.95 171.37 3hb3 n GLY 364 N 3.56 -0.52 0.00 5.86 0.00 -1.26 -4.98 105.19 107.85 3hb3 n GLY 364 Ca 0.12 0.14 0.00 0.00 0.00 0.00 0.00 46.02 46.28 3hb3 n GLY 364 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hb3 n GLY 365 N -1.53 2.77 2.63 -0.02 0.00 -0.93 -5.07 105.19 103.04 3hb3 n GLY 365 Ca -0.11 -2.09 -0.25 0.00 0.00 0.00 0.00 46.02 43.58 3hb3 n GLY 365 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3hb3 s SER 366 N -0.79 2.31 -0.11 1.61 0.15 0.17 -5.04 113.70 112.00 3hb3 s SER 366 Ca 0.00 -0.64 0.02 0.00 0.70 0.00 0.00 55.95 56.03 3hb3 s SER 366 Cb 0.00 -0.11 0.01 0.00 -1.71 0.00 0.00 66.02 64.22 3hb3 s SER 366 CO 0.00 -0.36 -0.17 -0.63 1.20 0.00 0.00 173.24 173.28 3hb3 s ILE 367 N 2.18 1.63 -0.18 6.45 1.01 -1.25 -4.27 121.20 126.77 3hb3 s ILE 367 Ca 0.04 -0.72 -0.07 0.00 0.00 0.00 0.00 60.65 59.90 3hb3 s ILE 367 Cb -0.16 -1.47 -0.04 0.00 0.01 0.00 0.00 42.46 40.80 3hb3 s ILE 367 CO -0.15 0.47 0.05 -1.61 0.00 0.00 0.00 174.94 173.70 3hb3 s GLU 368 N 0.91 3.94 -0.67 2.79 2.02 -1.13 -5.00 118.70 121.56 3hb3 s GLU 368 Ca -0.07 -0.37 -0.07 0.00 0.02 0.00 0.00 54.97 54.48 3hb3 s GLU 368 Cb -0.15 -3.17 -0.11 0.00 0.10 0.00 0.00 34.13 30.79 3hb3 s GLU 368 CO -0.01 0.27 3.15 1.19 0.02 0.00 0.00 175.26 179.88 3hb3 n PHE 369 N 3.52 1.25 -1.58 1.61 3.72 -1.26 -4.83 117.46 119.88 3hb3 n PHE 369 Ca -0.17 -2.16 -0.32 0.00 -0.05 0.00 0.00 57.45 54.75 3hb3 n PHE 369 Cb 0.52 -1.82 0.06 0.00 -0.94 0.00 0.00 39.48 37.30 3hb3 n PHE 369 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 176.76 176.86 3hb3 s LYS 370 N 0.53 2.61 0.21 -1.08 -0.14 -1.26 -4.64 119.74 115.97 3hb3 s LYS 370 Ca 0.65 1.31 -0.09 0.00 -1.36 0.00 0.00 55.97 56.47 3hb3 s LYS 370 Cb 0.28 -1.93 0.31 0.00 -1.68 0.00 0.00 37.83 34.81 3hb3 s LYS 370 CO -0.07 -1.39 1.70 1.15 -0.76 0.00 0.00 175.35 175.99 3hb3 h THR 371 N -0.38 0.62 -0.36 2.17 2.02 -1.91 1.20 112.91 116.27 3hb3 h THR 371 Ca -0.46 -0.09 0.11 0.00 0.77 0.00 0.00 66.41 66.74 3hb3 h THR 371 Cb 1.24 0.34 -0.01 0.00 -1.74 0.00 0.00 68.15 67.98 3hb3 h THR 371 CO 0.53 0.05 0.30 -0.65 0.37 0.00 0.00 175.52 176.12 3hb3 h PRO 372 N 0.26 0.00 0.04 6.66 0.11 -1.87 -0.95 132.00 136.25 3hb3 h PRO 372 Ca 0.33 0.00 -0.33 0.00 0.11 0.00 0.00 66.00 66.11 3hb3 h PRO 372 Cb 0.50 0.00 -0.04 0.00 0.11 0.00 0.00 31.00 31.57 3hb3 h PRO 372 CO -0.42 0.00 -1.91 -0.12 -0.21 0.00 0.00 178.00 175.34 3hb3 n MET 373 N -4.16 0.68 -0.19 1.05 0.00 0.40 -2.32 117.12 112.58 3hb3 n MET 373 Ca 0.06 0.25 -0.02 0.00 -0.00 0.00 0.00 57.70 57.99 3hb3 n MET 373 Cb 0.48 -1.73 0.05 0.00 0.00 0.00 0.00 33.22 32.02 3hb3 n MET 373 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 175.97 175.90 3hb3 h LEU 374 N 0.03 -0.61 -0.91 -0.89 3.38 0.13 0.33 115.31 116.76 3hb3 h LEU 374 Ca -0.37 0.18 -0.06 0.00 0.09 0.00 0.00 57.88 57.73 3hb3 h LEU 374 Cb 2.04 0.39 -0.03 0.00 0.09 0.00 0.00 40.66 43.15 3hb3 h LEU 374 CO 0.07 -0.21 0.17 -0.50 0.09 0.00 0.00 178.44 178.06 3hb3 h TRP 375 N -0.02 1.00 0.00 1.13 4.06 -1.22 -1.71 115.95 119.19 3hb3 h TRP 375 Ca 0.28 -0.10 -0.18 0.00 2.06 0.00 0.00 58.89 60.95 3hb3 h TRP 375 Cb 0.45 -0.29 -0.03 0.00 -1.00 0.00 0.00 29.16 28.29 3hb3 h TRP 375 CO -0.50 0.82 -0.84 0.00 -3.56 0.00 0.00 178.44 174.35 3hb3 h ALA 376 N 1.25 0.61 0.28 1.49 0.00 -1.20 -1.71 119.26 119.97 3hb3 h ALA 376 Ca 0.20 -0.77 -0.01 0.00 0.00 0.00 0.00 54.91 54.33 3hb3 h ALA 376 Cb 0.31 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.96 3hb3 h ALA 376 CO -0.00 1.05 -0.13 0.35 0.00 0.00 0.00 179.25 180.51 3hb3 h PHE 377 N 0.00 -0.35 -0.76 0.00 3.57 -0.67 -1.68 116.94 117.04 3hb3 h PHE 377 Ca -0.01 -0.01 0.13 0.00 3.53 0.00 0.00 57.97 61.61 3hb3 h PHE 377 Cb 1.49 0.11 -0.13 0.00 2.79 0.00 0.00 35.95 40.22 3hb3 h PHE 377 CO 0.00 -0.00 -0.36 0.78 -2.23 0.00 0.00 178.31 176.50 3hb3 h GLY 378 N -0.75 -0.04 0.68 2.40 0.00 -1.38 -0.73 103.07 103.25 3hb3 h GLY 378 Ca -0.04 0.47 0.16 0.00 0.00 0.00 0.00 47.33 47.93 3hb3 h GLY 378 CO 0.06 -0.20 0.49 -2.75 0.00 0.00 0.00 176.54 174.14 3hb3 h PHE 379 N -0.09 0.32 -0.26 5.60 3.04 -1.10 -1.50 116.94 122.95 3hb3 h PHE 379 Ca 0.28 0.01 -0.15 0.00 3.98 0.00 0.00 57.97 62.09 3hb3 h PHE 379 Cb 0.57 -0.10 -0.00 0.00 2.56 0.00 0.00 35.95 38.98 3hb3 h PHE 379 CO -0.74 0.11 -0.41 -0.07 -2.02 0.00 0.00 178.31 175.18 3hb3 h LEU 380 N 0.27 0.81 0.52 0.59 4.07 -0.17 -0.52 115.31 120.88 3hb3 h LEU 380 Ca 0.35 -0.52 -0.03 0.00 0.08 0.00 0.00 57.88 57.76 3hb3 h LEU 380 Cb 0.99 -0.23 0.01 0.00 1.08 0.00 0.00 40.66 42.51 3hb3 h LEU 380 CO -0.08 1.17 -0.25 0.15 -1.08 0.00 0.00 178.44 178.35 3hb3 h PHE 381 N 0.47 -0.65 -0.84 1.13 3.57 -1.18 -2.89 116.94 116.55 3hb3 h PHE 381 Ca 0.02 -0.02 0.11 0.00 3.53 0.00 0.00 57.97 61.62 3hb3 h PHE 381 Cb 1.01 0.22 -0.06 0.00 2.79 0.00 0.00 35.95 39.90 3hb3 h PHE 381 CO 0.08 -0.41 0.54 -0.07 -2.23 0.00 0.00 178.31 176.23 3hb3 h LEU 382 N -1.01 0.66 -0.15 0.59 3.38 -1.42 0.71 115.31 118.08 3hb3 h LEU 382 Ca -0.07 0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.92 3hb3 h LEU 382 Cb 0.54 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 41.18 3hb3 h LEU 382 CO 0.12 0.38 0.00 0.33 0.09 0.00 0.00 178.44 179.35 3hb3 n PHE 383 N -4.53 0.95 -0.03 1.13 7.35 -0.20 -2.00 117.46 120.14 3hb3 n PHE 383 Ca 0.15 0.30 -0.16 0.00 -0.76 0.00 0.00 57.45 56.98 3hb3 n PHE 383 Cb 0.38 -0.98 -0.13 0.00 0.35 0.00 0.00 39.48 39.10 3hb3 n PHE 383 CO 0.00 0.00 0.00 1.15 -0.76 0.00 0.00 176.76 177.15 3hb3 h THR 384 N 0.00 1.63 -0.88 -2.13 2.02 0.61 -1.58 112.91 112.58 3hb3 h THR 384 Ca 0.00 -2.21 0.20 0.00 0.77 0.00 0.00 66.41 65.18 3hb3 h THR 384 Cb 0.67 3.08 -0.12 0.00 -1.74 0.00 0.00 68.15 70.05 3hb3 h THR 384 CO 0.00 0.60 0.40 0.58 0.37 0.00 0.00 175.52 177.47 3hb3 h VAL 385 N -0.66 0.53 -0.06 3.16 2.07 -1.18 -1.88 116.25 118.24 3hb3 h VAL 385 Ca -0.04 -0.15 -0.19 0.00 0.82 0.00 0.00 66.70 67.13 3hb3 h VAL 385 Cb 1.13 0.05 -0.00 0.00 -1.52 0.00 0.00 31.29 30.94 3hb3 h VAL 385 CO 0.05 0.08 -0.78 1.23 0.02 0.00 0.00 177.57 178.18 3hb3 h GLY 386 N 0.45 0.45 1.53 2.17 0.00 -1.47 -2.80 103.07 103.39 3hb3 h GLY 386 Ca 0.53 -0.67 -0.14 0.00 0.00 0.00 0.00 47.33 47.05 3hb3 h GLY 386 CO -0.49 0.59 -0.49 -1.33 0.00 0.00 0.00 