#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hkb n GLU 3 N 0.00 -1.00 -3.15 5.56 4.71 -1.07 -4.61 120.64 121.09 3hkb n GLU 3 Ca 0.00 -0.58 0.06 0.00 -0.01 0.00 0.00 57.16 56.62 3hkb n GLU 3 Cb 0.00 -0.46 -0.01 0.00 -1.01 0.00 0.00 31.44 29.96 3hkb n GLU 3 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 3hkb s ILE 5 N 2.99 5.16 0.01 0.00 1.01 -0.98 -4.69 121.20 124.70 3hkb s ILE 5 Ca 0.07 0.72 -0.23 0.00 0.00 0.00 0.00 60.65 61.20 3hkb s ILE 5 Cb -0.05 -3.75 -0.05 0.00 0.01 0.00 0.00 42.46 38.62 3hkb s ILE 5 CO -0.13 0.19 0.71 -0.44 0.00 0.00 0.00 174.94 175.26 3hkb s SER 6 N 1.31 7.11 -0.13 3.58 0.01 -0.51 -0.77 113.70 124.30 3hkb s SER 6 Ca 0.19 1.32 0.01 0.00 1.31 0.00 0.00 55.95 58.78 3hkb s SER 6 Cb -0.15 -2.43 0.02 0.00 0.21 0.00 0.00 66.02 63.67 3hkb s SER 6 CO 0.09 0.02 -0.16 -0.63 0.41 0.00 0.00 173.24 172.97 3hkb s ILE 7 N 0.05 1.63 -0.23 1.44 1.01 -0.37 -0.93 121.20 123.80 3hkb s ILE 7 Ca 0.36 -0.70 -0.03 0.00 0.00 0.00 0.00 60.65 60.28 3hkb s ILE 7 Cb -0.19 -1.50 0.00 0.00 0.01 0.00 0.00 42.46 40.78 3hkb s ILE 7 CO 0.20 0.47 -0.06 -1.00 0.00 0.00 0.00 174.94 174.56 3hkb s HIS 8 N 1.19 2.97 -0.20 3.97 3.76 0.86 -1.06 115.29 126.78 3hkb s HIS 8 Ca -0.01 -1.14 -0.03 0.00 -0.15 0.00 0.00 55.06 53.73 3hkb s HIS 8 Cb -0.14 -2.09 -0.01 0.00 1.11 0.00 0.00 32.58 31.45 3hkb s HIS 8 CO -0.06 -0.61 -0.05 0.54 -0.85 0.00 0.00 174.74 173.70 3hkb s VAL 9 N 1.43 3.37 0.12 -0.90 0.11 -0.83 -0.17 120.40 123.54 3hkb s VAL 9 Ca 0.04 -0.50 0.00 0.00 -2.93 0.00 0.00 61.98 58.59 3hkb s VAL 9 Cb -0.15 -2.51 0.00 0.00 -1.53 0.00 0.00 36.38 32.19 3hkb s VAL 9 CO -0.04 0.44 0.00 0.61 -3.33 0.00 0.00 175.10 172.78 3hkb n GLY 10 N 4.51 -4.47 0.00 6.54 0.00 0.16 -3.77 105.19 108.16 3hkb n GLY 10 Ca -0.18 -0.53 0.00 0.00 0.00 0.00 0.00 46.02 45.31 3hkb n GLY 10 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 3hkb n GLN 11 N 0.79 0.00 -0.17 1.61 7.27 -1.26 -0.80 117.38 124.81 3hkb n GLN 11 Ca 0.00 0.00 -0.05 0.00 0.07 0.00 0.00 57.00 57.02 3hkb n GLN 11 Cb 0.00 0.00 -0.05 0.00 2.41 0.00 0.00 30.24 32.60 3hkb n GLN 11 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 3hkb h ALA 12 N 0.00 -0.31 -0.44 1.69 0.00 -1.98 0.70 119.26 118.92 3hkb h ALA 12 Ca 0.00 0.05 0.09 0.00 0.00 0.00 0.00 54.91 55.05 3hkb h ALA 12 Cb 0.00 1.13 -0.09 0.00 0.00 0.00 0.00 17.79 18.83 3hkb h ALA 12 CO 0.00 -0.50 -0.18 0.78 0.00 0.00 0.00 179.25 179.36 3hkb h GLY 13 N -0.04 0.18 0.18 0.00 0.00 -1.06 0.19 103.07 102.53 3hkb h GLY 13 Ca 0.07 0.23 0.05 0.00 0.00 0.00 0.00 47.33 47.68 3hkb h GLY 13 CO -0.42 -0.20 -0.27 -2.08 0.00 0.00 0.00 176.54 173.58 3hkb h VAL 14 N -0.08 0.36 -0.13 4.60 2.07 -0.95 0.21 116.25 122.33 3hkb h VAL 14 Ca 0.21 0.00 -0.10 0.00 0.82 0.00 0.00 66.70 67.63 3hkb h VAL 14 Cb 0.41 0.36 -0.01 0.00 -1.52 0.00 0.00 31.29 30.53 3hkb h VAL 14 CO -0.50 0.00 -0.38 1.56 0.02 0.00 0.00 177.57 178.27 3hkb h GLN 15 N -0.31 0.27 -0.14 1.57 4.20 0.69 0.77 115.11 122.15 3hkb h GLN 15 Ca 0.12 -0.12 -0.02 0.00 0.06 0.00 0.00 58.65 58.68 3hkb h GLN 15 Cb 0.49 -0.01 -0.01 0.00 0.30 0.00 0.00 27.48 28.26 3hkb h GLN 15 CO -0.36 0.62 0.01 0.82 -0.67 0.00 0.00 178.83 179.25 3hkb h ILE 16 N 0.23 1.24 0.51 2.54 5.03 -0.59 -2.68 117.51 123.78 3hkb h ILE 16 Ca 0.02 -0.76 -0.02 0.00 -0.12 0.00 0.00 64.86 63.99 3hkb h ILE 16 Cb 0.78 1.46 -0.02 0.00 -3.03 0.00 0.00 36.82 36.02 3hkb h ILE 16 CO 0.06 0.22 -0.47 1.23 -0.68 0.00 0.00 178.15 178.51 3hkb h GLY 17 N 0.00 -1.24 -1.20 5.37 0.00 0.69 -0.94 103.07 105.76 3hkb h GLY 17 Ca 0.04 0.57 0.35 0.00 0.00 0.00 0.00 47.33 48.29 3hkb h GLY 17 CO 0.00 -0.38 1.08 -2.01 0.00 0.00 0.00 176.54 175.24 3hkb n ASN 18 N -5.31 0.00 -0.28 0.19 5.15 0.26 0.45 115.26 115.72 3hkb n ASN 18 Ca -0.12 0.71 0.07 0.00 -0.60 0.00 0.00 54.58 54.65 3hkb n ASN 18 Cb 0.44 -0.30 -0.02 0.00 -0.53 0.00 0.00 39.78 39.37 3hkb n ASN 18 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3hkb n ALA 19 N -2.37 3.25 0.00 5.20 0.00 -0.41 -3.72 120.51 122.46 3hkb n ALA 19 Ca 0.27 -0.50 0.06 0.00 0.00 0.00 0.00 53.44 53.27 3hkb n ALA 19 Cb 1.44 -0.53 -0.10 0.00 0.00 0.00 0.00 19.45 20.27 3hkb n ALA 19 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3hkb h TRP 21 N 0.00 0.61 -0.65 0.00 4.06 -1.18 0.36 115.95 119.14 3hkb h TRP 21 Ca 0.00 -0.16 -0.01 0.00 2.06 0.00 0.00 58.89 60.78 3hkb h TRP 21 Cb 0.58 -0.14 -0.03 0.00 -1.00 0.00 0.00 29.16 28.57 3hkb h TRP 21 CO 0.00 0.80 0.37 1.05 -3.56 0.00 0.00 178.44 177.09 3hkb h GLU 22 N 0.44 0.89 0.01 0.49 4.11 -1.76 0.20 114.58 118.97 3hkb h GLU 22 Ca 0.05 -0.09 -0.23 0.00 0.07 0.00 0.00 59.36 59.16 3hkb h GLU 22 Cb 0.80 -0.18 0.00 0.00 0.50 0.00 0.00 28.75 29.87 3hkb h GLU 22 CO 0.07 0.65 -0.96 1.25 0.07 0.00 0.00 179.01 180.08 3hkb h LEU 23 N 0.91 0.49 -0.31 3.06 6.46 -1.52 -1.80 115.31 122.60 3hkb h LEU 23 Ca 0.23 -0.41 -0.02 0.00 -0.12 0.00 0.00 57.88 57.57 3hkb h LEU 23 Cb 0.01 -0.15 -0.01 0.00 -0.73 0.00 0.00 40.66 39.77 3hkb h LEU 23 CO -0.04 1.21 0.11 1.88 -0.62 0.00 0.00 178.44 180.99 3hkb h TYR 24 N 0.20 0.48 -0.70 1.25 0.99 0.10 -0.20 116.97 119.09 3hkb h TYR 24 Ca -0.08 -0.04 0.10 0.00 2.00 0.00 0.00 58.73 60.71 3hkb h TYR 24 Cb 1.61 -0.14 -0.07 0.00 1.00 0.00 0.00 36.73 39.12 3hkb h TYR 24 CO 0.06 0.48 0.33 0.00 -0.00 0.00 0.00 178.16 179.03 3hkb h LEU 26 N 0.56 0.44 -0.60 0.00 5.85 -0.79 -1.76 115.31 119.01 3hkb h LEU 26 Ca 0.35 -0.15 -0.14 0.00 0.84 0.00 0.00 57.88 58.78 3hkb h LEU 26 Cb 0.40 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 41.30 3hkb h LEU 26 CO -0.29 0.71 -0.41 -0.08 -0.34 0.00 0.00 178.44 178.03 3hkb h GLU 27 N 0.39 0.65 -0.51 1.25 4.81 -0.24 -3.30 114.58 117.63 3hkb h GLU 27 Ca 0.06 -0.34 0.00 0.00 -0.13 0.00 0.00 59.36 58.95 3hkb h GLU 27 Cb 0.68 0.01 0.00 0.00 0.63 0.00 0.00 28.75 30.07 3hkb h GLU 27 CO 0.05 0.94 0.00 0.72 -0.73 0.00 0.00 179.01 179.99 3hkb n HIS 28 N -4.03 0.67 -1.18 0.92 8.25 -0.56 -4.96 115.22 114.33 3hkb n HIS 28 Ca -0.02 -0.40 -0.06 0.00 -0.26 0.00 0.00 57.72 56.98 3hkb n HIS 28 Cb 0.53 -0.01 -0.03 0.00 1.12 0.00 0.00 29.99 31.61 3hkb n HIS 28 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3hkb n GLY 29 N 1.31 0.83 3.60 -1.41 0.00 -0.74 -4.98 105.19 103.81 3hkb n GLY 29 Ca 0.19 -0.51 -0.42 0.00 0.00 0.00 0.00 46.02 45.28 3hkb n GLY 29 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3hkb s ILE 30 N -2.13 4.66 0.57 -0.61 1.01 -0.77 -4.53 121.20 119.40 3hkb s ILE 30 Ca 0.00 1.06 -0.19 0.00 0.00 0.00 0.00 60.65 61.52 3hkb s ILE 30 Cb 0.00 -4.27 -0.04 0.00 0.01 0.00 0.00 42.46 38.16 3hkb s ILE 30 CO 0.00 -0.47 1.19 -1.10 0.00 0.00 0.00 174.94 174.56 3hkb s GLN 31 N 3.27 3.12 0.56 2.79 -0.21 0.60 -4.54 119.66 125.26 3hkb s GLN 31 Ca 0.35 1.78 0.37 0.00 0.02 0.00 0.00 55.36 57.87 3hkb s GLN 31 Cb -0.13 -1.98 1.49 0.00 1.00 0.00 0.00 33.01 33.39 3hkb s GLN 31 CO 0.17 -1.08 1.70 -1.35 -2.12 0.00 0.00 175.29 172.62 3hkb h PRO 32 N 1.04 0.00 0.00 2.91 0.11 -1.97 0.37 132.00 134.47 3hkb h PRO 32 Ca -0.50 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.61 