176.54 174.83 3hb3 h GLY 387 N 1.28 0.56 1.05 4.60 0.00 -0.78 -2.14 103.07 107.64 3hb3 h GLY 387 Ca -0.04 -0.60 -0.08 0.00 0.00 0.00 0.00 47.33 46.61 3hb3 h GLY 387 CO 0.13 0.54 0.06 -0.24 0.00 0.00 0.00 176.54 177.04 3hb3 h VAL 388 N 0.40 1.26 -0.19 4.60 3.04 -1.41 -1.82 116.25 122.14 3hb3 h VAL 388 Ca 0.02 -1.06 -0.05 0.00 -1.01 0.00 0.00 66.70 64.60 3hb3 h VAL 388 Cb 1.00 0.77 -0.01 0.00 -2.01 0.00 0.00 31.29 31.04 3hb3 h VAL 388 CO 0.09 0.39 -0.13 0.74 -1.01 0.00 0.00 177.57 177.65 3hb3 h THR 389 N 0.92 1.19 0.00 3.17 2.02 -1.52 0.35 112.91 119.04 3hb3 h THR 389 Ca 0.18 -0.85 -0.07 0.00 0.77 0.00 0.00 66.41 66.44 3hb3 h THR 389 Cb 0.48 1.19 -0.01 0.00 -1.74 0.00 0.00 68.15 68.07 3hb3 h THR 389 CO 0.02 0.27 -0.33 1.23 0.37 0.00 0.00 175.52 177.08 3hb3 h GLY 390 N 0.80 0.00 0.88 2.16 0.00 -1.26 0.17 103.07 105.83 3hb3 h GLY 390 Ca 0.06 0.00 -0.12 0.00 0.00 0.00 0.00 47.33 47.27 3hb3 h GLY 390 CO 0.02 0.00 -0.37 -2.08 0.00 0.00 0.00 176.54 174.12 3hb3 h VAL 391 N 0.00 1.34 0.16 4.60 2.07 0.53 -2.99 116.25 121.97 3hb3 h VAL 391 Ca -0.00 -1.62 0.01 0.00 0.82 0.00 0.00 66.70 65.91 3hb3 h VAL 391 Cb 0.66 1.94 -0.05 0.00 -1.52 0.00 0.00 31.29 32.33 3hb3 h VAL 391 CO 0.04 0.49 -0.52 0.58 0.02 0.00 0.00 177.57 178.19 3hb3 h VAL 392 N 0.20 0.02 -0.44 2.57 2.07 -1.10 -1.00 116.25 118.57 3hb3 h VAL 392 Ca 0.00 0.00 0.13 0.00 0.82 0.00 0.00 66.70 67.65 3hb3 h VAL 392 Cb 0.97 0.02 -0.02 0.00 -1.52 0.00 0.00 31.29 30.74 3hb3 h VAL 392 CO 0.08 0.00 0.97 -0.07 0.02 0.00 0.00 177.57 178.57 3hb3 h LEU 393 N -0.78 0.00 0.00 2.57 3.38 -0.68 -0.11 115.31 119.69 3hb3 h LEU 393 Ca -0.01 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 57.83 3hb3 h LEU 393 Cb 0.77 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.50 3hb3 h LEU 393 CO -0.26 0.00 -1.19 0.77 0.09 0.00 0.00 178.44 177.85 3hb3 h SER 394 N 0.00 0.00 -1.88 -0.43 4.64 -1.02 -3.39 113.55 111.47 3hb3 h SER 394 Ca 0.21 0.00 -0.49 0.00 -0.47 0.00 0.00 61.79 61.04 3hb3 h SER 394 Cb 2.14 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 64.19 3hb3 h SER 394 CO -0.00 0.49 1.24 -1.10 -0.87 0.00 0.00 176.83 176.59 3hb3 s GLN 395 N -2.99 2.74 0.33 4.77 -1.52 -0.06 -4.59 119.66 118.35 3hb3 s GLN 395 Ca -0.01 0.32 0.12 0.00 -1.95 0.00 0.00 55.36 53.83 3hb3 s GLN 395 Cb 0.09 -4.45 1.02 0.00 -0.22 0.00 0.00 33.01 29.44 3hb3 s GLN 395 CO 0.80 -2.69 1.64 0.00 -0.25 0.00 0.00 175.29 174.79 3hb3 h ALA 396 N 13.58 1.78 -0.05 6.09 0.00 -1.85 0.67 119.26 139.48 3hb3 h ALA 396 Ca -0.21 0.22 0.01 0.00 0.00 0.00 0.00 54.91 54.93 3hb3 h ALA 396 Cb 1.12 0.25 -0.00 0.00 0.00 0.00 0.00 17.79 19.16 3hb3 h ALA 396 CO 1.23 -0.60 0.05 -1.35 0.00 0.00 0.00 179.25 178.58 3hb3 h PRO 397 N 0.23 0.00 0.04 0.00 0.11 -1.95 0.76 132.00 131.19 3hb3 h PRO 397 Ca 0.70 0.00 -0.37 0.00 0.11 0.00 0.00 66.00 66.44 3hb3 h PRO 397 Cb 1.60 0.00 -0.05 0.00 0.11 0.00 0.00 31.00 32.66 3hb3 h PRO 397 CO -0.66 0.00 -2.16 1.28 -0.21 0.00 0.00 178.00 176.25 3hb3 n LEU 398 N -3.92 2.53 -0.30 2.35 4.32 0.20 -4.01 117.00 118.16 3hb3 n LEU 398 Ca -0.02 0.14 0.13 0.00 -0.02 0.00 0.00 56.01 56.25 3hb3 n LEU 398 Cb 0.15 -0.97 0.37 0.00 -1.62 0.00 0.00 43.42 41.35 3hb3 n LEU 398 CO 0.28 0.75 1.22 -0.78 -1.22 0.00 0.00 177.39 177.64 3hb3 h ASP 399 N -0.30 0.67 -0.88 -1.43 3.58 -0.23 -2.27 116.42 115.56 3hb3 h ASP 399 Ca -0.52 0.06 0.13 0.00 0.42 0.00 0.00 57.03 57.13 3hb3 h ASP 399 Cb 1.81 -0.07 -0.14 0.00 1.72 0.00 0.00 39.33 42.65 3hb3 h ASP 399 CO -0.11 0.29 -0.39 -0.09 -2.88 0.00 0.00 179.24 176.06 3hb3 h ARG 400 N 0.69 -0.05 0.00 0.28 9.65 -0.99 0.94 114.38 124.90 3hb3 h ARG 400 Ca 0.50 0.00 -0.15 0.00 -1.10 0.00 0.00 59.98 59.24 3hb3 h ARG 400 Cb 0.86 0.01 -0.02 0.00 -1.39 0.00 0.00 29.97 29.43 3hb3 h ARG 400 CO -0.26 -0.03 -0.71 0.28 2.80 0.00 0.00 179.97 182.05 3hb3 h VAL 401 N -0.05 1.35 0.05 0.20 2.07 -1.65 -3.36 116.25 114.86 3hb3 h VAL 401 Ca 0.30 -2.55 -0.32 0.00 0.82 0.00 0.00 66.70 64.95 3hb3 h VAL 401 Cb 0.57 2.43 -0.04 0.00 -1.52 0.00 0.00 31.29 32.74 3hb3 h VAL 401 CO -0.90 0.69 -1.80 1.88 0.02 0.00 0.00 177.57 177.46 3hb3 h TYR 402 N 0.00 0.19 -2.17 1.57 0.05 -0.65 -3.45 116.97 112.51 3hb3 h TYR 402 Ca -0.01 -0.14 -0.62 0.00 0.05 0.00 0.00 58.73 58.01 3hb3 h TYR 402 Cb 1.38 -0.01 0.10 0.00 1.01 0.00 0.00 36.73 39.21 3hb3 h TYR 402 CO 0.00 1.29 0.08 1.58 -1.05 0.00 0.00 178.16 180.07 3hb3 n HIS 403 N -3.22 1.07 -3.78 4.88 -0.00 0.31 -0.72 115.22 113.76 3hb3 n HIS 403 Ca -0.22 0.73 -0.29 0.00 0.46 0.00 0.00 57.72 58.40 3hb3 n HIS 403 Cb 1.05 -2.22 -0.03 0.00 -0.12 0.00 0.00 29.99 28.67 3hb3 n HIS 403 CO 0.00 0.00 0.00 -0.25 0.46 0.00 0.00 176.34 176.55 3hb3 n ASP 404 N 1.50 -2.62 -4.80 0.26 9.92 -1.26 -4.97 116.55 114.57 3hb3 n ASP 404 Ca 0.12 -0.65 -0.30 0.00 -0.53 0.00 0.00 54.79 53.43 3hb3 n ASP 404 Cb 0.29 -2.22 -0.05 0.00 -0.64 0.00 0.00 41.12 38.50 3hb3 n ASP 404 CO 0.00 0.00 0.00 0.42 0.13 0.00 0.00 177.20 177.75 3hb3 s THR 405 N -2.96 1.48 -0.22 -3.53 -4.23 0.10 -0.99 115.64 105.29 3hb3 s THR 405 Ca 0.55 -1.79 0.24 0.00 -1.18 0.00 0.00 61.69 59.51 3hb3 s THR 405 Cb -0.31 -2.27 0.25 0.00 1.34 0.00 0.00 72.50 71.51 3hb3 s THR 405 CO 0.68 0.00 1.74 1.88 -0.54 0.00 0.00 174.62 178.38 3hb3 h TYR 406 N 1.16 0.00 -0.35 3.99 -1.99 -1.68 -1.73 116.97 116.37 3hb3 h TYR 406 Ca -0.41 0.00 -0.02 0.00 2.00 0.00 0.00 58.73 60.30 3hb3 h TYR 406 Cb 1.30 0.00 -0.02 0.00 2.00 0.00 0.00 36.73 40.02 3hb3 h TYR 406 CO 1.21 0.00 0.14 -0.92 -0.00 0.00 0.00 178.16 178.59 3hb3 h TYR 407 N 0.00 0.54 0.00 4.88 3.20 -1.73 -0.12 116.97 123.74 3hb3 h TYR 407 Ca 0.00 -0.04 -0.03 0.00 3.14 0.00 0.00 58.73 61.80 3hb3 h TYR 407 Cb 0.15 -0.16 -0.00 0.00 1.54 0.00 0.00 36.73 38.26 3hb3 h TYR 407 CO 0.00 0.50 -0.15 -0.39 -1.64 0.00 0.00 178.16 176.49 3hb3 h VAL 408 N 0.43 1.05 -0.10 1.81 -1.51 -1.48 -1.74 116.25 114.71 3hb3 h VAL 408 Ca 0.12 -0.52 -0.15 0.00 -1.23 0.00 0.00 66.70 64.92 3hb3 h VAL 408 Cb 0.19 1.28 0.01 0.00 -2.13 0.00 0.00 31.29 30.64 3hb3 h VAL 408 CO -0.01 0.15 -0.52 0.58 -1.23 0.00 0.00 177.57 176.54 3hb3 h VAL 409 N 0.00 1.37 -0.14 7.19 2.07 -1.43 -1.89 116.25 123.41 3hb3 h VAL 409 Ca -0.00 -1.85 0.05 0.00 0.82 0.00 0.00 66.70 65.72 3hb3 h VAL 409 Cb 