3hkb h PRO 32 Cb 1.29 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.40 3hkb h PRO 32 CO 0.56 0.00 0.00 -0.40 -0.21 0.00 0.00 178.00 177.95 3hkb n ASP 33 N -3.92 0.00 0.00 -2.05 5.75 -1.26 -3.17 116.55 111.90 3hkb n ASP 33 Ca 0.26 -0.64 0.00 0.00 -0.01 0.00 0.00 54.79 54.41 3hkb n ASP 33 Cb 1.36 -0.08 0.00 0.00 -1.03 0.00 0.00 41.12 41.37 3hkb n ASP 33 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3hkb n GLY 34 N 0.76 3.30 3.78 6.12 0.00 0.13 -4.65 105.19 114.62 3hkb n GLY 34 Ca 0.18 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.87 3hkb n GLY 34 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3hkb s GLN 35 N -0.63 2.96 -0.24 1.61 -0.21 -1.24 -2.46 119.66 119.45 3hkb s GLN 35 Ca 0.00 1.37 -0.08 0.00 0.02 0.00 0.00 55.36 56.68 3hkb s GLN 35 Cb 0.00 -1.97 0.11 0.00 1.00 0.00 0.00 33.01 32.15 3hkb s GLN 35 CO 0.00 -1.12 0.51 0.00 -2.12 0.00 0.00 175.29 172.56 3hkb s MET 36 N -4.01 0.42 -1.10 2.91 0.23 -1.26 -0.29 119.30 116.21 3hkb s MET 36 Ca 0.67 1.17 -0.08 0.00 -1.03 0.00 0.00 55.69 56.42 3hkb s MET 36 Cb -0.20 0.51 0.28 0.00 -1.53 0.00 0.00 34.83 33.89 3hkb s MET 36 CO 0.39 -0.26 1.11 -0.35 -2.03 0.00 0.00 175.02 173.88 3hkb n PRO 37 N 5.41 3.51 0.00 3.16 -0.05 -1.26 -5.04 135.00 140.74 3hkb n PRO 37 Ca -0.09 -4.47 0.00 0.00 -0.05 0.00 0.00 63.50 58.89 3hkb n PRO 37 Cb 0.49 -2.53 0.00 0.00 -0.05 0.00 0.00 33.50 31.41 3hkb n PRO 37 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 175.50 171.98 3hkb n ASP 47 N 2.56 0.00 0.00 3.54 4.64 -1.26 -5.16 116.55 120.87 3hkb n ASP 47 Ca 0.24 0.00 0.00 0.00 -1.38 0.00 0.00 54.79 53.65 3hkb n ASP 47 Cb 0.38 0.00 0.00 0.00 -1.04 0.00 0.00 41.12 40.46 3hkb n ASP 47 CO 0.00 0.00 0.00 -0.24 -0.82 0.00 0.00 177.20 176.14 3hkb n SER 48 N 0.00 0.00 -0.35 1.67 2.88 -1.26 -3.61 113.62 112.95 3hkb n SER 48 Ca 0.00 0.00 0.06 0.00 -1.33 0.00 0.00 58.87 57.60 3hkb n SER 48 Cb 0.00 0.00 0.26 0.00 -0.75 0.00 0.00 64.21 63.72 3hkb n SER 48 CO 0.00 0.00 0.00 2.22 -1.23 0.00 0.00 175.04 176.03 3hkb n PHE 49 N 0.00 0.20 0.29 0.66 1.16 -1.19 -3.87 117.46 114.71 3hkb n PHE 49 Ca 0.00 -0.10 0.16 0.00 -1.87 0.00 0.00 57.45 55.64 3hkb n PHE 49 Cb 0.00 0.00 0.87 0.00 -1.61 0.00 0.00 39.48 38.74 3hkb n PHE 49 CO 0.00 0.00 0.00 -0.97 -1.87 0.00 0.00 176.76 173.92 3hkb h ASN 50 N 1.22 0.00 -0.01 5.98 -0.00 -1.78 -2.92 115.58 118.07 3hkb h ASN 50 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 56.30 56.30 3hkb h ASN 50 Cb 0.27 0.00 -0.00 0.00 -0.00 0.00 0.00 38.32 38.59 3hkb h ASN 50 CO 0.00 0.06 0.03 0.71 -0.00 0.00 0.00 177.43 178.23 3hkb h THR 51 N 0.00 0.24 0.00 -3.57 1.35 -1.82 -3.23 112.91 105.88 3hkb h THR 51 Ca -0.00 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.86 3hkb h THR 51 Cb 0.21 0.97 0.00 0.00 -1.73 0.00 0.00 68.15 67.60 3hkb h THR 51 CO 0.01 0.00 -0.98 0.49 -0.25 0.00 0.00 175.52 174.79 3hkb n PHE 52 N -3.42 0.00 -4.74 4.73 3.01 -1.12 -2.47 117.46 113.44 3hkb n PHE 52 Ca -0.03 0.00 -0.30 0.00 1.01 0.00 0.00 57.45 58.14 3hkb n PHE 52 Cb 0.11 0.00 -0.14 0.00 -0.01 0.00 0.00 39.48 39.44 3hkb n PHE 52 CO 0.00 0.00 0.00 -0.06 1.01 0.00 0.00 176.76 177.71 3hkb s PHE 53 N -1.97 2.30 -0.06 1.38 0.40 -1.12 -0.88 117.98 118.04 3hkb s PHE 53 Ca 0.00 -0.40 0.01 0.00 -0.60 0.00 0.00 56.93 55.94 3hkb s PHE 53 Cb 0.00 -1.34 -0.03 0.00 0.51 0.00 0.00 43.02 42.16 3hkb s PHE 53 CO 0.00 0.19 -0.08 -1.54 0.70 0.00 0.00 175.22 174.49 3hkb s SER 54 N -1.49 4.53 -1.46 1.36 1.04 -0.11 -4.48 113.70 113.08 3hkb s SER 54 Ca 0.12 -0.06 -0.09 0.00 0.48 0.00 0.00 55.95 56.41 3hkb s SER 54 Cb -0.10 -1.10 -0.04 0.00 0.10 0.00 0.00 66.02 64.87 3hkb s SER 54 CO 0.03 0.36 2.84 1.21 0.98 0.00 0.00 173.24 178.66 3hkb n GLU 55 N 2.21 3.85 -1.89 4.02 2.13 -1.26 -3.47 120.64 126.23 3hkb n GLU 55 Ca -0.18 -2.48 -0.42 0.00 0.66 0.00 0.00 57.16 54.75 3hkb n GLU 55 Cb 0.53 -2.71 -0.02 0.00 0.27 0.00 0.00 31.44 29.50 3hkb n GLU 55 CO 0.00 0.00 0.00 -0.08 -0.41 0.00 0.00 177.13 176.64 3hkb s THR 56 N 1.20 2.39 0.00 6.31 -1.32 -1.26 -4.72 115.64 118.23 3hkb s THR 56 Ca 0.66 0.31 0.00 0.00 -1.21 0.00 0.00 61.69 61.45 3hkb s THR 56 Cb 0.19 -3.20 0.00 0.00 -1.51 0.00 0.00 72.50 67.98 3hkb s THR 56 CO -0.07 0.04 0.00 0.61 -2.21 0.00 0.00 174.62 172.99 3hkb n GLY 57 N 2.63 0.84 3.18 6.08 0.00 -1.26 -3.65 105.19 113.01 3hkb n GLY 57 Ca 0.09 -0.79 -0.39 0.00 0.00 0.00 0.00 46.02 44.93 3hkb n GLY 57 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hkb s ALA 58 N -1.65 3.39 0.00 4.61 0.00 -1.26 -4.62 121.76 122.22 3hkb s ALA 58 Ca 0.00 -2.66 0.00 0.00 0.00 0.00 0.00 51.96 49.30 3hkb s ALA 58 Cb 0.00 -2.74 0.00 0.00 0.00 0.00 0.00 23.12 20.38 3hkb s ALA 58 CO 0.00 -1.92 0.00 0.41 0.00 0.00 0.00 175.76 174.25 3hkb n GLY 59 N 4.62 4.15 3.93 0.00 0.00 -1.26 -5.13 105.19 111.50 3hkb n GLY 59 Ca -0.04 -0.66 -0.30 0.00 0.00 0.00 0.00 46.02 45.03 3hkb n GLY 59 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3hkb s LYS 60 N 0.00 0.78 0.00 1.61 2.20 -1.24 -4.31 119.74 118.78 3hkb s LYS 60 Ca 0.00 -0.38 0.04 0.00 -0.36 0.00 0.00 55.97 55.27 3hkb s LYS 60 Cb 0.00 -1.86 0.07 0.00 -1.51 0.00 0.00 37.83 34.52 3hkb s LYS 60 CO 0.00 -2.33 0.87 0.72 -0.36 0.00 0.00 175.35 174.26 3hkb n HIS 61 N -3.71 0.00 -0.35 4.03 8.25 -1.03 -4.11 115.22 118.30 3hkb n HIS 61 Ca 0.15 -0.29 -0.13 0.00 -0.26 0.00 0.00 57.72 57.18 3hkb n HIS 61 Cb 0.60 0.26 -0.02 0.00 1.12 0.00 0.00 29.99 31.95 3hkb n HIS 61 CO 0.00 0.00 0.00 1.55 0.64 0.00 0.00 176.34 178.53 3hkb n VAL 62 N 0.08 0.10 -2.17 1.59 3.14 -1.23 -4.11 118.33 115.73 3hkb n VAL 62 Ca -0.11 -0.03 -0.39 0.00 -2.96 0.00 0.00 64.34 60.85 3hkb n VAL 62 Cb 0.71 0.00 -0.01 0.00 -1.06 0.00 0.00 33.84 33.47 3hkb n VAL 62 CO 0.00 0.00 0.00 -2.84 -6.46 0.00 0.00 176.83 167.53 3hkb s PRO 63 N -0.05 4.08 -1.15 1.45 0.02 -1.26 -0.93 135.00 137.15 3hkb s PRO 63 Ca 0.20 2.03 -0.19 0.00 0.02 0.00 0.00 61.00 63.06 3hkb s PRO 63 Cb -0.28 -2.79 -0.04 0.00 0.02 0.00 0.00 34.50 31.40 3hkb s PRO 63 CO 0.13 -0.36 1.97 0.54 -0.33 0.00 0.00 177.00 178.95 3hkb n ARG 64 N 0.24 2.23 -3.86 5.54 5.12 -0.06 -4.84 116.66 121.03 3hkb n ARG 64 Ca 0.03 -2.48 -0.11 0.00 -1.93 0.00 0.00 57.85 53.36 3hkb n ARG 64 Cb 0.44 -3.31 -0.10 0.00 -1.16 0.00 0.00 32.46 28.33 3hkb n ARG 64 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 3hkb s ALA 65 N 5.70 -0.37 -0.05 7.54 0.00 -1.26 -1.43 121.76 131.89 3hkb s ALA 65 Ca 0.56 -0.03 0.05 0.00 0.00 0.00 0.00 51.96 52.54 3hkb s ALA 65 Cb 0.09 0.06 -0.01 0.00 0.00 0.00 0.00 23.12 23.27 3hkb s ALA 65 CO 0.06 -0.20 -0.20 0.14 0.00 0.00 0.00 175.76 175.56 3hkb s VAL 66 N -1.21 1.69 -0.23 0.00 -7.23 -0.10 -4.84 120.40 108.47 3hkb s VAL 66 Ca -0.13 -0.86 -0.02 0.00 -1.81 0.00 0.00 61.98 59.16 3hkb s VAL 66 Cb -0.07 -1.44 0.01 0.00 0.56 0.00 0.00 36.38 35.45 3hkb s VAL 66 CO 0.02 0.48 -0.07 -0.36 -0.31 0.00 0.00 175.10 174.85 3hkb s PHE 67 N -0.03 2.99 -0.12 2.82 0.40 -0.56 -0.10 117.98 123.39 3hkb s PHE 67 Ca -0.04 -1.36 0.01 0.00 -0.60 0.00 0.00 56.93 54.94 3hkb s PHE 