0.27 2.22 -0.07 0.00 -1.52 0.00 0.00 31.29 32.19 3hb3 h VAL 409 CO 0.02 0.55 -0.34 0.00 0.02 0.00 0.00 177.57 177.82 3hb3 h ALA 410 N 0.46 -0.41 -0.20 1.67 0.00 -0.68 -2.12 119.26 117.99 3hb3 h ALA 410 Ca -0.04 0.02 0.02 0.00 0.00 0.00 0.00 54.91 54.91 3hb3 h ALA 410 Cb 1.16 0.65 -0.03 0.00 0.00 0.00 0.00 17.79 19.58 3hb3 h ALA 410 CO 0.11 -0.82 -0.13 1.25 0.00 0.00 0.00 179.25 179.65 3hb3 h HIS 411 N -0.41 -0.43 0.00 0.00 6.17 -1.21 -0.78 115.15 118.49 3hb3 h HIS 411 Ca 0.10 0.03 0.00 0.00 0.71 0.00 0.00 60.37 61.20 3hb3 h HIS 411 Cb 0.56 0.21 0.00 0.00 2.52 0.00 0.00 27.41 30.71 3hb3 h HIS 411 CO -0.43 -0.09 0.00 0.27 0.71 0.00 0.00 177.93 178.39 3hb3 h PHE 412 N -0.02 0.00 -0.22 5.26 -5.15 -1.07 -0.41 116.94 115.33 3hb3 h PHE 412 Ca 0.03 0.00 -0.19 0.00 -0.20 0.00 0.00 57.97 57.61 3hb3 h PHE 412 Cb 0.10 0.00 0.00 0.00 0.22 0.00 0.00 35.95 36.28 3hb3 h PHE 412 CO -0.88 0.00 -0.62 0.45 -2.00 0.00 0.00 178.31 175.25 3hb3 h HIS 413 N 0.00 1.00 -0.29 6.09 3.86 -1.21 -0.63 115.15 123.97 3hb3 h HIS 413 Ca 0.00 -0.38 0.04 0.00 -1.16 0.00 0.00 60.37 58.86 3hb3 h HIS 413 Cb 0.93 -0.18 -0.04 0.00 1.06 0.00 0.00 27.41 29.19 3hb3 h HIS 413 CO 0.00 1.20 0.07 1.88 0.86 0.00 0.00 177.93 181.94 3hb3 h TYR 414 N 0.58 0.13 0.00 2.45 0.05 0.45 0.90 116.97 121.52 3hb3 h TYR 414 Ca -0.01 0.02 0.00 0.00 0.05 0.00 0.00 58.73 58.79 3hb3 h TYR 414 Cb 1.23 -0.01 0.00 0.00 1.01 0.00 0.00 36.73 38.95 3hb3 h TYR 414 CO 0.07 0.04 -0.12 -0.39 -1.05 0.00 0.00 178.16 176.71 3hb3 h VAL 415 N 0.19 0.00 0.00 -2.88 -1.51 -1.45 -2.91 116.25 107.69 3hb3 h VAL 415 Ca 0.13 -0.56 -0.25 0.00 -1.23 0.00 0.00 66.70 64.79 3hb3 h VAL 415 Cb 0.13 1.48 -0.05 0.00 -2.13 0.00 0.00 31.29 30.73 3hb3 h VAL 415 CO -0.16 0.00 -1.94 0.23 -1.23 0.00 0.00 177.57 174.46 3hb3 n MET 416 N -2.36 1.66 -0.00 5.19 2.81 -0.25 -1.64 117.12 122.53 3hb3 n MET 416 Ca 0.05 0.00 0.01 0.00 -1.81 0.00 0.00 57.70 55.95 3hb3 n MET 416 Cb 0.45 -1.35 -0.02 0.00 -0.71 0.00 0.00 33.22 31.59 3hb3 n MET 416 CO 0.00 0.00 0.00 0.45 1.51 0.00 0.00 175.97 177.93 3hb3 n SER 417 N -2.55 4.49 -1.82 7.83 2.88 0.30 -2.51 113.62 122.25 3hb3 n SER 417 Ca -0.23 0.00 0.07 0.00 -1.33 0.00 0.00 58.87 57.38 3hb3 n SER 417 Cb 0.94 1.07 0.39 0.00 -0.75 0.00 0.00 64.21 65.85 3hb3 n SER 417 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 3hb3 n LEU 418 N -1.60 5.48 0.00 2.46 4.32 -0.62 -4.54 117.00 122.50 3hb3 n LEU 418 Ca -0.01 -2.78 0.00 0.00 -0.02 0.00 0.00 56.01 53.21 3hb3 n LEU 418 Cb 0.09 -0.67 0.00 0.00 -1.62 0.00 0.00 43.42 41.21 3hb3 n LEU 418 CO 0.05 0.62 0.00 0.61 -1.22 0.00 0.00 177.39 177.44 3hb3 n GLY 419 N 0.62 1.76 0.38 -0.72 0.00 -1.11 -4.26 105.19 101.87 3hb3 n GLY 419 Ca 0.26 -0.21 0.18 0.00 0.00 0.00 0.00 46.02 46.25 3hb3 n GLY 419 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hb3 h ALA 420 N 1.00 1.92 0.07 4.61 0.00 -1.27 -0.74 119.26 124.85 3hb3 h ALA 420 Ca 0.00 -0.01 -0.32 0.00 0.00 0.00 0.00 54.91 54.58 3hb3 h ALA 420 Cb 0.00 0.02 -0.03 0.00 0.00 0.00 0.00 17.79 17.78 3hb3 h ALA 420 CO 0.00 -0.68 -1.77 0.28 0.00 0.00 0.00 179.25 177.08 3hb3 h VAL 421 N 0.00 0.84 -0.70 0.00 2.07 -1.75 -2.10 116.25 114.60 3hb3 h VAL 421 Ca 0.14 -2.60 0.12 0.00 0.82 0.00 0.00 66.70 65.18 3hb3 h VAL 421 Cb 1.20 2.52 -0.05 0.00 -1.52 0.00 0.00 31.29 33.44 3hb3 h VAL 421 CO -0.00 0.70 0.47 -0.26 0.02 0.00 0.00 177.57 178.50 3hb3 h PHE 422 N 0.04 0.53 -0.26 1.57 -1.00 -1.38 -0.45 116.94 115.98 3hb3 h PHE 422 Ca -0.32 0.01 -0.01 0.00 2.81 0.00 0.00 57.97 60.47 3hb3 h PHE 422 Cb 2.02 -0.17 -0.01 0.00 3.61 0.00 0.00 35.95 41.39 3hb3 h PHE 422 CO 0.04 0.23 0.14 0.78 -1.61 0.00 0.00 178.31 177.89 3hb3 h GLY 423 N 0.48 0.40 0.92 -1.45 0.00 -1.33 0.01 103.07 102.09 3hb3 h GLY 423 Ca 0.33 -0.19 -0.02 0.00 0.00 0.00 0.00 47.33 47.46 3hb3 h GLY 423 CO -0.11 0.18 0.12 -2.22 0.00 0.00 0.00 176.54 174.52 3hb3 h ILE 424 N 0.31 1.18 -0.11 2.60 2.04 -0.57 0.12 117.51 123.07 3hb3 h ILE 424 Ca 0.09 -0.56 -0.17 0.00 1.00 0.00 0.00 64.86 65.23 3hb3 h ILE 424 Cb 0.09 0.97 -0.01 0.00 -0.74 0.00 0.00 36.82 37.13 3hb3 h ILE 424 CO -0.01 0.19 -0.63 -0.26 0.00 0.00 0.00 178.15 177.44 3hb3 h PHE 425 N 0.36 0.53 0.04 1.37 0.04 -1.02 -0.63 116.94 117.64 3hb3 h PHE 425 Ca 0.10 -0.21 0.02 0.00 2.80 0.00 0.00 57.97 60.69 3hb3 h PHE 425 Cb 0.19 -0.09 -0.05 0.00 2.20 0.00 0.00 35.95 38.19 3hb3 h PHE 425 CO -0.00 0.93 -0.47 0.00 -0.60 0.00 0.00 178.31 178.17 3hb3 h ALA 426 N 1.02 -0.80 -0.93 2.45 0.00 -0.74 0.29 119.26 120.54 3hb3 h ALA 426 Ca -0.01 -0.07 0.23 0.00 0.00 0.00 0.00 54.91 55.06 3hb3 h ALA 426 Cb 1.18 0.81 -0.12 0.00 0.00 0.00 0.00 17.79 19.66 3hb3 h ALA 426 CO 0.11 -1.03 0.47 0.78 0.00 0.00 0.00 179.25 179.58 3hb3 h GLY 427 N -0.64 1.67 0.36 0.00 0.00 -0.53 -2.18 103.07 101.74 3hb3 h GLY 427 Ca 0.03 -0.22 -0.01 0.00 0.00 0.00 0.00 47.33 47.13 3hb3 h GLY 427 CO -0.31 -0.26 -0.11 -2.08 0.00 0.00 0.00 176.54 173.78 3hb3 h VAL 428 N 0.46 0.55 -0.12 4.60 2.07 -0.36 -1.22 116.25 122.23 3hb3 h VAL 428 Ca 0.59 -0.96 0.04 0.00 0.82 0.00 0.00 66.70 67.19 3hb3 h VAL 428 Cb 1.12 0.92 -0.00 0.00 -1.52 0.00 0.00 31.29 31.81 3hb3 h VAL 428 CO -0.51 0.14 0.17 1.88 0.02 0.00 0.00 177.57 179.28 3hb3 h TYR 429 N -0.96 0.00 0.02 1.57 0.05 -0.89 -2.69 116.97 114.08 3hb3 h TYR 429 Ca -0.03 0.00 -0.04 0.00 0.05 0.00 0.00 58.73 58.71 3hb3 h TYR 429 Cb 0.47 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.21 3hb3 h TYR 429 CO 0.05 0.00 -0.19 -0.92 -1.05 0.00 0.00 178.16 176.06 3hb3 h TYR 430 N 0.00 0.09 -0.55 4.88 3.20 -1.11 -3.37 116.97 120.11 3hb3 h TYR 430 Ca 0.06 -0.06 0.00 0.00 3.14 0.00 0.00 58.73 61.87 3hb3 h TYR 430 Cb 0.41 -0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.67 3hb3 h TYR 430 CO 0.00 1.07 0.00 0.91 -1.64 0.00 0.00 178.16 178.50 3hb3 n TRP 431 N -4.52 0.73 -0.01 -3.82 8.01 -0.48 -4.65 117.44 112.69 3hb3 n TRP 431 Ca -0.12 -0.43 -0.12 0.00 -1.31 0.00 0.00 57.50 55.52 3hb3 n TRP 431 Cb 0.54 -0.01 -0.10 0.00 -2.01 0.00 0.00 31.31 29.74 3hb3 n TRP 431 CO 0.00 0.00 0.00 0.97 -1.01 0.00 0.00 177.69 177.65 3hb3 h ILE 432 N 3.75 1.31 -0.59 -0.99 2.10 -1.65 -0.21 117.51 121.23 3hb3 h ILE 432 Ca 0.00 -1.50 0.09 0.00 1.08 0.00 0.00 64.86 64.54 3hb3 h ILE 432 Cb 0.91 2.26 -0.10 0.00 -1.09 0.00 0.00 36.82 38.80 3hb3 h ILE 432 CO 0.00 0.36 -0.22 0.61 -1.08 0.00 0.00 178.15 177.82 3hb3 n GLY 433 N 0.79 -1.18 0.21 8.18 0.00 -0.79 0.60 105.19 113.01 3hb3 n GLY 433 Ca -0.08 0.65 -0.11 0.00 0.00 0.00 0.00 46.02 46.48 3hb3 n GLY 433 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 3hb3 h LYS 434 N 0.00 0.60 0.00 1.61 1.63 -1.72 0.17 116.57 118.87 3hb3 h LYS 434 Ca 0.21 -0.41 -0.22 0.00 -0.85 0.00 0.00 60.65 59.38 3hb3 h LYS 434 Cb 0.36 0.06 -0.03 0.00 -0.60 0.00 0.00 32.23 32.02 3hb3 h LYS 434 CO -0.58 1.03 -1.11 0.52 -3.45 0.00 0.00 179.45 175.86 3hb3 h MET 435 N 0.45 0.00 0.00 1.90 2.86 0.65 -3.33 114.93 117.46 3hb3 h MET 435 Ca -0.01 0.00 -0.03 0.00 -2.06 0.00 0.00 59.70 57.60 3hb3 h MET 435 Cb 1.18 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.83 3hb3 h MET 435 CO 0.12 0.84 -1.50 -1.13 1.06 0.00 0.00 176.91 176.29 3hb3 n SER 436 N -3.27 2.65 0.00 1.22 3.41 0.20 -4.67 113.62 113.17 3hb3 n SER 436 Ca -0.03 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.58 3hb3 n SER 436 Cb 0.94 1.34 0.00 0.00 -0.26 0.00 0.00 64.21 66.23 3hb3 n SER 436 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3hb3 n GLY 437 N 2.01 1.06 3.23 5.00 0.00 0.58 -4.66 105.19 112.40 3hb3 n GLY 437 Ca -0.04 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.85 3hb3 n GLY 437 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 3hb3 s ARG 438 N -0.64 1.09 -0.03 1.61 3.03 -1.25 0.40 118.95 123.16 3hb3 s ARG 438 Ca 0.00 -1.53 0.06 0.00 2.03 0.00 0.00 55.73 56.29 3hb3 s ARG 438 Cb 0.00 -0.16 -0.01 0.00 -1.03 0.00 0.00 34.95 33.75 3hb3 s ARG 438 CO 0.00 -0.17 -0.21 -1.14 -1.13 0.00 0.00 175.30 172.65 3hb3 s GLN 439 N -3.95 1.84 0.71 3.89 2.00 -0.99 -1.88 119.66 121.28 3hb3 s GLN 439 Ca 0.25 -0.75 -0.13 0.00 -2.00 0.00 0.00 55.36 52.72 3hb3 s GLN 439 Cb 0.06 -1.71 0.03 0.00 0.80 0.00 0.00 33.01 32.19 3hb3 s GLN 439 CO 0.04 0.41 1.11 1.52 -0.50 0.00 0.00 175.29 177.88 3hb3 s TYR 440 N -0.37 2.51 -0.03 1.67 -0.85 -1.26 -3.68 117.35 115.34 3hb3 s TYR 440 Ca 0.05 1.57 -0.30 0.00 -0.52 0.00 0.00 57.07 57.87 3hb3 s TYR 440 Cb -0.09 -3.16 -0.03 0.00 0.38 0.00 0.00 41.96 39.05 3hb3 s TYR 440 CO 0.00 -1.86 1.09 -2.14 -1.52 0.00 0.00 175.55 171.12 3hb3 s PRO 441 N -4.37 4.44 0.19 -3.49 0.02 -1.26 -4.95 135.00 125.58 3hb3 s PRO 441 Ca 0.66 1.54 -0.11 0.00 0.02 0.00 0.00 61.00 63.11 3hb3 s PRO 441 Cb -0.20 -3.49 0.10 0.00 0.02 0.00 0.00 34.50 30.94 3hb3 s PRO 441 CO 0.47 -0.27 1.79 1.49 -0.33 0.00 0.00 177.00 180.16 3hb3 h GLU 442 N 7.05 0.92 0.00 5.54 4.57 -2.00 -0.91 114.58 129.76 3hb3 h GLU 442 Ca -0.37 -0.12 -0.05 0.00 -1.18 0.00 0.00 59.36 57.65 3hb3 h GLU 442 Cb 1.18 -0.18 -0.01 0.00 -0.16 0.00 0.00 28.75 29.59 3hb3 h GLU 442 CO 0.82 0.71 -0.23 0.11 -1.18 0.00 0.00 179.01 179.24 3hb3 h TRP 443 N 0.89 0.00 0.25 0.92 5.08 -2.00 -2.11 115.95 118.98 3hb3 h TRP 443 Ca 0.23 0.00 -0.01 0.00 1.08 0.00 0.00 58.89 60.19 3hb3 h TRP 443 Cb 0.07 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.23 3hb3 h TRP 443 CO -0.00 0.23 -0.12 0.00 -1.28 0.00 0.00 178.44 177.27 3hb3 h ALA 444 N 1.77 -0.34 -1.40 0.11 0.00 -1.60 -2.31 119.26 115.50 3hb3 h ALA 444 Ca -0.00 -0.20 0.45 0.00 0.00 0.00 0.00 54.91 55.16 3hb3 h ALA 444 Cb 0.49 0.13 -0.12 0.00 0.00 0.00 0.00 17.79 18.29 3hb3 h ALA 444 CO 0.03 -0.41 0.92 0.78 0.00 0.00 0.00 179.25 180.57 3hb3 h GLY 445 N -0.89 1.07 0.34 0.00 0.00 -1.23 -0.81 103.07 101.57 3hb3 h GLY 445 Ca -0.03 -0.09 -0.13 0.00 0.00 0.00 0.00 47.33 47.07 3hb3 h GLY 445 CO 0.06 -0.33 -0.64 1.46 0.00 0.00 0.00 176.54 177.09 3hb3 h GLN 446 N 0.07 0.15 -0.84 4.80 4.20 -1.09 -1.84 115.11 120.56 3hb3 h GLN 446 Ca 0.82 -0.26 0.21 0.00 0.06 0.00 0.00 58.65 59.49 3hb3 h GLN 446 Cb 2.71 0.10 -0.13 0.00 0.30 0.00 0.00 27.48 30.45 3hb3 h GLN 446 CO -0.35 1.12 0.20 1.25 -0.67 0.00 0.00 178.83 180.39 3hb3 h LEU 447 N -0.66 -0.03 -0.79 1.46 5.85 -1.13 -1.76 115.31 118.25 3hb3 h LEU 447 Ca -0.13 0.18 0.01 0.00 0.84 0.00 0.00 57.88 58.78 3hb3 h LEU 447 Cb 1.39 0.26 -0.04 0.00 0.37 0.00 0.00 40.66 42.63 3hb3 h LEU 447 CO 0.05 -0.13 0.52 -0.74 -0.34 0.00 0.00 178.44 177.80 3hb3 h HIS 448 N 0.22 1.00 0.24 1.25 2.76 -1.10 0.17 115.15 119.68 3hb3 h HIS 448 Ca 0.51 0.02 -0.01 0.00 -2.20 0.00 0.00 60.37 58.69 3hb3 h HIS 448 Cb 0.98 -0.34 0.00 0.00 1.55 0.00 0.00 27.41 29.60 3hb3 h HIS 448 CO -0.28 0.63 -0.11 0.35 -1.30 0.00 0.00 177.93 177.22 3hb3 h PHE 449 N 1.07 -0.29 -0.20 5.26 3.57 -0.87 -1.42 116.94 124.06 3hb3 h PHE 449 Ca 0.29 -0.01 -0.08 0.00 3.53 0.00 0.00 57.97 61.71 3hb3 h PHE 449 Cb -0.12 0.10 -0.01 0.00 2.79 0.00 0.00 35.95 38.70 3hb3 h PHE 449 CO -0.02 -0.02 -0.21 -1.49 -2.23 0.00 0.00 178.31 174.34 3hb3 h TRP 450 N -0.55 0.38 -0.05 0.41 4.06 -1.06 -1.74 115.95 117.41 3hb3 h TRP 450 Ca -0.03 -0.07 -0.01 0.00 2.06 0.00 0.00 58.89 60.84 3hb3 h TRP 450 Cb 0.40 -0.10 -0.00 0.00 -1.00 0.00 0.00 29.16 28.46 3hb3 h TRP 450 CO 0.00 0.55 0.00 0.52 -3.56 0.00 0.00 178.44 175.95 3hb3 h MET 451 N 0.32 0.08 0.00 0.49 2.86 -0.87 -1.63 114.93 116.19 3hb3 h MET 451 Ca 0.05 -0.03 -0.04 0.00 -2.06 0.00 0.00 59.70 57.63 3hb3 h MET 451 Cb 0.56 -0.01 -0.01 0.00 0.06 0.00 0.00 31.60 32.20 3hb3 h MET 451 CO 0.04 0.36 -0.17 1.98 1.06 0.00 0.00 176.91 180.19 3hb3 h MET 452 N -0.21 0.00 0.14 1.72 1.85 -1.12 0.66 114.93 117.97 3hb3 h MET 452 Ca 0.01 0.00 -0.29 0.00 -0.61 0.00 0.00 59.70 58.81 3hb3 h MET 452 Cb 0.33 0.00 0.00 0.00 0.43 0.00 0.00 31.60 32.36 3hb3 h MET 452 CO 0.00 0.17 -1.48 0.35 -0.40 0.00 0.00 176.91 175.55 3hb3 h PHE 453 N 0.00 0.53 -0.07 1.39 3.57 -1.23 -1.99 116.94 119.14 3hb3 h PHE 453 Ca -0.00 -0.39 -0.06 0.00 3.53 0.00 0.00 57.97 61.05 3hb3 h PHE 453 Cb 0.35 -0.02 0.00 0.00 2.79 0.00 0.00 35.95 39.07 3hb3 h PHE 453 CO 0.00 1.58 -0.19 0.82 -2.23 0.00 0.00 178.31 178.29 3hb3 h ILE 454 N -0.19 1.42 -0.61 1.41 2.04 -1.09 -2.95 117.51 117.55 3hb3 h ILE 454 Ca -0.31 -1.55 0.05 0.00 1.00 0.00 0.00 64.86 64.05 3hb3 h ILE 454 Cb 1.85 2.26 -0.05 0.00 -0.74 0.00 0.00 36.82 40.14 3hb3 h ILE 454 CO 0.10 0.44 0.33 1.23 0.00 0.00 0.00 178.15 180.25 3hb3 h GLY 455 N -0.24 0.88 2.00 5.37 0.00 -0.98 -2.60 103.07 107.49 3hb3 h GLY 455 Ca -0.00 -0.23 -0.05 0.00 0.00 0.00 0.00 47.33 47.04 3hb3 h GLY 455 CO 0.04 0.15 -0.23 1.76 0.00 0.00 0.00 176.54 178.27 3hb3 h SER 456 N 0.63 0.00 0.67 0.19 0.02 -1.34 -1.57 113.55 112.15 3hb3 h SER 456 Ca 0.27 0.00 -0.27 0.00 -0.84 0.00 0.00 61.79 60.95 3hb3 h SER 456 Cb 0.15 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 62.66 3hb3 h SER 456 CO -0.16 0.23 -1.37 0.78 -1.14 0.00 0.00 176.83 175.16 3hb3 h ASN 457 N 0.00 0.15 0.18 3.07 2.35 -1.34 -2.53 115.58 117.46 3hb3 h ASN 457 Ca -0.00 -0.21 -0.09 0.00 -0.55 0.00 0.00 56.30 55.45 3hb3 h ASN 457 Cb 0.74 -0.05 -0.01 0.00 0.05 0.00 0.00 38.32 39.05 3hb3 h ASN 457 CO 0.03 1.17 -0.32 -0.07 -1.65 0.00 0.00 177.43 176.59 3hb3 h LEU 458 N 0.03 0.22 0.55 1.61 3.38 -1.04 0.93 115.31 120.99 3hb3 h LEU 458 Ca -0.16 -0.08 -0.03 0.00 0.09 0.00 0.00 57.88 57.70 3hb3 h LEU 458 Cb 1.92 -0.06 0.01 0.00 0.09 0.00 0.00 40.66 42.62 3hb3 h LEU 458 CO 0.13 0.54 -0.26 0.40 0.09 0.00 0.00 178.44 179.34 3hb3 h ILE 459 N 0.19 0.00 0.00 1.22 2.04 -1.25 -3.30 117.51 116.41 3hb3 h ILE 459 Ca 0.03 -0.39 -0.24 0.00 1.00 0.00 0.00 64.86 65.26 3hb3 h ILE 459 Cb 0.67 0.00 -0.04 0.00 -0.74 0.00 0.00 36.82 36.71 3hb3 h ILE 459 CO 0.05 0.00 -1.47 -0.26 0.00 0.00 0.00 178.15 176.47 3hb3 h PHE 460 N -1.12 0.00 -0.23 1.37 0.04 -1.45 -3.37 116.94 112.18 3hb3 h PHE 460 Ca -0.08 0.00 0.01 0.00 2.80 0.00 0.00 57.97 60.71 3hb3 h PHE 460 Cb 0.56 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 38.70 3hb3 h PHE 460 CO 0.01 0.87 0.13 0.35 -0.60 0.00 0.00 178.31 179.07 3hb3 h PHE 461 N 0.00 0.24 -0.06 -0.55 3.57 -1.02 -1.05 116.94 118.07 3hb3 h PHE 461 Ca -0.20 0.01 0.02 0.00 3.53 0.00 0.00 57.97 61.32 3hb3 h PHE 461 Cb 1.84 -0.07 -0.00 0.00 2.79 0.00 0.00 35.95 40.51 3hb3 h PHE 461 CO 0.00 0.14 0.10 -1.35 -2.23 0.00 0.00 178.31 174.97 3hb3 h PRO 462 N 0.26 0.00 0.00 6.41 0.11 -1.75 -2.19 132.00 134.85 3hb3 h PRO 462 Ca 0.09 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.20 3hb3 h PRO 462 Cb 0.01 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.12 3hb3 h PRO 462 CO -0.05 0.00 0.00 1.04 -0.21 0.00 0.00 178.00 178.78 3hb3 n GLN 463 N -3.51 0.03 -0.07 1.05 6.02 -0.40 -1.52 117.38 118.97 3hb3 n GLN 463 Ca -0.01 0.33 -0.20 0.00 -0.01 0.00 0.00 57.00 57.11 3hb3 n GLN 463 Cb 0.19 -1.50 -0.12 0.00 1.02 0.00 0.00 30.24 29.83 3hb3 n GLN 463 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.06 176.50 3hb3 h HIS 464 N 0.00 0.09 -0.38 1.08 3.86 -1.51 -2.63 115.15 115.65 3hb3 h HIS 464 Ca 0.00 -0.06 0.08 0.00 -1.16 0.00 0.00 60.37 59.22 3hb3 h HIS 464 Cb 0.05 -0.00 -0.09 0.00 1.06 0.00 0.00 27.41 28.42 3hb3 h HIS 464 CO 0.00 1.38 -0.34 0.74 0.86 0.00 0.00 177.93 180.57 3hb3 h PHE 465 N -0.86 -0.94 -0.30 2.45 0.04 -1.42 -0.74 116.94 115.16 3hb3 h PHE 465 Ca -0.25 0.06 0.06 0.00 2.80 0.00 0.00 57.97 60.64 3hb3 h PHE 465 Cb 1.32 0.47 -0.06 0.00 2.20 0.00 0.00 35.95 39.88 3hb3 h PHE 465 CO 0.15 -0.39 -0.08 -0.07 -0.60 0.00 0.00 178.31 177.32 3hb3 h LEU 466 N -0.27 -0.29 -1.05 1.54 3.38 -1.51 0.42 115.31 117.53 3hb3 h LEU 466 Ca 0.16 0.09 -0.09 0.00 0.09 0.00 0.00 57.88 58.13 3hb3 h LEU 466 Cb 0.55 0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.47 3hb3 h LEU 466 CO -0.53 -0.10 -0.32 1.23 0.09 0.00 0.00 178.44 178.81 3hb3 h GLY 467 N -0.00 0.30 1.37 0.83 0.00 -1.37 -1.54 103.07 102.65 3hb3 h GLY 467 Ca 0.15 -0.25 -0.19 0.00 0.00 0.00 0.00 47.33 47.04 3hb3 h GLY 467 CO -0.32 0.23 -0.65 3.21 0.00 0.00 0.00 176.54 179.01 3hb3 h ARG 468 N 0.24 0.64 0.00 4.80 3.08 0.29 -2.16 114.38 121.27 3hb3 h ARG 468 Ca 0.03 -0.46 0.00 0.00 0.07 0.00 0.00 59.98 59.62 3hb3 h ARG 468 Cb 0.69 0.08 0.00 0.00 0.08 0.00 0.00 29.97 30.82 3hb3 h ARG 468 CO 0.05 1.08 0.00 1.04 -1.07 0.00 0.00 179.97 181.07 3hb3 n GLN 469 N -3.93 0.60 0.00 0.04 1.13 -0.00 -4.91 117.38 110.31 3hb3 n GLN 469 Ca -0.05 0.01 0.00 0.00 -1.94 0.00 0.00 57.00 55.02 3hb3 n GLN 469 Cb 0.67 -1.50 0.00 0.00 0.11 0.00 0.00 30.24 29.52 3hb3 n GLN 469 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3hb3 n GLY 470 N 1.10 1.15 3.62 1.08 0.00 -0.81 -5.06 105.19 106.26 3hb3 n GLY 470 Ca 0.17 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.76 3hb3 n GLY 470 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 3hb3 s MET 471 N -0.62 3.57 1.08 1.61 0.00 -0.64 -4.99 119.30 119.30 3hb3 s MET 471 Ca 0.00 1.62 -0.14 0.00 0.00 0.00 0.00 55.69 57.17 3hb3 s MET 471 Cb 0.00 -4.13 0.23 0.00 0.00 0.00 0.00 34.83 30.93 3hb3 s MET 471 CO 0.00 -1.58 1.09 -2.14 0.00 0.00 0.00 175.02 172.39 3hb3 s PRO 472 N 5.21 -0.23 0.37 4.11 0.02 -1.26 -2.29 135.00 140.92 3hb3 s PRO 472 Ca 0.78 0.37 0.03 0.00 0.02 0.00 0.00 61.00 62.20 3hb3 s PRO 472 Cb -0.25 -1.67 -0.01 0.00 0.02 0.00 0.00 34.50 32.58 3hb3 s PRO 472 CO 0.32 -3.14 0.54 -0.98 -0.33 0.00 0.00 177.00 173.41 3hb3 s ARG 473 N -5.03 3.21 0.00 5.54 1.70 -0.16 -4.48 118.95 119.73 3hb3 s ARG 473 Ca 0.67 -0.66 0.00 0.00 -0.47 0.00 0.00 55.73 55.27 3hb3 s ARG 473 Cb -0.17 -2.71 0.00 0.00 -0.57 0.00 0.00 34.95 31.50 3hb3 s ARG 473 CO 0.58 0.01 0.00 0.54 -1.08 0.00 0.00 175.30 175.35 3hb3 n ARG 474 N -1.79 0.00 -3.97 3.89 1.74 -1.26 -4.99 116.66 110.27 3hb3 n ARG 474 Ca -0.02 0.12 -0.35 0.00 -0.77 0.00 0.00 57.85 56.83 3hb3 n ARG 474 Cb 0.57 -3.27 -0.12 0.00 -1.02 0.00 0.00 32.46 28.62 3hb3 n ARG 474 CO 0.00 0.00 0.00 0.71 -1.52 0.00 0.00 177.63 176.82 3hb3 s TYR 475 N -2.00 3.06 0.52 -1.55 1.51 -1.26 -4.94 117.35 112.68 3hb3 s TYR 475 Ca 0.00 -0.44 0.19 0.00 -1.01 0.00 0.00 57.07 55.81 3hb3 s TYR 475 Cb 0.00 -2.13 1.29 0.00 -0.11 0.00 0.00 41.96 41.01 3hb3 s TYR 475 CO 0.00 -0.26 2.07 0.97 -1.11 0.00 0.00 175.55 177.22 3hb3 h ILE 476 N 5.41 0.89 -3.38 2.71 2.10 -1.95 -3.46 117.51 119.83 3hb3 h ILE 476 Ca -0.37 -0.02 -0.02 0.00 1.08 0.00 0.00 64.86 65.53 3hb3 h ILE 476 Cb 1.18 0.84 -0.09 0.00 -1.09 0.00 0.00 36.82 37.65 3hb3 h ILE 476 CO 0.61 0.01 -0.00 -0.62 -1.08 0.00 0.00 178.15 177.06 3hb3 s ASP 477 N -6.66 -0.21 0.09 2.19 2.15 -1.26 -4.81 116.67 108.17 3hb3 s ASP 477 Ca -0.05 -0.61 -0.23 0.00 0.43 0.00 0.00 52.55 52.09 3hb3 s ASP 477 Cb 0.18 0.59 0.06 0.00 -0.30 0.00 0.00 42.92 43.45 3hb3 s ASP 477 CO 0.70 -1.09 0.56 -0.72 -0.17 0.00 0.00 175.17 174.45 