67 Cb -0.13 -2.06 0.02 0.00 0.51 0.00 0.00 43.02 41.36 3hkb s PHE 67 CO 0.03 -0.68 -0.15 0.14 0.70 0.00 0.00 175.22 175.26 3hkb s VAL 68 N 1.37 1.53 0.13 -0.44 -7.23 0.76 0.99 120.40 117.52 3hkb s VAL 68 Ca 0.03 -0.65 0.04 0.00 -1.81 0.00 0.00 61.98 59.59 3hkb s VAL 68 Cb -0.15 -1.41 -0.04 0.00 0.56 0.00 0.00 36.38 35.33 3hkb s VAL 68 CO -0.05 0.45 -0.10 -0.62 -0.31 0.00 0.00 175.10 174.47 3hkb s ASP 69 N 1.14 1.69 0.03 4.85 3.68 -0.16 0.37 116.67 128.26 3hkb s ASP 69 Ca -0.03 -0.98 0.16 0.00 2.13 0.00 0.00 52.55 53.82 3hkb s ASP 69 Cb -0.14 0.00 -0.17 0.00 -1.45 0.00 0.00 42.92 41.16 3hkb s ASP 69 CO -0.04 -0.33 0.76 0.18 0.13 0.00 0.00 175.17 175.87 3hkb n LEU 70 N -0.06 0.85 -4.89 -1.34 4.32 -1.26 -2.36 117.00 112.24 3hkb n LEU 70 Ca -0.11 0.38 -0.29 0.00 -0.02 0.00 0.00 56.01 55.97 3hkb n LEU 70 Cb 0.60 0.11 -0.02 0.00 -1.62 0.00 0.00 43.42 42.49 3hkb n LEU 70 CO 0.31 0.22 0.35 -1.83 -1.22 0.00 0.00 177.39 175.23 3hkb s GLU 71 N -2.82 3.67 0.00 3.23 -1.05 -1.25 -1.66 118.70 118.81 3hkb s GLU 71 Ca -0.04 0.22 0.00 0.00 -0.15 0.00 0.00 54.97 55.01 3hkb s GLU 71 Cb 0.08 -2.48 0.00 0.00 -0.44 0.00 0.00 34.13 31.29 3hkb s GLU 71 CO 0.82 0.02 0.05 -2.30 0.95 0.00 0.00 175.26 174.79 3hkb n PRO 72 N -1.42 0.00 0.00 -4.83 -0.02 -1.26 -4.26 135.00 123.20 3hkb n PRO 72 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.48 3hkb n PRO 72 Cb 0.54 -0.42 0.00 0.00 -0.02 0.00 0.00 33.50 33.61 3hkb n PRO 72 CO 0.00 0.00 0.00 2.41 1.98 0.00 0.00 175.50 179.89 3hkb n THR 73 N -0.08 0.00 0.02 3.45 -1.04 -1.26 -2.16 114.28 113.21 3hkb n THR 73 Ca 0.00 0.00 -0.12 0.00 -2.04 0.00 0.00 64.05 61.89 3hkb n THR 73 Cb 0.00 0.00 -0.09 0.00 -1.82 0.00 0.00 70.33 68.42 3hkb n THR 73 CO 0.00 0.00 0.00 0.58 -0.64 0.00 0.00 175.07 175.01 3hkb h VAL 74 N 0.00 1.11 0.00 12.58 2.07 -2.01 -2.11 116.25 127.89 3hkb h VAL 74 Ca 0.00 -1.27 -0.02 0.00 0.82 0.00 0.00 66.70 66.23 3hkb h VAL 74 Cb 0.00 1.86 -0.00 0.00 -1.52 0.00 0.00 31.29 31.62 3hkb h VAL 74 CO 0.00 0.29 -0.08 0.40 0.02 0.00 0.00 177.57 178.19 3hkb h ILE 75 N -0.77 0.87 -0.65 4.57 1.08 -1.72 -1.90 117.51 118.98 3hkb h ILE 75 Ca -0.01 -0.30 -0.04 0.00 -0.39 0.00 0.00 64.86 64.12 3hkb h ILE 75 Cb 0.57 1.17 -0.03 0.00 -3.07 0.00 0.00 36.82 35.46 3hkb h ILE 75 CO 0.02 0.08 0.24 0.44 -0.69 0.00 0.00 178.15 178.25 3hkb h ASP 76 N 0.00 0.89 -0.26 1.72 5.19 -1.53 -2.44 116.42 119.99 3hkb h ASP 76 Ca -0.00 -0.13 -0.07 0.00 -0.62 0.00 0.00 57.03 56.21 3hkb h ASP 76 Cb 0.16 -0.23 -0.02 0.00 0.18 0.00 0.00 39.33 39.42 3hkb h ASP 76 CO 0.01 0.81 -0.05 -0.33 -3.12 0.00 0.00 179.24 176.56 3hkb h GLU 77 N 0.95 0.61 -0.64 3.56 3.07 -0.65 -2.80 114.58 118.68 3hkb h GLU 77 Ca 0.22 -0.16 0.02 0.00 -0.50 0.00 0.00 59.36 58.94 3hkb h GLU 77 Cb 0.21 -0.07 -0.04 0.00 -0.84 0.00 0.00 28.75 28.01 3hkb h GLU 77 CO -0.02 0.67 0.40 0.28 -1.40 0.00 0.00 179.01 178.94 3hkb h VAL 78 N 0.57 1.10 -0.21 3.13 2.07 -1.29 -1.87 116.25 119.76 3hkb h VAL 78 Ca 0.11 -0.27 -0.06 0.00 0.82 0.00 0.00 66.70 67.30 3hkb h VAL 78 Cb 0.44 0.23 -0.04 0.00 -1.52 0.00 0.00 31.29 30.40 3hkb h VAL 78 CO 0.02 0.15 0.07 -2.11 0.02 0.00 0.00 177.57 175.72 3hkb n ARG 79 N -4.69 1.78 0.00 1.57 1.85 -1.06 -3.73 116.66 112.38 3hkb n ARG 79 Ca 0.06 -0.85 0.00 0.00 -1.00 0.00 0.00 57.85 56.06 3hkb n ARG 79 Cb 0.07 -1.55 0.00 0.00 -1.05 0.00 0.00 32.46 29.92 3hkb n ARG 79 CO 0.00 0.00 0.00 2.41 -0.01 0.00 0.00 177.63 180.03 3hkb n THR 80 N 0.12 0.00 -5.10 8.89 -1.04 -0.73 -4.94 114.28 111.48 3hkb n THR 80 Ca 0.11 0.00 -0.30 0.00 -2.04 0.00 0.00 64.05 61.82 3hkb n THR 80 Cb 0.64 -0.54 -0.17 0.00 -1.82 0.00 0.00 70.33 68.44 3hkb n THR 80 CO 0.00 0.00 0.00 -0.83 -0.64 0.00 0.00 175.07 173.60 3hkb s GLY 81 N -3.28 1.22 0.00 3.41 0.00 -1.07 -4.93 107.32 102.67 3hkb s GLY 81 Ca 0.00 -0.87 0.00 0.00 0.00 0.00 0.00 44.72 43.85 3hkb s GLY 81 CO 0.00 -0.29 0.00 -1.30 0.00 0.00 0.00 173.10 171.51 3hkb n THR 82 N 3.49 0.00 -0.01 0.90 -2.24 -1.26 -2.86 114.28 112.30 3hkb n THR 82 Ca -0.19 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.59 3hkb n THR 82 Cb 0.53 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.76 3hkb n THR 82 CO 0.00 0.00 0.00 -1.22 -0.57 0.00 0.00 175.07 173.28 3hkb n TYR 83 N 0.00 0.00 -0.24 4.78 0.53 -1.26 -4.93 117.16 116.03 3hkb n TYR 83 Ca 0.00 0.00 0.05 0.00 -1.02 0.00 0.00 57.90 56.93 3hkb n TYR 83 Cb 0.00 0.00 0.17 0.00 -1.03 0.00 0.00 39.34 38.48 3hkb n TYR 83 CO 0.00 0.00 0.00 -0.09 -1.02 0.00 0.00 176.86 175.75 3hkb h ARG 84 N 3.32 0.32 -0.23 -0.72 2.43 -1.61 -0.68 114.38 117.21 3hkb h ARG 84 Ca 0.00 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.15 3hkb h ARG 84 Cb 0.00 -0.07 0.00 0.00 -0.42 0.00 0.00 29.97 29.48 3hkb h ARG 84 CO 0.00 0.21 0.00 1.04 -1.51 0.00 0.00 179.97 179.71 3hkb n GLN 85 N -5.10 2.09 0.09 0.20 6.02 -1.26 -4.33 117.38 115.09 3hkb n GLN 85 Ca 0.13 -1.63 -0.11 0.00 -0.01 0.00 0.00 57.00 55.39 3hkb n GLN 85 Cb 0.43 -1.45 -0.07 0.00 1.02 0.00 0.00 30.24 30.16 3hkb n GLN 85 CO 0.00 0.00 0.00 1.25 -1.01 0.00 0.00 177.06 177.30 3hkb h LEU 86 N 3.35 -0.26-10.48 1.08 5.85 -1.07 -3.41 115.31 110.38 3hkb h LEU 86 Ca 0.00 -0.25 -0.49 0.00 0.84 0.00 0.00 57.88 57.98 3hkb h LEU 86 Cb 0.73 0.07 0.07 0.00 0.37 0.00 0.00 40.66 41.90 3hkb h LEU 86 CO 0.00 0.24 0.34 -0.36 -0.34 0.00 0.00 178.44 178.33 3hkb s PHE 87 N -3.55 3.27 0.26 1.25 0.08 -1.24 -4.22 117.98 113.84 3hkb s PHE 87 Ca -0.12 0.90 -0.17 0.00 0.12 0.00 0.00 56.93 57.67 3hkb s PHE 87 Cb 0.01 -3.01 -0.08 0.00 -0.57 0.00 0.00 43.02 39.36 3hkb s PHE 87 CO 0.43 -1.13 0.72 -1.01 -0.10 0.00 0.00 175.22 174.13 3hkb s HIS 88 N -3.27 3.52 0.22 0.36 3.76 -1.26 -4.98 115.29 113.64 3hkb s HIS 88 Ca 0.57 1.28 -0.08 0.00 -0.15 0.00 0.00 55.06 56.69 3hkb s HIS 88 Cb -0.11 -2.56 0.29 0.00 1.11 0.00 0.00 32.58 31.31 3hkb s HIS 88 CO 0.50 0.23 1.81 -1.00 -0.85 0.00 0.00 174.74 175.43 3hkb h PRO 89 N 2.88 0.70 -0.53 8.40 0.13 -1.97 -1.64 132.00 139.98 3hkb h PRO 89 Ca -0.48 -0.04 0.03 0.00 -0.87 0.00 0.00 66.00 64.64 3hkb h PRO 89 Cb 1.18 -0.16 -0.04 0.00 0.13 0.00 0.00 31.00 32.12 3hkb h PRO 89 CO 0.65 0.47 0.31 1.05 -0.23 0.00 0.00 178.00 180.25 3hkb h GLU 90 N 0.73 0.59 0.00 0.86 9.09 -2.02 -2.97 114.58 120.85 3hkb h GLU 90 Ca 0.33 -0.04 0.00 0.00 0.05 0.00 0.00 59.36 59.70 3hkb h GLU 90 Cb 0.23 -0.13 0.00 0.00 -1.65 0.00 0.00 28.75 27.20 3hkb h GLU 90 CO -0.20 0.39 0.00 0.00 0.05 0.00 0.00 179.01 179.25 3hkb n GLN 91 N -4.80 0.17 -3.50 1.06 10.64 -0.62 -4.18 117.38 116.15 3hkb n GLN 91 Ca 0.04 0.12 -0.42 0.00 -1.83 0.00 0.00 57.00 54.91 3hkb n GLN 91 Cb 0.09 -1.50 -0.08 0.00 -0.86 0.00 0.00 30.24 27.88 3hkb n GLN 91 CO 0.00 0.00 0.00 -0.51 -1.83 0.00 0.00 177.06 174.72 3hkb s LEU 92 N -2.32 5.54 -0.15 2.61 1.43 -1.12 -1.50 118.68 123.17 3hkb s LEU 92 Ca 0.09 -1.60 -0.04 0.00 -1.03 0.00 0.00 54.13 51.55 3hkb s LEU 92 Cb 0.05 -2.07 -0.03 0.00 0.03 0.00 0.00 46.19 44.17 3hkb s LEU 92 CO 0.10 -0.64 -0.01 -0.63 0.23 0.00 0.00 176.35 175.40 3hkb s ILE 93 N 1.49 4.19 0.04 -0.59 1.01 0.28 -4.97 121.20 122.64 3hkb s ILE 93 Ca 0.04 -0.26 0.03 0.00 0.00 0.00 0.00 60.65 60.46 3hkb s ILE 93 Cb -0.25 -2.83 -0.02 0.00 0.01 0.00 0.00 42.46 39.37 3hkb s ILE 93 CO 0.03 0.51 -0.09 0.28 0.00 0.00 0.00 174.94 175.67 3hkb s THR 94 N 0.08 0.64 -0.04 2.92 -1.32 -1.26 -0.99 115.64 115.67 3hkb s THR 94 Ca 0.01 -1.00 0.06 0.00 -1.21 0.00 0.00 61.69 59.55 3hkb s THR 94 Cb -0.13 -0.67 0.09 0.00 -1.51 0.00 0.00 72.50 70.28 3hkb s THR 94 CO 0.02 -0.27 1.02 0.61 -2.21 0.00 0.00 174.62 173.79 3hkb n GLY 95 N 1.64 3.23 5.00 6.08 0.00 -1.00 -4.95 105.19 115.20 3hkb n GLY 95 Ca -0.21 -0.36 0.00 0.00 0.00 0.00 0.00 46.02 45.45 3hkb n GLY 95 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 3hkb n LYS 96 N -0.76 0.00 -4.53 1.61 0.00 -0.67 -4.81 118.16 109.01 3hkb n LYS 96 Ca 0.05 0.00 -0.32 0.00 0.00 0.00 0.00 58.31 58.04 3hkb n LYS 96 Cb 0.40 0.00 -0.11 0.00 0.00 0.00 0.00 35.03 35.32 3hkb n LYS 96 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.40 175.40 3hkb s GLU 97 N 0.00 2.57 1.34 1.64 2.12 -1.16 -4.61 118.70 120.61 3hkb s GLU 97 Ca 0.00 -0.69 -0.20 0.00 0.36 0.00 0.00 54.97 54.44 3hkb s GLU 97 Cb 0.00 -2.50 0.33 0.00 0.26 0.00 0.00 34.13 32.22 3hkb s GLU 97 CO 0.00 0.61 0.81 -3.47 -0.54 0.00 0.00 175.26 172.67 3hkb n ASP 98 N 1.74 -3.40 -0.60 -1.70 -0.08 -1.26 -3.86 116.55 107.39 3hkb n ASP 98 Ca -0.16 -0.62 0.08 0.00 -1.51 0.00 0.00 54.79 52.59 3hkb n ASP 98 Cb 0.53 -1.04 0.05 0.00 2.34 0.00 0.00 41.12 43.00 3hkb n ASP 98 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 3hkb n ALA 99 N -5.43 2.67 -3.95 -1.67 0.00 -1.26 -4.89 120.51 105.98 3hkb n ALA 99 Ca 0.09 -0.61 -0.26 0.00 0.00 0.00 0.00 53.44 52.66 3hkb n ALA 99 Cb 0.56 -0.58 -0.07 0.00 0.00 0.00 0.00 19.45 19.36 3hkb n ALA 99 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3hkb n ALA 100 N 0.66 -1.85 -1.86 0.00 0.00 -1.26 -2.58 120.51 113.62 3hkb n ALA 100 Ca 0.09 -0.35 -0.19 0.00 0.00 0.00 0.00 53.44 53.00 3hkb n ALA 100 Cb 0.40 -0.76 -0.05 0.00 0.00 0.00 0.00 19.45 19.05 3hkb n ALA 100 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 3hkb n ASN 101 N -2.16 -5.28 -3.72 0.00 3.02 -1.26 -4.95 115.26 100.90 3hkb n ASN 101 Ca -0.25 0.27 -0.15 0.00 -0.03 0.00 0.00 54.58 54.43 3hkb n ASN 101 Cb 0.54 -4.39 -0.15 0.00 -0.61 0.00 0.00 39.78 35.18 3hkb n ASN 101 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 3hkb s ASN 102 N -2.55 0.14 0.30 6.41 4.22 -1.07 -4.54 114.94 117.86 3hkb s ASN 102 Ca 0.00 0.30 0.06 0.00 -2.14 0.00 0.00 52.86 51.08 3hkb s ASN 102 Cb 0.00 0.20 0.78 0.00 1.28 0.00 0.00 41.25 43.52 3hkb s ASN 102 CO 0.00 -0.18 1.72 0.22 -2.04 0.00 0.00 177.10 176.82 3hkb h TYR 103 N 7.57 0.83 -0.20 1.54 3.20 -1.86 0.23 116.97 128.28 3hkb h TYR 103 Ca -0.35 0.04 0.04 0.00 3.14 0.00 0.00 58.73 61.60 3hkb h TYR 103 Cb 1.13 -0.22 -0.04 0.00 1.54 0.00 0.00 36.73 39.15 3hkb h TYR 103 CO 0.43 0.02 -0.05 0.00 -1.64 0.00 0.00 178.16 176.92 3hkb h ALA 104 N 1.71 0.13 0.30 1.82 0.00 -1.92 0.58 119.26 121.88 3hkb h ALA 104 Ca 0.59 0.08 -0.01 0.00 0.00 0.00 0.00 54.91 55.57 3hkb h ALA 104 Cb 1.10 0.15 -0.00 0.00 0.00 0.00 0.00 17.79 19.04 3hkb h ALA 104 CO -0.49 -0.48 -0.19 -0.09 0.00 0.00 0.00 179.25 178.00 3hkb h ARG 105 N -0.00 -0.45 -0.10 0.00 2.43 -0.85 0.89 114.38 116.30 3hkb h ARG 105 Ca 0.10 0.03 0.04 0.00 -0.81 0.00 0.00 59.98 59.34 3hkb h ARG 105 Cb 0.15 0.10 -0.06 0.00 -0.42 0.00 0.00 29.97 29.74 3hkb h ARG 105 CO -0.21 -0.30 -0.29 0.78 -1.51 0.00 0.00 179.97 178.44 3hkb h GLY 106 N -0.47 -0.39 1.47 2.80 0.00 -0.88 -0.85 103.07 104.75 3hkb h GLY 106 Ca -0.03 0.35 -0.19 0.00 0.00 0.00 0.00 47.33 47.46 3hkb h GLY 106 CO 0.03 -0.22 -0.70 0.84 0.00 0.00 0.00 176.54 176.49 3hkb h HIS 107 N -0.38 0.70 0.00 5.60 -0.00 0.32 -2.40 115.15 119.00 3hkb h HIS 107 Ca 0.09 -0.30 -0.01 0.00 -0.00 0.00 0.00 60.37 60.15 3hkb h HIS 107 Cb 0.51 -0.11 -0.00 0.00 -0.00 0.00 0.00 27.41 27.81 3hkb h HIS 107 CO -0.36 1.07 -0.60 0.66 -0.00 0.00 0.00 177.93 178.70 3hkb n TYR 108 N -3.88 0.00 0.03 5.26 4.02 0.29 -4.29 117.16 118.59 3hkb n TYR 108 Ca -0.05 0.00 -0.02 0.00 -0.01 0.00 0.00 57.90 57.82 3hkb n TYR 108 Cb 0.70 -0.28 -0.01 0.00 -0.02 0.00 0.00 39.34 39.73 3hkb n TYR 108 CO 0.00 0.00 0.00 1.15 -1.01 0.00 0.00 176.86 177.00 3hkb h THR 109 N -0.53 0.00 0.00 -0.72 2.02 -1.14 -3.03 112.91 109.52 3hkb h THR 109 Ca -0.02 -0.41 -0.18 0.00 0.77 0.00 0.00 66.41 66.58 3hkb h THR 109 Cb 0.57 0.00 -0.03 0.00 -1.74 0.00 0.00 68.15 66.95 3hkb h THR 109 CO -0.01 0.00 -1.08 -0.29 0.37 0.00 0.00 175.52 174.51 3hkb h ILE 110 N -0.55 0.93 0.04 3.11 6.09 -1.52 -3.38 117.51 122.23 3hkb h ILE 110 Ca -0.01 -2.48 0.02 0.00 -1.37 0.00 0.00 64.86 61.02 3hkb h ILE 110 Cb 0.11 2.39 -0.05 0.00 0.47 0.00 0.00 36.82 39.73 3hkb h ILE 110 CO 0.02 0.53 -0.51 1.23 -3.07 0.00 0.00 178.15 176.36 3hkb h GLY 111 N 3.46 -1.04 -0.22 8.18 0.00 -1.37 -2.77 103.07 109.31 3hkb h GLY 111 Ca -0.10 0.62 0.03 0.00 0.00 0.00 0.00 47.33 47.88 3hkb h GLY 111 CO 0.08 -0.25 -0.10 0.28 0.00 0.00 0.00 176.54 176.55 3hkb n LYS 112 N -5.47 -0.06 -0.13 4.80 5.02 -1.14 -2.00 118.16 119.17 3hkb n LYS 112 Ca -0.07 0.33 -0.10 0.00 -2.02 0.00 0.00 58.31 56.46 3hkb n LYS 112 Cb 0.40 -0.50 0.04 0.00 -0.02 0.00 0.00 35.03 34.95 3hkb n LYS 112 CO 0.00 0.00 0.00 0.93 -0.52 0.00 0.00 177.40 177.81 3hkb h GLU 113 N 0.00 0.91 0.00 1.97 4.39 -1.73 -3.20 114.58 116.92 3hkb h GLU 113 Ca 0.06 -0.37 0.00 0.00 0.34 0.00 0.00 59.36 59.39 3hkb h GLU 113 Cb 0.12 -0.04 0.00 0.00 -0.10 0.00 0.00 28.75 28.73 3hkb h GLU 113 CO -0.21 1.02 -0.88 1.51 -1.16 0.00 0.00 179.01 179.29 3hkb n ILE 114 N -4.12 0.18 0.27 3.13 0.13 -0.85 -4.26 119.36 113.83 3hkb n ILE 114 Ca 0.00 -0.21 0.15 0.00 -1.10 0.00 0.00 62.75 61.59 3hkb n ILE 114 Cb 0.44 0.18 0.44 0.00 -0.84 0.00 0.00 39.64 39.86 3hkb n ILE 114 CO 0.00 0.00 0.00 -0.29 2.80 0.00 0.00 176.55 179.06 3hkb h ILE 115 N 0.00 0.00 0.01 9.51 -0.00 -1.50 -1.36 117.51 124.16 3hkb h ILE 115 Ca 0.00 -0.72 -0.23 0.00 -0.00 0.00 0.00 64.86 63.91 3hkb h ILE 115 Cb 0.69 1.71 -0.03 0.00 -0.00 0.00 0.00 36.82 39.19 3hkb h ILE 115 CO 0.00 0.00 -1.18 0.44 -0.00 0.00 0.00 178.15 177.41 3hkb h ASP 116 N 0.00 0.02 -0.06 2.19 3.32 -1.74 -2.87 116.42 117.27 3hkb h ASP 116 Ca 0.00 -0.02 -0.17 0.00 0.02 0.00 0.00 57.03 56.86 3hkb h ASP 116 Cb 0.74 -0.01 0.01 0.00 0.22 0.00 0.00 39.33 40.29 3hkb h ASP 116 CO 0.00 1.02 -0.62 0.25 -1.72 0.00 0.00 179.24 178.17 3hkb h LEU 117 N 0.00 0.65 0.03 1.55 5.85 -1.71 -3.10 115.31 118.58 3hkb h LEU 117 Ca -0.08 -0.69 0.00 0.00 0.84 0.00 0.00 57.88 57.95 3hkb h LEU 117 Cb 1.84 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 42.66 3hkb h LEU 117 CO 0.12 1.25 -0.04 0.58 -0.34 0.00 0.00 178.44 180.00 3hkb h VAL 118 N 0.11 0.89 -0.50 1.05 2.07 -1.34 -0.56 116.25 117.98 3hkb h VAL 118 Ca -0.06 0.00 -0.06 0.00 0.82 0.00 0.00 66.70 67.40 3hkb h VAL 118 Cb 1.29 0.89 -0.02 0.00 -1.52 0.00 0.00 31.29 31.93 3hkb h VAL 118 CO 0.13 0.00 0.06 0.25 0.02 0.00 0.00 177.57 178.02 3hkb h LEU 119 N -0.09 0.76 -0.98 2.57 5.85 -1.65 0.14 115.31 121.91 3hkb h LEU 119 Ca 0.01 -0.16 -0.08 0.00 0.84 0.00 0.00 57.88 58.49 3hkb h LEU 119 Cb 0.10 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 40.92 3hkb h LEU 119 CO -0.02 0.79 -0.37 -0.78 -0.34 0.00 0.00 178.44 177.72 3hkb h ASP 120 N 0.76 0.00 0.08 1.25 -0.00 -1.43 -2.02 116.42 115.06 3hkb h ASP 120 Ca 0.16 0.00 -0.25 0.00 -0.00 0.00 0.00 57.03 56.94 3hkb h ASP 120 Cb 0.38 0.00 -0.01 0.00 -0.00 0.00 0.00 39.33 39.70 3hkb h ASP 120 CO 0.01 0.37 -1.29 -0.09 -0.00 0.00 0.00 179.24 178.24 3hkb h ARG 121 N 0.00 0.17 -1.00 0.28 2.43 0.16 -3.29 114.38 113.12 3hkb h ARG 121 Ca -0.00 -0.28 0.23 0.00 -0.81 0.00 0.00 59.98 59.12 3hkb h ARG 121 Cb 0.87 0.11 -0.12 0.00 -0.42 0.00 0.00 29.97 30.40 3hkb h ARG 121 CO 0.05 1.14 0.60 0.82 -1.51 0.00 0.00 179.97 181.06 3hkb h ILE 122 N -0.50 0.57 0.00 1.20 2.04 -0.80 0.13 117.51 120.15 3hkb h ILE 122 Ca -0.29 -0.21 0.00 0.00 1.00 0.00 0.00 64.86 65.35 3hkb h ILE 122 Cb 1.60 -0.10 0.00 0.00 -0.74 0.00 0.00 36.82 37.58 3hkb h ILE 122 CO -0.01 0.11 0.00 -0.09 0.00 0.00 0.00 178.15 178.17 3hkb h ARG 123 N 0.62 0.00 0.01 2.37 9.65 -1.46 -1.28 114.38 124.29 3hkb h ARG 123 Ca 0.63 0.00 -0.19 0.00 -1.10 0.00 0.00 59.98 59.32 3hkb h ARG 123 Cb 1.16 0.00 -0.02 0.00 -1.39 0.00 0.00 29.97 29.72 3hkb h ARG 123 CO -0.46 0.00 -0.91 0.87 2.80 0.00 0.00 179.97 182.27 3hkb h LYS 124 N 0.00 0.04 0.02 0.20 1.57 -0.80 -2.00 116.57 115.60 3hkb h LYS 124 Ca 0.00 -0.05 -0.24 0.00 -1.87 0.00 0.00 60.65 58.49 3hkb h LYS 124 Cb 0.25 0.02 0.01 0.00 0.08 0.00 0.00 32.23 32.58 3hkb h LYS 124 CO 0.00 0.92 -1.01 -0.07 -0.57 0.00 0.00 179.45 178.73 3hkb h LEU 125 N 0.02 0.56 -1.18 2.94 3.38 -1.25 -3.18 115.31 116.60 3hkb h LEU 125 Ca -0.02 -0.47 -0.02 0.00 0.09 0.00 0.00 57.88 57.45 3hkb h LEU 125 Cb 1.60 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 42.15 3hkb h LEU 125 CO 0.12 1.29 0.28 0.00 0.09 0.00 0.00 178.44 180.22 3hkb h ALA 126 N 0.67 1.36 -0.14 1.53 0.00 -1.22 -2.22 119.26 119.24 3hkb h ALA 126 Ca -0.10 -0.13 -0.03 0.00 0.00 0.00 0.00 54.91 54.65 3hkb h ALA 126 Cb 1.66 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 19.19 3hkb h ALA 126 CO 0.18 0.50 -0.05 -0.44 0.00 0.00 0.00 179.25 179.43 3hkb h ASP 127 N 0.85 0.18 1.04 0.00 3.45 -1.34 -2.44 116.42 118.16 3hkb h ASP 127 Ca 0.21 -0.02 0.00 0.00 0.43 0.00 0.00 57.03 57.64 3hkb h ASP 127 Cb 0.10 -0.05 0.00 0.00 -0.56 0.00 0.00 39.33 38.83 3hkb h ASP 127 CO -0.03 0.27 0.00 1.56 -1.57 0.00 0.00 179.24 179.47 3hkb h GLN 128 N 0.20 0.00 -4.54 3.56 1.08 -1.38 -3.45 115.11 110.58 3hkb h GLN 128 Ca 0.05 0.00 -0.71 0.00 -1.45 0.00 0.00 58.65 56.53 3hkb h GLN 128 Cb 0.23 0.00 -0.23 0.00 -0.05 0.00 0.00 27.48 27.43 3hkb h GLN 128 CO 0.01 0.00 -0.47 0.00 -0.95 0.00 0.00 178.83 177.42 3hkb n THR 130 N 5.07 3.10 -0.17 0.00 -2.24 -1.26 -3.18 114.28 115.60 3hkb n THR 130 Ca -0.11 -3.06 0.00 0.00 -2.27 0.00 0.00 64.05 58.60 3hkb n THR 130 Cb 0.46 -2.36 0.00 0.00 -2.10 0.00 0.00 70.33 66.33 3hkb n THR 130 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3hkb n GLY 131 N 5.10 0.68 3.70 3.38 0.00 -1.26 -4.81 105.19 111.98 3hkb n GLY 131 Ca 0.49 -0.38 -0.42 0.00 0.00 0.00 0.00 46.02 45.71 3hkb n GLY 131 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 3hkb n LEU 132 N -0.12 3.65 -0.04 0.99 7.94 -1.19 -2.58 117.00 125.65 3hkb n LEU 132 Ca 0.00 1.20 -0.02 0.00 -1.11 0.00 0.00 56.01 56.08 3hkb n LEU 132 Cb 0.05 -1.49 -0.10 0.00 0.53 0.00 0.00 43.42 42.41 3hkb n LEU 132 CO 0.00 -0.47 -0.82 1.67 -1.11 0.00 0.00 177.39 176.66 3hkb n GLN 133 N 0.50 1.56 -3.06 1.96 7.27 -1.17 -4.82 117.38 119.63 3hkb n GLN 133 Ca 0.05 -0.04 0.00 0.00 0.07 0.00 0.00 57.00 57.08 3hkb n GLN 133 Cb 0.36 -1.31 0.00 0.00 2.41 0.00 0.00 30.24 31.71 3hkb n GLN 133 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 3hkb n GLY 134 N 2.12 -1.18 3.43 1.69 0.00 -1.26 -3.23 105.19 106.75 3hkb n GLY 134 Ca -0.15 -1.42 -0.29 0.00 0.00 0.00 0.00 46.02 44.17 3hkb n GLY 134 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3hkb s PHE 135 N -2.46 2.38 -0.33 1.61 0.40 -0.00 -2.33 117.98 117.25 3hkb s PHE 135 Ca 0.00 -0.34 0.01 0.00 -0.60 0.00 0.00 56.93 56.00 3hkb s PHE 135 Cb 0.00 -1.26 0.08 0.00 0.51 0.00 0.00 43.02 42.36 3hkb s PHE 135 CO 0.00 0.39 0.05 -0.51 0.70 0.00 0.00 175.22 175.85 3hkb s LEU 136 N -2.23 4.46 -0.13 -0.37 1.43 0.05 -1.26 118.68 120.62 3hkb s LEU 136 Ca 0.17 -1.79 -0.20 0.00 -1.03 0.00 0.00 54.13 51.28 3hkb s LEU 136 Cb -0.10 -1.68 -0.04 0.00 0.03 0.00 0.00 46.19 44.41 3hkb s LEU 136 CO 0.08 -0.36 0.56 -0.69 0.23 0.00 0.00 176.35 176.17 3hkb s VAL 137 N 1.07 5.11 -0.22 -1.59 1.01 0.30 -1.24 120.40 124.85 3hkb s VAL 137 Ca 0.03 1.10 -0.01 0.00 0.00 0.00 0.00 61.98 63.10 3hkb s VAL 137 Cb -0.20 -3.89 0.02 0.00 0.00 0.00 0.00 36.38 32.30 3hkb s VAL 137 CO -0.05 0.25 -0.11 -0.36 0.00 0.00 0.00 175.10 174.83 3hkb s PHE 138 N 1.06 2.95 0.08 5.22 0.40 -0.22 -0.31 117.98 127.15 3hkb s PHE 138 Ca 0.29 -1.46 -0.23 0.00 -0.60 0.00 0.00 56.93 54.93 3hkb s PHE 138 Cb -0.16 -2.02 0.06 0.00 0.51 0.00 0.00 43.02 41.41 3hkb s PHE 138 CO 0.12 -0.72 0.55 -3.38 0.70 0.00 0.00 175.22 172.50 3hkb s HIS 139 N 1.34 -0.47 0.48 0.36 -3.43 -0.76 -1.96 115.29 110.85 3hkb s HIS 139 Ca 0.03 0.45 -0.18 0.00 -0.80 0.00 0.00 55.06 54.56 3hkb s HIS 139 Cb -0.15 0.41 -0.09 0.00 -1.43 0.00 0.00 32.58 31.32 3hkb s HIS 139 CO -0.07 -0.71 0.97 -1.54 -2.00 0.00 0.00 174.74 171.38 3hkb s SER 140 N -2.21 6.74 -0.13 7.38 1.04 -1.26 -1.82 113.70 123.43 3hkb s SER 140 Ca -0.03 1.60 -0.14 0.00 0.48 0.00 0.00 55.95 57.86 3hkb s SER 140 Cb -0.00 -2.52 -0.11 0.00 0.10 0.00 0.00 66.02 63.49 3hkb s SER 140 CO -0.05 -0.50 0.25 -0.26 0.98 0.00 0.00 173.24 173.66 3hkb h PHE 141 N 1.30 0.00 -3.37 5.02 0.05 -1.67 -3.17 116.94 115.10 3hkb h PHE 141 Ca -0.48 0.00 -0.37 0.00 3.82 0.00 0.00 57.97 60.95 3hkb h PHE 141 Cb 1.18 0.00 0.17 0.00 2.00 0.00 0.00 35.95 39.30 3hkb h PHE 141 CO 0.63 0.53 0.22 0.41 -0.18 0.00 0.00 178.31 179.92 3hkb n GLY 142 N 1.65 -2.17 0.52 -1.45 0.00 -1.26 -3.09 105.19 99.39 3hkb n GLY 142 Ca -0.09 -1.59 0.04 0.00 0.00 0.00 0.00 46.02 44.38 3hkb n GLY 142 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hkb n GLY 143 N -3.40 -3.02 0.00 -0.02 0.00 -1.26 -4.33 105.19 93.15 3hkb n GLY 143 Ca 0.14 -1.25 0.00 0.00 0.00 0.00 0.00 46.02 44.91 3hkb n GLY 143 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hkb n GLY 144 N -2.48 -0.94 0.18 -0.02 0.00 -1.26 -2.85 105.19 97.82 3hkb n GLY 144 Ca -0.02 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.04 3hkb n GLY 144 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 3hkb h THR 145 N 0.00 1.04 -0.74 2.61 1.35 -1.89 0.40 112.91 115.68 3hkb h THR 145 Ca 0.00 -1.53 0.05 0.00 -0.55 0.00 0.00 66.41 64.38 3hkb h THR 145 Cb 0.00 1.89 -0.05 0.00 -1.73 0.00 0.00 68.15 68.26 3hkb h THR 145 CO 0.00 0.40 0.44 1.23 -0.25 0.00 0.00 175.52 177.34 3hkb h GLY 146 N 1.77 1.09 0.04 5.82 0.00 -1.82 -1.08 103.07 108.89 3hkb h GLY 146 Ca -0.00 -0.32 -0.22 