3hb3 s TYR 478 N -3.91 -0.47 0.52 -5.34 -0.85 -1.26 -5.05 117.35 100.98 3hb3 s TYR 478 Ca 0.12 0.41 -0.19 0.00 -0.52 0.00 0.00 57.07 56.89 3hb3 s TYR 478 Cb -0.01 0.43 -0.10 0.00 0.38 0.00 0.00 41.96 42.66 3hb3 s TYR 478 CO 0.01 -0.73 0.51 -2.30 -1.52 0.00 0.00 175.55 171.51 3hb3 n PRO 479 N 0.05 0.53 0.00 -3.49 -0.02 -1.26 -4.68 135.00 126.14 3hb3 n PRO 479 Ca -0.18 0.20 0.09 0.00 -2.02 0.00 0.00 63.50 61.59 3hb3 n PRO 479 Cb 0.62 -1.62 0.42 0.00 -0.02 0.00 0.00 33.50 32.90 3hb3 n PRO 479 CO 0.00 0.00 0.00 1.33 1.98 0.00 0.00 175.50 178.81 3hb3 n VAL 480 N -1.42 0.58 0.12 -1.45 0.24 -1.26 -2.38 118.33 112.75 3hb3 n VAL 480 Ca 0.11 0.14 0.00 0.00 -2.04 0.00 0.00 64.34 62.56 3hb3 n VAL 480 Cb 0.45 -0.85 -0.01 0.00 -1.47 0.00 0.00 33.84 31.96 3hb3 n VAL 480 CO 0.00 0.00 0.00 -0.33 -2.14 0.00 0.00 176.83 174.36 3hb3 h GLU 481 N 0.00 0.00 -0.17 7.34 3.07 -2.04 -2.48 114.58 120.30 3hb3 h GLU 481 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 3hb3 h GLU 481 Cb 0.20 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.11 3hb3 h GLU 481 CO 0.00 0.60 0.00 1.19 -1.40 0.00 0.00 179.01 179.40 3hb3 n PHE 482 N -3.24 0.00 -0.08 4.33 3.72 -1.00 -4.62 117.46 116.57 3hb3 n PHE 482 Ca 0.01 0.00 -0.15 0.00 -0.05 0.00 0.00 57.45 57.26 3hb3 n PHE 482 Cb 0.79 -0.02 -0.11 0.00 -0.94 0.00 0.00 39.48 39.20 3hb3 n PHE 482 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3hb3 h ALA 483 N 1.39 0.09 -0.85 4.37 0.00 -1.64 -3.10 119.26 119.51 3hb3 h ALA 483 Ca 0.00 -0.69 0.08 0.00 0.00 0.00 0.00 54.91 54.30 3hb3 h ALA 483 Cb 0.09 0.26 -0.11 0.00 0.00 0.00 0.00 17.79 18.03 3hb3 h ALA 483 CO 0.00 0.25 -0.48 0.98 0.00 0.00 0.00 179.25 180.00 3hb3 n TYR 484 N -4.57 -0.32 0.16 0.00 9.36 -1.26 -0.82 117.16 119.72 3hb3 n TYR 484 Ca -0.16 1.06 0.03 0.00 3.32 0.00 0.00 57.90 62.15 3hb3 n TYR 484 Cb 0.50 -0.60 0.24 0.00 -0.63 0.00 0.00 39.34 38.85 3hb3 n TYR 484 CO 0.00 0.00 0.00 -1.49 0.22 0.00 0.00 176.86 175.59 3hb3 h TRP 485 N 0.00 0.00 0.00 2.98 -0.00 -1.90 -2.99 115.95 114.04 3hb3 h TRP 485 Ca 0.16 0.00 -0.11 0.00 -0.00 0.00 0.00 58.89 58.94 3hb3 h TRP 485 Cb 0.37 0.00 -0.02 0.00 -0.00 0.00 0.00 29.16 29.51 3hb3 h TRP 485 CO -0.86 0.48 -0.53 -0.91 -0.00 0.00 0.00 178.44 176.62 3hb3 h ASN 486 N 0.00 0.00 0.70 -3.49 4.21 -1.25 -0.90 115.58 114.85 3hb3 h ASN 486 Ca -0.00 0.00 -0.03 0.00 1.21 0.00 0.00 56.30 57.47 3hb3 h ASN 486 Cb 1.04 0.00 0.01 0.00 -1.12 0.00 0.00 38.32 38.25 3hb3 h ASN 486 CO 0.06 0.53 -0.34 -1.13 -1.29 0.00 0.00 177.43 175.27 3hb3 h ASN 487 N 0.00 -0.79 -0.30 5.81 -1.24 -0.83 -2.31 115.58 115.92 3hb3 h ASN 487 Ca -0.01 0.00 0.06 0.00 0.71 0.00 0.00 56.30 57.06 3hb3 h ASN 487 Cb 1.13 0.21 -0.05 0.00 0.73 0.00 0.00 38.32 40.33 3hb3 h ASN 487 CO 0.07 -0.50 -0.06 0.40 -1.29 0.00 0.00 177.43 176.05 3hb3 h ILE 488 N -1.06 0.72 0.00 2.57 1.08 -1.56 -1.75 117.51 117.51 3hb3 h ILE 488 Ca -0.10 -0.01 -0.01 0.00 -0.39 0.00 0.00 64.86 64.36 3hb3 h ILE 488 Cb 0.75 0.70 -0.00 0.00 -3.07 0.00 0.00 36.82 35.20 3hb3 h ILE 488 CO 0.16 0.00 -0.03 -1.28 -0.69 0.00 0.00 178.15 176.31 3hb3 h SER 489 N 0.01 0.00 0.29 1.72 0.87 -1.15 -1.39 113.55 113.90 3hb3 h SER 489 Ca 0.14 0.00 -0.30 0.00 -1.23 0.00 0.00 61.79 60.40 3hb3 h SER 489 Cb 0.21 0.00 0.03 0.00 -0.44 0.00 0.00 62.40 62.20 3hb3 h SER 489 CO -0.29 0.03 -1.31 0.28 -0.53 0.00 0.00 176.83 175.01 3hb3 h SER 490 N 0.00 0.76 0.87 6.23 0.02 -0.78 -2.92 113.55 117.73 3hb3 h SER 490 Ca -0.00 -0.75 -0.04 0.00 -0.84 0.00 0.00 61.79 60.16 3hb3 h SER 490 Cb 0.05 -0.24 0.00 0.00 0.14 0.00 0.00 62.40 62.35 3hb3 h SER 490 CO 0.00 1.57 -0.47 0.40 -1.14 0.00 0.00 176.83 177.19 3hb3 h ILE 491 N 0.19 0.00 -0.32 3.27 2.04 -0.45 0.60 117.51 122.83 3hb3 h ILE 491 Ca -0.19 0.00 0.12 0.00 1.00 0.00 0.00 64.86 65.78 3hb3 h ILE 491 Cb 1.99 0.00 -0.06 0.00 -0.74 0.00 0.00 36.82 38.01 3hb3 h ILE 491 CO 0.24 0.00 0.10 0.61 0.00 0.00 0.00 178.15 179.11 3hb3 n GLY 492 N -1.63 -0.32 0.22 5.37 0.00 -0.70 0.27 105.19 108.41 3hb3 n GLY 492 Ca -0.15 0.28 0.11 0.00 0.00 0.00 0.00 46.02 46.26 3hb3 n GLY 492 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hb3 h ALA 493 N 0.65 0.98 0.00 4.61 0.00 -0.68 -1.67 119.26 123.15 3hb3 h ALA 493 Ca 0.24 -0.17 -0.04 0.00 0.00 0.00 0.00 54.91 54.94 3hb3 h ALA 493 Cb 0.59 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.35 3hb3 h ALA 493 CO -0.27 0.23 -0.25 1.88 0.00 0.00 0.00 179.25 180.84 3hb3 h TYR 494 N 0.00 0.00 -0.88 0.00 0.05 0.43 -2.54 116.97 114.04 3hb3 h TYR 494 Ca -0.00 0.00 0.18 0.00 0.05 0.00 0.00 58.73 58.95 3hb3 h TYR 494 Cb 0.79 0.00 -0.17 0.00 1.01 0.00 0.00 36.73 38.36 3hb3 h TYR 494 CO 0.00 0.93 -0.21 0.82 -1.05 0.00 0.00 178.16 178.65 3hb3 h ILE 495 N -1.00 0.12 0.00 -2.88 2.04 -1.31 0.23 117.51 114.72 3hb3 h ILE 495 Ca -0.06 -0.00 -0.07 0.00 1.00 0.00 0.00 64.86 65.72 3hb3 h ILE 495 Cb 0.92 0.12 -0.01 0.00 -0.74 0.00 0.00 36.82 37.11 3hb3 h ILE 495 CO -0.04 0.00 -0.34 0.77 0.00 0.00 0.00 178.15 178.54 3hb3 h SER 496 N 0.00 0.00 -0.11 1.72 4.64 -1.33 -2.34 113.55 116.14 3hb3 h SER 496 Ca 0.42 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 61.68 3hb3 h SER 496 Cb 0.65 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.74 3hb3 h SER 496 CO -0.90 0.34 -0.16 0.15 -0.87 0.00 0.00 176.83 175.38 3hb3 h PHE 497 N 0.00 0.37 -0.46 4.77 3.57 -0.55 -2.35 116.94 122.30 3hb3 h PHE 497 Ca -0.00 -0.13 0.09 0.00 3.53 0.00 0.00 57.97 61.46 3hb3 h PHE 497 Cb 0.90 -0.07 -0.10 0.00 2.79 0.00 0.00 35.95 39.47 3hb3 h PHE 497 CO 0.00 0.76 -0.26 0.00 -2.23 0.00 0.00 178.31 176.59 3hb3 h ALA 498 N 0.55 0.03 -0.02 2.41 0.00 -1.13 0.03 119.26 121.13 3hb3 h ALA 498 Ca 0.01 0.15 0.01 0.00 0.00 0.00 0.00 54.91 55.07 3hb3 h ALA 498 Cb 0.73 0.60 -0.00 0.00 0.00 0.00 0.00 17.79 19.12 3hb3 h ALA 498 CO 0.04 -0.61 0.02 0.66 0.00 0.00 0.00 179.25 179.35 3hb3 h SER 499 N -0.16 0.00 0.66 0.00 4.64 -1.35 -1.21 113.55 116.13 3hb3 h SER 499 Ca 0.21 0.00 -0.19 0.00 -0.47 0.00 0.00 61.79 61.34 3hb3 h SER 499 Cb 0.49 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.55 3hb3 h SER 499 CO -0.56 0.00 -1.47 0.33 -0.87 0.00 0.00 176.83 174.26 3hb3 n PHE 500 N -4.27 1.00 -0.01 4.77 7.35 -0.08 -1.54 117.46 124.68 3hb3 n PHE 500 Ca -0.03 0.34 -0.13 0.00 -0.76 0.00 0.00 57.45 56.88 3hb3 n PHE 500 Cb 0.11 -1.11 -0.10 0.00 0.35 0.00 0.00 39.48 38.73 3hb3 n PHE 500 CO 0.00 0.00 0.00 -0.07 -0.76 0.00 0.00 176.76 175.93 3hb3 h LEU 501 N 0.00 -0.05 -0.45 -2.13 3.38 -0.51 -2.04 115.31 113.51 3hb3 h LEU 501 Ca -0.19 -0.56 0.04 0.00 0.09 0.00 0.00 57.88 57.27 3hb3 h LEU 501 Cb 1.67 0.01 -0.05 0.00 0.09 0.00 0.00 40.66 42.38 3hb3 h LEU 501 CO 0.05 0.56 -0.27 0.33 0.09 0.00 0.00 178.44 179.21 3hb3 n PHE 502 N -4.82 -0.20 -0.30 1.13 7.35 -0.54 0.09 117.46 120.17 3hb3 n PHE 502 Ca -0.09 0.57 0.13 0.00 -0.76 0.00 0.00 57.45 57.30 3hb3 n PHE 502 Cb 0.30 -0.49 0.29 0.00 0.35 0.00 0.00 39.48 39.93 3hb3 n PHE 502 CO 0.00 0.00 0.00 0.35 -0.76 0.00 0.00 176.76 176.35 3hb3 h PHE 503 N 0.00 0.32 -0.18 -5.13 3.57 -1.15 0.22 116.94 114.60 3hb3 h PHE 503 Ca 0.07 0.05 -0.09 0.00 3.53 0.00 0.00 57.97 61.54 3hb3 h PHE 503 Cb 0.19 -0.00 -0.01 0.00 2.79 0.00 0.00 35.95 38.91 3hb3 h PHE 503 CO -0.61 -0.22 -0.27 0.82 -2.23 0.00 0.00 178.31 175.80 3hb3 h ILE 504 N 0.19 1.26 -0.48 1.41 2.04 0.40 0.16 117.51 122.49 3hb3 h ILE 504 Ca 0.55 -1.22 -0.06 0.00 1.00 0.00 0.00 64.86 65.13 3hb3 h ILE 504 Cb 1.11 1.42 -0.02 0.00 -0.74 0.00 0.00 36.82 38.59 3hb3 h ILE 504 CO -0.67 0.38 0.06 1.23 0.00 0.00 0.00 178.15 179.15 3hb3 h GLY 505 N 1.02 0.86 0.96 5.37 0.00 0.18 -0.94 103.07 110.51 3hb3 h GLY 505 Ca 0.04 -0.59 -0.01 0.00 0.00 0.00 0.00 47.33 46.78 3hb3 h GLY 505 CO 0.05 0.54 0.17 -2.22 0.00 0.00 0.00 176.54 175.08 3hb3 h ILE 506 N 0.66 1.13 -1.00 2.60 2.04 -0.41 0.23 117.51 122.77 3hb3 h ILE 506 Ca 0.14 -0.33 0.02 0.00 1.00 0.00 0.00 64.86 65.69 3hb3 h ILE 506 Cb 0.41 0.79 -0.05 0.00 -0.74 0.00 0.00 36.82 37.24 3hb3 h ILE 506 CO 0.01 0.13 0.66 0.58 0.00 0.00 0.00 178.15 179.53 3hb3 h VAL 507 N 0.38 1.23 -0.07 1.67 2.07 -0.60 -0.55 116.25 120.38 3hb3 h VAL 507 Ca 0.11 -0.45 -0.15 0.00 0.82 0.00 0.00 66.70 67.02 3hb3 h VAL 507 Cb 0.06 -0.21 0.01 0.00 -1.52 0.00 0.00 31.29 29.63 3hb3 h VAL 507 CO -0.02 0.24 -0.55 -0.26 0.02 0.00 0.00 177.57 177.00 3hb3 h PHE 508 N 1.32 0.70 -0.61 1.57 0.04 -0.33 -1.76 116.94 117.86 3hb3 h PHE 508 Ca 0.37 -0.33 0.04 0.00 2.80 0.00 0.00 57.97 60.85 3hb3 h PHE 508 Cb -0.11 -0.10 -0.04 0.00 2.20 0.00 0.00 35.95 37.90 3hb3 h PHE 508 CO -0.00 1.12 0.36 -0.92 -0.60 0.00 0.00 178.31 178.27 3hb3 h TYR 509 N 0.08 0.68 -0.17 -0.55 5.03 -0.94 -2.22 116.97 118.87 3hb3 h TYR 509 Ca -0.05 0.02 0.05 0.00 2.58 0.00 0.00 58.73 61.33 3hb3 h TYR 509 Cb 1.21 -0.22 -0.06 0.00 1.55 0.00 0.00 36.73 39.22 3hb3 h TYR 509 CO 0.12 0.37 -0.21 1.15 -1.32 0.00 0.00 178.16 178.27 3hb3 h THR 510 N 0.70 0.47 0.00 1.81 2.02 -0.95 0.75 112.91 117.72 3hb3 h THR 510 Ca 0.26 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.44 3hb3 h THR 510 Cb 0.07 0.47 0.00 0.00 -1.74 0.00 0.00 68.15 66.95 3hb3 h THR 510 CO -0.12 0.00 0.00 0.18 0.37 0.00 0.00 175.52 175.95 3hb3 n LEU 511 N -5.35 0.13 -0.00 2.58 4.77 -0.68 -1.29 117.00 117.17 3hb3 n LEU 511 Ca -0.02 0.52 0.02 0.00 -0.03 0.00 0.00 56.01 56.50 3hb3 n LEU 511 Cb 0.26 -0.49 -0.03 0.00 -2.33 0.00 0.00 43.42 40.83 3hb3 n LEU 511 CO 0.18 -0.16 -0.55 0.49 -1.33 0.00 0.00 177.39 176.02 3hb3 n PHE 512 N -1.63 0.00 -2.07 -1.77 3.72 -0.88 -4.80 117.46 110.03 3hb3 n PHE 512 Ca 0.05 0.00 -0.00 0.00 -0.05 0.00 0.00 57.45 57.45 3hb3 n PHE 512 Cb 0.27 -0.09 -0.01 0.00 -0.94 0.00 0.00 39.48 38.71 3hb3 n PHE 512 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3hb3 n ALA 513 N -1.65 2.25 -2.21 4.37 0.00 0.21 -5.07 120.51 118.40 3hb3 n ALA 513 Ca -0.01 -0.80 -0.36 0.00 0.00 0.00 0.00 53.44 52.27 3hb3 n ALA 513 Cb 0.12 -0.34 -0.06 0.00 0.00 0.00 0.00 19.45 19.17 3hb3 n ALA 513 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 3hb3 s GLY 514 N -0.78 2.59 -0.37 0.00 0.00 -0.41 -4.87 107.32 103.48 3hb3 s GLY 514 Ca 0.04 0.06 -0.45 0.00 0.00 0.00 0.00 44.72 44.37 3hb3 s GLY 514 CO -0.02 0.41 1.47 1.17 0.00 0.00 0.00 173.10 176.12 3hb3 n LYS 515 N 0.98 0.01 -2.07 2.90 3.00 -1.24 -4.44 118.16 117.30 3hb3 n LYS 515 Ca -0.05 0.00 -0.39 0.00 -0.00 0.00 0.00 58.31 57.87 3hb3 n LYS 515 Cb 0.51 -1.50 -0.00 0.00 0.00 0.00 0.00 35.03 34.03 3hb3 n LYS 515 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.40 178.43 3hb3 s ARG 516 N 2.25 3.88 -0.35 1.64 0.52 -1.26 -2.33 118.95 123.29 3hb3 s ARG 516 Ca 1.01 2.11 0.05 0.00 -0.52 0.00 0.00 55.73 58.38 3hb3 s ARG 516 Cb -1.44 -2.68 0.17 0.00 0.52 0.00 0.00 34.95 31.53 3hb3 s ARG 516 CO 0.76 -0.55 0.50 0.08 0.02 0.00 0.00 175.30 176.11 3hb3 s VAL 517 N -1.30 -0.72 -1.01 3.52 1.01 0.16 -4.91 120.40 117.14 3hb3 s VAL 517 Ca 0.59 -0.35 0.27 0.00 0.00 0.00 0.00 61.98 62.49 3hb3 s VAL 517 Cb -0.37 -0.59 0.10 0.00 0.00 0.00 0.00 36.38 35.52 3hb3 s VAL 517 CO 0.47 -0.23 1.62 -0.46 0.00 0.00 0.00 175.10 176.49 3hb3 n ASN 518 N 4.76 0.31 -4.72 3.32 2.04 -1.26 -4.64 115.26 115.08 3hb3 n ASN 518 Ca 0.07 0.03 -0.35 0.00 -0.44 0.00 0.00 54.58 53.89 3hb3 n ASN 518 Cb 0.51 -0.04 0.09 0.00 -2.53 0.00 0.00 39.78 37.82 3hb3 n ASN 518 CO 0.00 0.00 0.00 0.68 -0.44 0.00 0.00 177.26 177.50 3hb3 s VAL 519 N -2.99 2.16 0.49 3.53 -7.23 -1.26 -1.78 120.40 113.32 3hb3 s VAL 519 Ca 0.12 0.08 0.23 0.00 -1.81 0.00 0.00 61.98 60.60 3hb3 s VAL 519 Cb 0.18 -2.75 0.28 0.00 0.56 0.00 0.00 36.38 34.65 3hb3 s VAL 519 CO 0.63 -0.04 2.12 -0.65 -0.31 0.00 0.00 175.10 176.85 3hb3 h PRO 520 N -0.15 0.00 -2.26 4.82 0.11 -1.81 -3.31 132.00 129.39 3hb3 h PRO 520 Ca -0.48 0.00 -0.20 0.00 0.11 0.00 0.00 66.00 65.43 3hb3 h PRO 520 Cb 1.31 0.00 -0.32 0.00 0.11 0.00 0.00 31.00 32.10 3hb3 h PRO 520 CO 0.50 0.08 -0.52 1.21 -0.21 0.00 0.00 178.00 179.07 3hb3 s ASN 521 N -6.54 0.52 0.00 -2.05 3.84 -1.25 -4.42 114.94 105.04 3hb3 s ASN 521 Ca -0.04 0.23 0.11 0.00 0.21 0.00 0.00 52.86 53.37 3hb3 s ASN 521 Cb 0.15 0.88 0.29 0.00 -0.55 0.00 0.00 41.25 42.02 3hb3 s ASN 521 CO 0.62 -0.29 1.21 0.00 -2.79 0.00 0.00 177.10 175.85 3hb3 n TYR 522 N 5.35 0.42 0.00 0.43 4.11 -1.26 -4.71 117.16 121.50 3hb3 n TYR 522 Ca -0.05 -0.44 0.00 0.00 -0.00 0.00 0.00 57.90 57.41 3hb3 n TYR 522 Cb 0.50 -0.02 0.00 0.00 -0.00 0.00 0.00 39.34 39.82 3hb3 n TYR 522 CO 0.00 0.00 0.00 0.91 -0.00 0.00 0.00 176.86 