0.00 0.00 0.00 0.00 47.33 46.79 3hkb h GLY 146 CO 0.05 0.23 -1.18 1.48 0.00 0.00 0.00 176.54 177.13 3hkb h SER 147 N 0.83 0.03 0.54 0.19 4.64 -1.41 -3.37 113.55 115.00 3hkb h SER 147 Ca 0.32 -0.58 -0.03 0.00 -0.47 0.00 0.00 61.79 61.03 3hkb h SER 147 Cb 0.12 -0.01 0.01 0.00 -0.31 0.00 0.00 62.40 62.21 3hkb h SER 147 CO -0.15 1.47 -0.26 1.23 -0.87 0.00 0.00 176.83 178.24 3hkb h GLY 148 N -0.89 -0.75 1.83 -0.77 0.00 -0.92 -2.92 103.07 98.64 3hkb h GLY 148 Ca -0.32 0.28 -0.09 0.00 0.00 0.00 0.00 47.33 47.20 3hkb h GLY 148 CO -0.17 -0.27 -0.35 -2.75 0.00 0.00 0.00 176.54 173.00 3hkb h PHE 149 N -1.11 0.23 0.15 5.60 3.04 -1.32 -2.84 116.94 120.69 3hkb h PHE 149 Ca -0.07 -0.05 -0.01 0.00 3.98 0.00 0.00 57.97 61.82 3hkb h PHE 149 Cb 0.55 -0.05 0.00 0.00 2.56 0.00 0.00 35.95 39.01 3hkb h PHE 149 CO 0.01 0.53 -0.07 1.15 -2.02 0.00 0.00 178.31 177.91 3hkb h THR 150 N 0.18 0.87 -0.55 4.41 2.02 -1.66 -1.10 112.91 117.08 3hkb h THR 150 Ca 0.02 -0.10 0.10 0.00 0.77 0.00 0.00 66.41 67.20 3hkb h THR 150 Cb 0.70 0.94 -0.11 0.00 -1.74 0.00 0.00 68.15 67.94 3hkb h THR 150 CO 0.05 0.02 -0.32 -1.28 0.37 0.00 0.00 175.52 174.37 3hkb h SER 151 N -0.26 -1.10 -0.70 4.18 0.87 -1.30 0.35 113.55 115.60 3hkb h SER 151 Ca -0.02 0.22 -0.05 0.00 -1.23 0.00 0.00 61.79 60.70 3hkb h SER 151 Cb 0.20 0.55 -0.03 0.00 -0.44 0.00 0.00 62.40 62.67 3hkb h SER 151 CO 0.03 -0.30 0.24 0.25 -0.53 0.00 0.00 176.83 176.52 3hkb h LEU 152 N -0.17 1.02 0.33 2.23 5.85 -1.38 -2.17 115.31 121.02 3hkb h LEU 152 Ca 0.22 -0.18 -0.00 0.00 0.84 0.00 0.00 57.88 58.76 3hkb h LEU 152 Cb 0.54 -0.27 -0.02 0.00 0.37 0.00 0.00 40.66 41.29 3hkb h LEU 152 CO -0.65 0.94 -0.30 0.25 -0.34 0.00 0.00 178.44 178.35 3hkb h LEU 153 N 1.06 -0.79 -1.84 2.25 6.46 -0.23 -2.42 115.31 119.80 3hkb h LEU 153 Ca 0.23 0.07 0.02 0.00 -0.12 0.00 0.00 57.88 58.08 3hkb h LEU 153 Cb 0.28 0.26 -0.01 0.00 -0.73 0.00 0.00 40.66 40.46 3hkb h LEU 153 CO -0.01 -0.43 0.14 0.24 -0.62 0.00 0.00 178.44 177.76 3hkb h MET 154 N -0.65 0.20 0.72 1.25 2.86 -0.12 0.41 114.93 119.61 3hkb h MET 154 Ca -0.02 -0.01 -0.04 0.00 -2.06 0.00 0.00 59.70 57.57 3hkb h MET 154 Cb 0.58 -0.05 0.01 0.00 0.06 0.00 0.00 31.60 32.20 3hkb h MET 154 CO -0.04 0.13 -0.35 0.93 1.06 0.00 0.00 176.91 178.65 3hkb h GLU 155 N 0.21 -0.94 0.00 1.72 5.08 -1.22 -2.30 114.58 117.13 3hkb h GLU 155 Ca 0.08 0.06 -0.04 0.00 -1.00 0.00 0.00 59.36 58.47 3hkb h GLU 155 Cb 0.08 0.21 -0.01 0.00 0.50 0.00 0.00 28.75 29.54 3hkb h GLU 155 CO -0.02 -0.60 -0.19 0.00 -1.00 0.00 0.00 179.01 177.20 3hkb h ARG 156 N -1.15 0.00 -0.16 2.33 2.47 -0.80 -1.22 114.38 115.85 3hkb h ARG 156 Ca -0.10 0.00 -0.05 0.00 -1.26 0.00 0.00 59.98 58.57 3hkb h ARG 156 Cb 0.77 0.00 -0.00 0.00 -1.65 0.00 0.00 29.97 29.09 3hkb h ARG 156 CO 0.16 0.19 -0.10 -0.07 0.56 0.00 0.00 179.97 180.72 3hkb h LEU 157 N 0.00 0.36 -0.89 3.04 3.38 -0.21 -0.58 115.31 120.40 3hkb h LEU 157 Ca -0.00 -0.43 0.00 0.00 0.09 0.00 0.00 57.88 57.54 3hkb h LEU 157 Cb 0.57 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.21 3hkb h LEU 157 CO 0.03 0.71 0.00 -1.20 0.09 0.00 0.00 178.44 178.07 3hkb n SER 158 N -4.60 0.47 -0.02 -0.43 7.64 -0.50 -0.16 113.62 116.02 3hkb n SER 158 Ca -0.06 0.68 -0.22 0.00 1.01 0.00 0.00 58.87 60.28 3hkb n SER 158 Cb 0.32 -0.75 -0.13 0.00 -1.01 0.00 0.00 64.21 62.63 3hkb n SER 158 CO 0.00 0.00 0.00 0.52 -3.01 0.00 0.00 175.04 172.55 3hkb n VAL 159 N -2.08 1.73 0.13 0.44 0.31 -0.96 -4.49 118.33 113.41 3hkb n VAL 159 Ca 0.00 -0.53 0.11 0.00 -0.01 0.00 0.00 64.34 63.91 3hkb n VAL 159 Cb 0.10 -1.79 0.03 0.00 -0.91 0.00 0.00 33.84 31.27 3hkb n VAL 159 CO 0.00 0.00 0.00 0.44 -1.32 0.00 0.00 176.83 175.95 3hkb h ASP 160 N -0.14 0.00 -2.98 4.52 3.45 0.11 -3.41 116.42 117.97 3hkb h ASP 160 Ca -0.42 0.00 -0.60 0.00 0.43 0.00 0.00 57.03 56.45 3hkb h ASP 160 Cb 1.89 0.00 -0.39 0.00 -0.56 0.00 0.00 39.33 40.27 3hkb h ASP 160 CO 0.02 0.03 -0.80 -0.31 -1.57 0.00 0.00 179.24 176.61 3hkb s TYR 161 N -3.31 1.41 0.00 4.55 1.51 0.77 -5.07 117.35 117.21 3hkb s TYR 161 Ca 0.01 -2.10 0.00 0.00 -1.01 0.00 0.00 57.07 53.97 3hkb s TYR 161 Cb 0.08 -1.40 0.00 0.00 -0.11 0.00 0.00 41.96 40.54 3hkb s TYR 161 CO 0.76 -0.80 0.15 0.41 -1.11 0.00 0.00 175.55 174.97 3hkb n GLY 162 N 3.63 -1.65 0.40 0.71 0.00 -1.26 -3.93 105.19 103.09 3hkb n GLY 162 Ca 0.13 0.16 -0.18 0.00 0.00 0.00 0.00 46.02 46.13 3hkb n GLY 162 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3hkb h LYS 163 N 0.00 -0.92 -1.08 1.61 6.56 -1.98 -3.46 116.57 117.30 3hkb h LYS 163 Ca 0.00 0.06 -0.15 0.00 -1.06 0.00 0.00 60.65 59.50 3hkb h LYS 163 Cb 0.00 0.21 0.00 0.00 -0.57 0.00 0.00 32.23 31.87 3hkb h LYS 163 CO 0.00 -0.61 0.10 1.63 -2.06 0.00 0.00 179.45 178.50 3hkb n LYS 164 N -5.51 0.00 -1.05 3.15 4.76 -1.25 -4.83 118.16 113.43 3hkb n LYS 164 Ca -0.14 0.00 -0.30 0.00 -2.87 0.00 0.00 58.31 55.00 3hkb n LYS 164 Cb 0.39 -0.27 0.14 0.00 -1.84 0.00 0.00 35.03 33.45 3hkb n LYS 164 CO 0.00 0.00 0.00 -1.12 -1.37 0.00 0.00 177.40 174.91 3hkb s SER 165 N 0.41 3.42 -0.10 4.39 0.01 -1.20 -4.82 113.70 115.81 3hkb s SER 165 Ca 0.18 1.74 -0.03 0.00 1.31 0.00 0.00 55.95 59.15 3hkb s SER 165 Cb -0.26 -2.38 0.04 0.00 0.21 0.00 0.00 66.02 63.64 3hkb s SER 165 CO 0.14 -2.71 0.07 -0.54 0.41 0.00 0.00 173.24 170.61 3hkb s LYS 166 N -4.82 -0.02 -0.11 12.44 1.02 -1.26 -0.82 119.74 126.17 3hkb s LYS 166 Ca 0.64 0.17 -0.02 0.00 0.02 0.00 0.00 55.97 56.78 3hkb s LYS 166 Cb -0.19 -1.11 -0.03 0.00 -0.52 0.00 0.00 37.83 35.97 3hkb s LYS 166 CO 0.58 -0.49 -0.01 -0.51 -0.92 0.00 0.00 175.35 174.00 3hkb s LEU 167 N 2.16 3.45 0.05 3.17 1.02 -0.39 -0.51 118.68 127.63 3hkb s LEU 167 Ca 0.04 0.04 0.08 0.00 0.02 0.00 0.00 54.13 54.31 3hkb s LEU 167 Cb -0.14 -1.80 -0.03 0.00 0.02 0.00 0.00 46.19 44.24 3hkb s LEU 167 CO -0.06 0.30 -0.23 -1.83 0.02 0.00 0.00 176.35 174.55 3hkb s GLU 168 N -0.41 1.56 -0.42 1.70 -1.05 -0.72 -0.54 118.70 118.81 3hkb s GLU 168 Ca 0.07 -1.03 -0.04 0.00 -0.15 0.00 0.00 54.97 53.82 3hkb s GLU 168 Cb -0.12 -1.72 0.11 0.00 -0.44 0.00 0.00 34.13 31.96 3hkb s GLU 168 CO 0.02 0.44 0.23 -0.06 0.95 0.00 0.00 175.26 176.85 3hkb s PHE 169 N -0.82 3.56 -0.04 4.83 0.40 0.57 0.76 117.98 127.25 3hkb s PHE 169 Ca 0.09 -2.32 -0.15 0.00 -0.60 0.00 0.00 56.93 53.95 3hkb s PHE 169 Cb -0.09 -3.28 -0.05 0.00 0.51 0.00 0.00 43.02 40.10 3hkb s PHE 169 CO 0.02 -0.98 0.42 -1.12 0.70 0.00 0.00 175.22 174.26 3hkb s SER 170 N 1.98 6.76 -0.52 1.36 0.01 -0.81 -1.84 113.70 120.64 3hkb s SER 170 Ca 0.08 0.90 -0.15 0.00 1.31 0.00 0.00 55.95 58.09 3hkb s SER 170 Cb -0.23 -2.25 0.12 0.00 0.21 0.00 0.00 66.02 63.86 3hkb s SER 170 CO -0.04 0.24 0.47 -0.63 0.41 0.00 0.00 173.24 173.69 3hkb s ILE 171 N -0.59 5.11 0.05 1.44 1.09 -0.76 0.22 121.20 127.76 3hkb s ILE 171 Ca 0.24 -1.46 -0.31 0.00 -1.10 0.00 0.00 60.65 58.02 3hkb s ILE 171 Cb -0.16 -4.25 -0.06 0.00 -1.06 0.00 0.00 42.46 36.93 3hkb s ILE 171 CO 0.12 -0.82 1.35 -0.47 -0.10 0.00 0.00 174.94 175.02 3hkb s TYR 172 N 1.58 3.13 0.33 3.97 6.14 0.11 -1.83 117.35 130.79 3hkb s TYR 172 Ca 0.03 0.98 -0.27 0.00 0.64 0.00 0.00 57.07 58.45 3hkb s TYR 172 Cb -0.29 -3.61 -0.09 0.00 0.42 0.00 0.00 41.96 38.39 3hkb s TYR 172 CO 0.03 -2.13 1.14 -1.25 0.64 0.00 0.00 175.55 173.98 3hkb s PRO 173 N 1.66 4.38 -0.02 4.97 0.04 -1.26 -1.76 135.00 143.01 3hkb s PRO 173 Ca 0.63 1.83 0.02 0.00 0.04 0.00 0.00 61.00 63.52 3hkb s PRO 173 Cb -0.33 -2.95 0.00 0.00 0.04 0.00 0.00 34.50 31.26 3hkb s PRO 173 CO 0.28 -0.03 -0.08 0.00 0.04 0.00 0.00 177.00 177.21 3hkb s ALA 174 N -1.29 0.77 0.24 8.56 0.00 -1.26 -4.78 121.76 124.00 3hkb s ALA 174 Ca 0.50 -0.32 -0.07 0.00 0.00 0.00 0.00 51.96 52.08 3hkb s ALA 174 Cb -0.31 -0.26 0.43 0.00 0.00 0.00 0.00 23.12 22.98 3hkb s ALA 174 CO 0.40 0.14 1.66 -1.35 0.00 0.00 0.00 175.76 176.61 3hkb h PRO 175 N 6.26 0.16 0.02 0.00 0.11 -1.96 -2.58 132.00 134.00 3hkb h PRO 175 Ca -0.32 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.78 3hkb h PRO 175 Cb 1.17 -0.04 -0.00 0.00 0.11 0.00 0.00 31.00 32.24 3hkb h PRO 175 CO 0.49 0.11 -0.03 -0.56 -0.21 0.00 0.00 178.00 177.80 3hkb h GLN 176 N 0.17 -0.05 -2.37 1.05 -0.00 -1.99 -3.16 115.11 108.75 3hkb h GLN 176 Ca 0.40 0.00 -0.81 0.00 -0.00 0.00 0.00 58.65 58.25 3hkb h GLN 176 Cb 0.70 0.01 -0.27 0.00 -0.00 0.00 0.00 27.48 27.92 3hkb h GLN 176 CO -0.58 -0.04 0.97 1.55 -0.00 0.00 0.00 178.83 180.73 3hkb n VAL 177 N -5.13 5.94 -3.66 1.86 3.14 -0.97 -4.98 118.33 114.54 3hkb n VAL 177 Ca -0.07 -5.98 -0.15 0.00 -2.96 0.00 0.00 64.34 55.19 3hkb n VAL 177 Cb 0.06 -1.64 -0.08 0.00 -1.06 0.00 0.00 33.84 31.12 3hkb n VAL 177 CO 0.00 0.00 0.00 -0.55 -6.46 0.00 0.00 176.83 169.82 3hkb s SER 178 N -1.46 -0.48 -0.04 6.55 0.15 -1.19 -4.76 113.70 112.47 3hkb s SER 178 Ca 0.38 0.68 -0.02 0.00 0.70 0.00 0.00 55.95 57.68 3hkb s SER 178 Cb 0.17 0.70 -0.01 0.00 -1.71 0.00 0.00 66.02 65.16 3hkb s SER 178 CO -0.09 -0.39 -0.05 0.71 1.20 0.00 0.00 173.24 174.63 3hkb h THR 179 N 3.79 0.00 -3.53 6.45 1.35 -1.92 -3.49 112.91 115.56 3hkb h THR 179 Ca -0.28 -0.30 -0.53 0.00 -0.55 0.00 0.00 66.41 64.76 3hkb h THR 179 Cb 1.16 0.00 -0.03 0.00 -1.73 0.00 0.00 68.15 67.55 3hkb h THR 179 CO 0.30 0.00 0.12 0.00 -0.25 0.00 0.00 175.52 175.69 3hkb s ALA 180 N -2.92 3.44 0.15 6.62 0.00 -1.26 -4.98 121.76 122.81 3hkb s ALA 180 Ca -0.04 0.22 0.06 0.00 0.00 0.00 0.00 51.96 52.20 3hkb s ALA 180 Cb 0.01 -2.85 -0.08 0.00 0.00 0.00 0.00 23.12 20.20 3hkb s ALA 180 CO 0.06 0.32 1.35 0.28 0.00 0.00 0.00 175.76 177.76 3hkb h VAL 181 N 2.98 1.62 -0.16 0.00 2.07 -1.96 -3.13 116.25 117.67 3hkb h VAL 181 Ca -0.48 -3.04 0.00 0.00 0.82 0.00 0.00 66.70 64.00 3hkb h VAL 181 Cb 1.20 2.67 0.00 0.00 -1.52 0.00 0.00 31.29 33.64 3hkb h VAL 181 CO 0.65 0.87 0.00 1.33 0.02 0.00 0.00 177.57 180.44 3hkb n VAL 182 N -3.49 0.22 -0.11 2.57 0.24 -1.26 -4.46 118.33 112.03 3hkb n VAL 182 Ca -0.01 -0.23 -0.09 0.00 -2.04 0.00 0.00 64.34 61.97 3hkb n VAL 182 Cb 0.87 0.11 -0.03 0.00 -1.47 0.00 0.00 33.84 33.31 3hkb n VAL 182 CO 0.00 0.00 0.00 -0.08 -2.14 0.00 0.00 176.83 174.61 3hkb h GLU 183 N 1.02 -0.30 -0.72 7.34 4.57 -1.88 -2.04 114.58 122.58 3hkb h GLU 183 Ca 0.00 0.02 0.15 0.00 -1.18 0.00 0.00 59.36 58.35 3hkb h GLU 183 Cb 0.23 0.07 -0.13 0.00 -0.16 0.00 0.00 28.75 28.76 3hkb h GLU 183 CO 0.00 -0.20 -0.07 -1.35 -1.18 0.00 0.00 179.01 176.21 3hkb h PRO 184 N -0.31 0.05 0.04 0.92 0.11 -1.88 -1.05 132.00 129.89 3hkb h PRO 184 Ca 0.15 -0.00 0.03 0.00 0.11 0.00 0.00 66.00 66.28 3hkb h PRO 184 Cb 0.57 -0.01 -0.05 0.00 0.11 0.00 0.00 31.00 31.61 3hkb h PRO 184 CO -0.54 0.04 -0.43 1.88 -0.21 0.00 0.00 178.00 178.73 3hkb h TYR 185 N 0.06 -1.23 -0.83 0.65 0.99 -1.71 -1.06 116.97 113.84 3hkb h TYR 185 Ca 0.37 0.04 0.09 0.00 2.00 0.00 0.00 58.73 61.23 3hkb h TYR 185 Cb 0.61 0.54 -0.07 0.00 1.00 0.00 0.00 36.73 38.81 3hkb h TYR 185 CO -0.48 -0.51 0.47 -0.91 -0.00 0.00 0.00 178.16 176.73 3hkb h ASN 186 N -0.62 0.68 0.33 3.88 2.35 -1.18 0.21 115.58 121.24 3hkb h ASN 186 Ca 0.03 0.05 -0.01 0.00 -0.55 0.00 0.00 56.30 55.82 3hkb h ASN 186 Cb 0.67 -0.08 -0.01 0.00 0.05 0.00 0.00 38.32 38.95 3hkb h ASN 186 CO -0.30 0.38 -0.32 0.28 -1.65 0.00 0.00 177.43 175.82 3hkb h SER 187 N 0.79 -0.88 -0.90 5.81 0.02 -0.69 -1.74 113.55 115.97 3hkb h SER 187 Ca 0.40 0.07 0.10 0.00 -0.84 0.00 0.00 61.79 61.52 3hkb h SER 187 Cb 0.36 0.29 -0.07 0.00 0.14 0.00 0.00 62.40 63.13 3hkb h SER 187 CO -0.25 -0.43 0.58 0.40 -1.14 0.00 0.00 176.83 175.99 3hkb h ILE 188 N -0.65 0.96 -0.25 3.27 1.08 -0.67 -1.15 117.51 120.10 3hkb h ILE 188 Ca -0.04 -0.30 -0.01 0.00 -0.39 0.00 0.00 64.86 64.12 3hkb h ILE 188 Cb 0.56 -0.00 -0.01 0.00 -3.07 0.00 0.00 36.82 34.30 3hkb h ILE 188 CO -0.03 0.16 0.13 -0.07 -0.69 0.00 0.00 178.15 177.65 3hkb h LEU 189 N 0.89 0.32 0.11 1.44 3.38 -0.44 -2.89 115.31 118.12 3hkb h LEU 189 Ca 0.42 -0.11 -0.01 0.00 0.09 0.00 0.00 57.88 58.27 3hkb h LEU 189 Cb 0.42 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.09 3hkb h LEU 189 CO -0.18 0.34 -0.05 0.00 0.09 0.00 0.00 178.44 178.64 3hkb h THR 190 N 0.28 0.69 -1.33 0.22 1.03 -0.72 -3.08 112.91 110.00 3hkb h THR 190 Ca 0.09 -1.26 0.39 0.00 -0.01 0.00 0.00 66.41 65.61 3hkb h THR 190 Cb 0.10 1.23 -0.05 0.00 -1.07 0.00 0.00 68.15 68.36 3hkb h THR 190 CO -0.01 0.21 1.04 0.00 -0.01 0.00 0.00 175.52 176.74 3hkb h THR 191 N -0.96 0.23 0.25 0.00 1.03 -1.31 1.61 112.91 113.76 3hkb h THR 191 Ca -0.02 0.00 -0.01 0.00 -0.01 0.00 0.00 66.41 66.37 3hkb h THR 191 Cb 0.46 0.26 0.00 0.00 -1.07 0.00 0.00 68.15 67.79 3hkb h THR 191 CO 0.03 0.00 -0.12 -0.74 -0.01 0.00 0.00 175.52 174.68 3hkb h HIS 192 N 0.00 -0.31 -0.14 0.00 6.17 -1.55 -2.81 115.15 116.52 3hkb h HIS 192 Ca 0.63 -0.01 -0.09 0.00 0.71 0.00 0.00 60.37 61.61 3hkb h HIS 192 Cb 2.70 0.10 -0.01 0.00 2.52 0.00 0.00 27.41 32.72 3hkb h HIS 192 CO 0.00 0.06 -0.31 1.15 0.71 0.00 0.00 177.93 179.54 3hkb h THR 193 N -0.87 1.27 0.00 6.26 2.02 0.22 -3.09 112.91 118.71 3hkb h THR 193 Ca -0.03 -1.28 -0.16 0.00 0.77 0.00 0.00 66.41 65.70 3hkb h THR 193 Cb 0.51 1.51 -0.02 0.00 -1.74 0.00 0.00 68.15 68.41 3hkb h THR 193 CO 0.06 0.39 -0.79 0.00 0.37 0.00 0.00 175.52 175.54 3hkb h THR 194 N 0.23 1.27 -0.03 3.16 1.03 -0.28 -3.41 112.91 114.89 3hkb h THR 194 Ca 0.03 -2.81 0.04 0.00 -0.01 0.00 0.00 66.41 63.65 3hkb h THR 194 Cb 0.67 2.62 -0.05 0.00 -1.07 0.00 0.00 68.15 70.32 3hkb h THR 194 CO 0.05 0.72 -0.32 0.25 -0.01 0.00 0.00 175.52 176.21 3hkb h LEU 195 N 0.00 -0.97 -0.42 0.00 5.85 -1.41 -0.27 115.31 118.10 3hkb h LEU 195 Ca -0.02 0.13 0.00 0.00 0.84 0.00 0.00 57.88 58.83 3hkb h LEU 195 Cb 1.59 0.39 0.00 0.00 0.37 0.00 0.00 40.66 43.01 3hkb h LEU 195 CO 0.10 -0.38 0.00 -1.84 -0.34 0.00 0.00 178.44 175.98 3hkb n GLU 196 N -5.41 0.82 0.00 1.25 0.28 -1.26 -3.10 120.64 113.21 3hkb n GLU 196 Ca -0.05 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 56.95 3hkb n GLU 196 Cb 0.33 -1.17 0.00 0.00 1.43 0.00 0.00 31.44 32.03 3hkb n GLU 196 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 177.13 177.69 3hkb n HIS 197 N -0.25 0.00 -2.86 -1.84 8.25 -0.17 -5.05 