177.77 3hb3 n TRP 523 N 0.56 0.00 0.00 -3.48 5.03 -1.26 -5.16 117.44 113.13 3hb3 n TRP 523 Ca 0.11 0.00 0.00 0.00 3.03 0.00 0.00 57.50 60.64 3hb3 n TRP 523 Cb 0.41 0.00 0.00 0.00 -1.03 0.00 0.00 31.31 30.69 3hb3 n TRP 523 CO 0.00 0.00 0.00 0.27 -0.03 0.00 0.00 177.69 177.93 3hb3 n ASN 524 N -1.18 0.00 0.13 -0.99 0.23 -1.26 -5.04 115.26 107.15 3hb3 n ASN 524 Ca 0.00 0.00 0.13 0.00 -0.53 0.00 0.00 54.58 54.18 3hb3 n ASN 524 Cb 0.00 0.00 0.33 0.00 -2.08 0.00 0.00 39.78 38.03 3hb3 n ASN 524 CO 0.00 0.00 0.00 1.05 -0.93 0.00 0.00 177.26 177.38 3hb3 h GLU 525 N 0.00 0.00 0.00 -3.83 9.09 -1.98 -1.64 114.58 116.21 3hb3 h GLU 525 Ca 0.00 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.41 3hb3 h GLU 525 Cb 0.00 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.10 3hb3 h GLU 525 CO 0.00 0.00 0.00 0.72 0.05 0.00 0.00 179.01 179.78 3hb3 n HIS 526 N -2.46 0.74 -2.04 2.06 8.25 -1.26 -4.13 115.22 116.38 3hb3 n HIS 526 Ca 0.05 0.24 -0.27 0.00 -0.26 0.00 0.00 57.72 57.48 3hb3 n HIS 526 Cb 0.46 -0.89 -0.05 0.00 1.12 0.00 0.00 29.99 30.62 3hb3 n HIS 526 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3hb3 s ALA 527 N -3.15 1.67 -0.09 -1.41 0.00 -0.62 -4.45 121.76 113.71 3hb3 s ALA 527 Ca 0.09 -1.47 0.13 0.00 0.00 0.00 0.00 51.96 50.71 3hb3 s ALA 527 Cb 0.12 -4.55 0.25 0.00 0.00 0.00 0.00 23.12 18.94 3hb3 s ALA 527 CO 0.51 -4.80 1.12 -0.40 0.00 0.00 0.00 175.76 172.19 3hb3 n ASP 528 N 13.97 1.44 -4.90 0.00 5.75 -1.26 -4.82 116.55 126.73 3hb3 n ASP 528 Ca 0.40 -2.81 -0.20 0.00 -0.01 0.00 0.00 54.79 52.16 3hb3 n ASP 528 Cb 0.47 -0.37 -0.02 0.00 -1.03 0.00 0.00 41.12 40.17 3hb3 n ASP 528 CO 0.00 0.00 0.00 0.42 -0.11 0.00 0.00 177.20 177.51 3hb3 s THR 529 N -1.83 2.85 0.32 2.12 -4.23 -1.26 -5.01 115.64 108.60 3hb3 s THR 529 Ca 0.24 -1.28 0.05 0.00 -1.18 0.00 0.00 61.69 59.53 3hb3 s THR 529 Cb 0.23 -3.03 0.30 0.00 1.34 0.00 0.00 72.50 71.35 3hb3 s THR 529 CO -0.02 -0.02 1.85 -0.07 -0.54 0.00 0.00 174.62 175.82 3hb3 h LEU 530 N 0.98 0.78 -1.99 4.79 3.38 -1.84 -1.20 115.31 120.21 3hb3 h LEU 530 Ca -0.42 0.05 0.33 0.00 0.09 0.00 0.00 57.88 57.93 3hb3 h LEU 530 Cb 1.27 -0.11 -0.05 0.00 0.09 0.00 0.00 40.66 41.86 3hb3 h LEU 530 CO 0.55 0.40 0.82 1.05 0.09 0.00 0.00 178.44 181.36 3hb3 h GLU 531 N 0.83 0.00 -0.01 1.13 9.09 -1.95 0.12 114.58 123.79 3hb3 h GLU 531 Ca 0.47 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.88 3hb3 h GLU 531 Cb 0.62 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.72 3hb3 h GLU 531 CO -0.24 0.00 -0.21 0.91 0.05 0.00 0.00 179.01 179.52 3hb3 n TRP 532 N -4.17 0.00 1.06 2.06 7.02 -0.45 -2.62 117.44 120.34 3hb3 n TRP 532 Ca 0.24 0.00 0.12 0.00 -1.02 0.00 0.00 57.50 56.84 3hb3 n TRP 532 Cb 1.20 -0.11 0.13 0.00 -2.42 0.00 0.00 31.31 30.12 3hb3 n TRP 532 CO 0.00 0.00 0.00 0.25 -2.02 0.00 0.00 177.69 175.92 3hb3 n THR 533 N -0.54 0.00 -3.56 -0.99 -2.24 0.41 -3.81 114.28 103.56 3hb3 n THR 533 Ca 0.13 -0.08 -0.20 0.00 -2.27 0.00 0.00 64.05 61.63 3hb3 n THR 533 Cb 0.35 0.69 -0.01 0.00 -2.10 0.00 0.00 70.33 69.26 3hb3 n THR 533 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 3hb3 s LEU 534 N -2.78 4.04 0.98 3.22 1.43 -1.08 -4.91 118.68 119.59 3hb3 s LEU 534 Ca 0.15 -0.08 -0.12 0.00 -1.03 0.00 0.00 54.13 53.04 3hb3 s LEU 534 Cb 0.18 -2.81 0.18 0.00 0.03 0.00 0.00 46.19 43.76 3hb3 s LEU 534 CO 0.68 -0.35 1.10 -2.84 0.23 0.00 0.00 176.35 175.16 3hb3 s PRO 535 N -4.15 0.54 -0.38 1.29 0.02 -1.26 -3.90 135.00 127.16 3hb3 s PRO 535 Ca 0.42 0.51 -0.05 0.00 0.02 0.00 0.00 61.00 61.91 3hb3 s PRO 535 Cb -0.09 -1.75 0.08 0.00 0.02 0.00 0.00 34.50 32.76 3hb3 s PRO 535 CO 0.31 -2.65 0.16 -1.12 -0.33 0.00 0.00 177.00 173.37 3hb3 s SER 536 N -3.51 5.27 0.54 2.53 0.01 -0.73 -1.85 113.70 115.96 3hb3 s SER 536 Ca 0.65 -1.64 0.02 0.00 1.31 0.00 0.00 55.95 56.29 3hb3 s SER 536 Cb -0.18 -1.84 0.03 0.00 0.21 0.00 0.00 66.02 64.23 3hb3 s SER 536 CO 0.57 -0.46 0.76 -2.16 0.41 0.00 0.00 173.24 172.36 3hb3 s PRO 537 N 1.26 2.58 0.83 12.44 0.04 -1.25 -3.94 135.00 146.96 3hb3 s PRO 537 Ca 0.03 -0.81 -0.13 0.00 0.04 0.00 0.00 61.00 60.12 3hb3 s PRO 537 Cb -0.22 -2.51 0.06 0.00 0.04 0.00 0.00 34.50 31.87 3hb3 s PRO 537 CO -0.01 -0.67 0.95 -2.30 0.04 0.00 0.00 177.00 175.01 3hb3 n PRO 538 N -2.30 0.07 -1.86 0.56 -0.02 -0.77 -4.98 135.00 125.69 3hb3 n PRO 538 Ca 0.08 0.09 -0.32 0.00 -2.02 0.00 0.00 63.50 61.33 3hb3 n PRO 538 Cb 0.60 -2.23 0.02 0.00 -0.02 0.00 0.00 33.50 31.86 3hb3 n PRO 538 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 3hb3 s PRO 539 N -3.85 3.27 0.27 0.52 0.04 -1.26 -4.94 135.00 129.05 3hb3 s PRO 539 Ca 0.69 1.01 -0.10 0.00 0.04 0.00 0.00 61.00 62.64 3hb3 s PRO 539 Cb -0.28 -2.03 0.41 0.00 0.04 0.00 0.00 34.50 32.64 3hb3 s PRO 539 CO 0.55 -0.83 1.57 0.93 0.04 0.00 0.00 177.00 179.26 3hb3 h GLU 540 N -0.10 -0.00 -5.19 4.56 5.08 -2.03 -3.38 114.58 113.52 3hb3 h GLU 540 Ca -0.45 0.00 -0.65 0.00 -1.00 0.00 0.00 59.36 57.26 3hb3 h GLU 540 Cb 1.21 0.00 -0.25 0.00 0.50 0.00 0.00 28.75 30.21 3hb3 h GLU 540 CO 0.58 -0.00 -0.70 -1.01 -1.00 0.00 0.00 179.01 176.88 3hb3 s HIS 541 N -6.23 2.96 0.12 4.33 3.76 -1.26 -5.04 115.29 113.94 3hb3 s HIS 541 Ca -0.15 -0.57 0.06 0.00 -0.15 0.00 0.00 55.06 54.25 3hb3 s HIS 541 Cb 0.25 -2.00 -0.04 0.00 1.11 0.00 0.00 32.58 31.91 3hb3 s HIS 541 CO 0.77 -0.25 -0.15 0.95 -0.85 0.00 0.00 174.74 175.21 3hb3 s THR 542 N 0.78 1.41 -0.59 1.30 -4.23 -1.26 -4.90 115.64 108.14 3hb3 s THR 542 Ca -0.02 -1.69 -0.14 0.00 -1.18 0.00 0.00 61.69 58.66 3hb3 s THR 542 Cb -0.15 -1.53 0.02 0.00 1.34 0.00 0.00 72.50 72.18 3hb3 s THR 542 CO 0.02 -0.35 0.64 0.49 -0.54 0.00 0.00 174.62 174.88 3hb3 n PHE 543 N 0.62 -2.90 0.00 3.99 3.72 -1.26 -4.30 117.46 117.32 3hb3 n PHE 543 Ca -0.16 1.17 0.00 0.00 -0.05 0.00 0.00 57.45 58.41 3hb3 n PHE 543 Cb 0.56 -3.32 0.00 0.00 -0.94 0.00 0.00 39.48 35.79 3hb3 n PHE 543 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 176.76 177.10 3hb3 n GLU 544 N -1.11 0.00 0.00 -1.08 4.71 -1.26 -4.52 120.64 117.38 3hb3 n GLU 544 Ca -0.04 0.00 0.00 0.00 -0.01 0.00 0.00 57.16 57.11 3hb3 n GLU 544 Cb 0.57 -0.13 0.00 0.00 -1.01 0.00 0.00 31.44 30.87 3hb3 n GLU 544 CO 0.00 0.00 0.00 0.25 0.09 0.00 0.00 177.13 177.47