115.22 113.30 3hkb n HIS 197 Ca 0.00 0.00 -0.24 0.00 -0.26 0.00 0.00 57.72 57.22 3hkb n HIS 197 Cb 0.09 0.00 0.02 0.00 1.12 0.00 0.00 29.99 31.21 3hkb n HIS 197 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 3hkb s SER 198 N -1.19 5.78 -0.08 0.41 0.15 -0.85 -4.78 113.70 113.14 3hkb s SER 198 Ca 0.00 0.37 -0.02 0.00 0.70 0.00 0.00 55.95 57.00 3hkb s SER 198 Cb 0.00 -1.56 -0.04 0.00 -1.71 0.00 0.00 66.02 62.71 3hkb s SER 198 CO 0.00 -0.78 -0.09 0.47 1.20 0.00 0.00 173.24 174.04 3hkb n ASP 199 N -2.19 2.07 -3.75 5.45 9.92 0.34 -4.94 116.55 123.45 3hkb n ASP 199 Ca 0.02 0.03 -0.13 0.00 -0.53 0.00 0.00 54.79 54.18 3hkb n ASP 199 Cb 0.58 -0.18 -0.10 0.00 -0.64 0.00 0.00 41.12 40.78 3hkb n ASP 199 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 3hkb s ALA 201 N -0.25 0.73 -0.42 0.00 0.00 -0.89 -1.76 121.76 119.16 3hkb s ALA 201 Ca -0.04 -0.12 -0.14 0.00 0.00 0.00 0.00 51.96 51.67 3hkb s ALA 201 Cb -0.03 -0.57 0.04 0.00 0.00 0.00 0.00 23.12 22.56 3hkb s ALA 201 CO 0.02 -0.19 0.30 -0.06 0.00 0.00 0.00 175.76 175.82 3hkb s PHE 202 N 1.33 3.25 0.31 0.00 0.40 0.23 -3.66 117.98 119.84 3hkb s PHE 202 Ca -0.05 -0.81 -0.20 0.00 -0.60 0.00 0.00 56.93 55.27 3hkb s PHE 202 Cb -0.13 -2.71 -0.09 0.00 0.51 0.00 0.00 43.02 40.60 3hkb s PHE 202 CO -0.02 -0.67 0.82 -1.64 0.70 0.00 0.00 175.22 174.41 3hkb s MET 203 N 1.63 4.25 -0.21 0.44 -1.94 -1.26 -1.92 119.30 120.28 3hkb s MET 203 Ca 0.04 0.97 -0.01 0.00 -1.71 0.00 0.00 55.69 54.98 3hkb s MET 203 Cb -0.20 -2.60 0.06 0.00 2.01 0.00 0.00 34.83 34.09 3hkb s MET 203 CO 0.08 0.22 -0.02 0.08 -0.01 0.00 0.00 175.02 175.37 3hkb s VAL 204 N -1.80 1.13 -0.59 -6.03 1.01 0.13 -4.67 120.40 109.59 3hkb s VAL 204 Ca 0.51 -0.93 -0.28 0.00 0.00 0.00 0.00 61.98 61.28 3hkb s VAL 204 Cb -0.14 -1.48 0.03 0.00 0.00 0.00 0.00 36.38 34.79 3hkb s VAL 204 CO 0.19 -0.12 1.24 -0.62 0.00 0.00 0.00 175.10 175.79 3hkb s ASP 205 N 1.58 6.37 0.53 3.32 -1.08 0.63 0.08 116.67 128.10 3hkb s ASP 205 Ca -0.04 0.09 0.33 0.00 -0.52 0.00 0.00 52.55 52.42 3hkb s ASP 205 Cb -0.18 -2.55 1.49 0.00 -1.46 0.00 0.00 42.92 40.21 3hkb s ASP 205 CO -0.07 -1.55 1.83 0.78 0.52 0.00 0.00 175.17 176.68 3hkb h ASN 206 N 9.83 0.04 -0.40 -0.34 -0.26 -1.65 0.28 115.58 123.09 3hkb h ASN 206 Ca -0.26 0.01 -0.10 0.00 -0.56 0.00 0.00 56.30 55.39 3hkb h ASN 206 Cb 1.06 0.00 -0.01 0.00 -1.06 0.00 0.00 38.32 38.31 3hkb h ASN 206 CO 1.19 0.01 -0.14 -0.08 -1.06 0.00 0.00 177.43 177.35 3hkb h GLU 207 N 0.04 0.79 0.28 0.81 4.81 -1.89 -0.51 114.58 118.93 3hkb h GLU 207 Ca 0.52 -0.33 -0.01 0.00 -0.13 0.00 0.00 59.36 59.41 3hkb h GLU 207 Cb 2.01 -0.03 0.00 0.00 0.63 0.00 0.00 28.75 31.36 3hkb h GLU 207 CO -0.03 0.95 -0.14 0.00 -0.73 0.00 0.00 179.01 179.06 3hkb h ALA 208 N 0.83 -0.38 0.00 2.92 0.00 -0.81 0.52 119.26 122.34 3hkb h ALA 208 Ca 0.09 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 3hkb h ALA 208 Cb 0.68 0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.62 3hkb h ALA 208 CO 0.05 -0.65 -0.03 0.82 0.00 0.00 0.00 179.25 179.44 3hkb h ILE 209 N -0.51 0.98 0.10 0.00 1.08 -1.27 0.35 117.51 118.25 3hkb h ILE 209 Ca -0.04 -0.09 -0.28 0.00 -0.39 0.00 0.00 64.86 64.05 3hkb h ILE 209 Cb 0.38 1.05 0.02 0.00 -3.07 0.00 0.00 36.82 35.20 3hkb h ILE 209 CO 0.06 0.03 -1.20 0.22 -0.69 0.00 0.00 178.15 176.57 3hkb h TYR 210 N 0.00 0.87 -0.21 1.37 5.03 -0.82 -3.09 116.97 120.11 3hkb h TYR 210 Ca -0.00 -0.55 -0.10 0.00 2.58 0.00 0.00 58.73 60.66 3hkb h TYR 210 Cb 0.05 -0.07 -0.01 0.00 1.55 0.00 0.00 36.73 38.25 3hkb h TYR 210 CO 0.00 1.39 -0.31 -0.44 -1.32 0.00 0.00 178.16 177.49 3hkb h ASP 211 N 0.24 0.43 0.02 -2.11 3.45 0.23 -2.36 116.42 116.31 3hkb h ASP 211 Ca -0.16 -0.16 -0.11 0.00 0.43 0.00 0.00 57.03 57.03 3hkb h ASP 211 Cb 1.87 -0.12 -0.01 0.00 -0.56 0.00 0.00 39.33 40.51 3hkb h ASP 211 CO 0.22 0.72 -0.35 0.40 -1.57 0.00 0.00 179.24 178.66 3hkb h ILE 212 N 0.36 1.29 0.00 0.35 5.03 -0.49 -1.83 117.51 122.23 3hkb h ILE 212 Ca 0.05 -1.45 -0.03 0.00 -0.12 0.00 0.00 64.86 63.30 3hkb h ILE 212 Cb 0.72 1.51 -0.00 0.00 -3.03 0.00 0.00 36.82 36.02 3hkb h ILE 212 CO 0.06 0.45 -0.15 0.00 -0.68 0.00 0.00 178.15 177.83 3hkb n ARG 214 N -3.42 0.68 -0.04 0.00 1.74 -0.97 -2.10 116.66 112.54 3hkb n ARG 214 Ca -0.01 0.30 -0.15 0.00 -0.77 0.00 0.00 57.85 57.22 3hkb n ARG 214 Cb 0.33 -1.65 -0.07 0.00 -1.02 0.00 0.00 32.46 30.05 3hkb n ARG 214 CO 0.00 0.00 0.00 -0.09 -1.52 0.00 0.00 177.63 176.02 3hkb h ARG 215 N -0.29 0.59 0.01 5.56 2.43 -1.38 -3.08 114.38 118.22 3hkb h ARG 215 Ca -0.47 -0.43 -0.28 0.00 -0.81 0.00 0.00 59.98 57.99 3hkb h ARG 215 Cb 1.81 0.07 -0.04 0.00 -0.42 0.00 0.00 29.97 31.39 3hkb h ARG 215 CO -0.07 1.05 -1.53 0.09 -1.51 0.00 0.00 179.97 178.00 3hkb n ASN 216 N -4.22 1.89 0.07 -3.80 5.03 0.10 -4.27 115.26 110.06 3hkb n ASN 216 Ca -0.07 0.39 0.12 0.00 0.87 0.00 0.00 54.58 55.90 3hkb n ASN 216 Cb 0.58 -0.93 0.26 0.00 -1.02 0.00 0.00 39.78 38.66 3hkb n ASN 216 CO 0.00 0.00 0.00 0.18 -1.83 0.00 0.00 177.26 175.61 3hkb n LEU 217 N -4.34 0.69 -1.83 3.41 4.32 -1.16 -4.32 117.00 113.76 3hkb n LEU 217 Ca -0.36 0.31 -0.18 0.00 -0.02 0.00 0.00 56.01 55.77 3hkb n LEU 217 Cb 0.74 -0.24 -0.03 0.00 -1.62 0.00 0.00 43.42 42.28 3hkb n LEU 217 CO 0.17 -0.07 -0.21 -0.67 -1.22 0.00 0.00 177.39 175.39 3hkb n ASP 218 N -2.08 -5.15 -4.61 -1.43 -0.08 -0.98 -4.94 116.55 97.27 3hkb n ASP 218 Ca 0.04 0.11 -0.43 0.00 -1.51 0.00 0.00 54.79 53.00 3hkb n ASP 218 Cb 0.43 -4.23 -0.02 0.00 2.34 0.00 0.00 41.12 39.64 3hkb n ASP 218 CO 0.00 0.00 0.00 -0.63 0.12 0.00 0.00 177.20 176.69 3hkb s ILE 219 N -2.82 4.33 0.25 5.18 1.01 -0.89 -4.92 121.20 123.33 3hkb s ILE 219 Ca 0.00 1.35 -0.05 0.00 0.00 0.00 0.00 60.65 61.95 3hkb s ILE 219 Cb 0.00 -4.52 0.24 0.00 0.01 0.00 0.00 42.46 38.19 3hkb s ILE 219 CO 0.00 -0.82 1.68 -0.33 0.00 0.00 0.00 174.94 175.47 3hkb h GLU 220 N 8.84 0.24 -1.83 2.79 4.39 -1.92 -3.34 114.58 123.75 3hkb h GLU 220 Ca -0.22 -0.01 -0.31 0.00 0.34 0.00 0.00 59.36 59.16 3hkb h GLU 220 Cb 1.06 -0.05 -0.30 0.00 -0.10 0.00 0.00 28.75 29.36 3hkb h GLU 220 CO 1.09 0.16 -0.64 1.03 -1.16 0.00 0.00 179.01 179.49 3hkb s ARG 221 N -6.05 0.60 0.57 2.33 0.52 -1.26 -5.04 118.95 110.63 3hkb s ARG 221 Ca -0.13 -0.59 -0.20 0.00 -0.52 0.00 0.00 55.73 54.29 3hkb s ARG 221 Cb 0.21 -0.57 -0.05 0.00 0.52 0.00 0.00 34.95 35.07 3hkb s ARG 221 CO 0.76 -1.16 1.17 -0.35 0.02 0.00 0.00 175.30 175.74 3hkb n PRO 222 N 4.52 1.27 -1.12 3.54 -0.04 -1.25 -5.05 135.00 136.87 3hkb n PRO 222 Ca 0.08 0.48 -0.30 0.00 -0.04 0.00 0.00 63.50 63.73 3hkb n PRO 222 Cb 0.47 -2.37 0.24 0.00 -0.04 0.00 0.00 33.50 31.81 3hkb n PRO 222 CO 0.00 0.00 0.00 2.41 -0.04 0.00 0.00 175.50 177.87 3hkb n THR 223 N -1.39 0.00 0.06 0.52 -1.04 -1.26 -4.93 114.28 106.24 3hkb n THR 223 Ca 0.12 -0.53 -0.21 0.00 -2.04 0.00 0.00 64.05 61.40 3hkb n THR 223 Cb 0.46 -1.27 -0.11 0.00 -1.82 0.00 0.00 70.33 67.59 3hkb n THR 223 CO 0.00 0.00 0.00 1.88 -0.64 0.00 0.00 175.07 176.31 3hkb h TYR 224 N -2.62 1.03 0.00 -1.42 0.99 -1.98 -2.96 116.97 110.01 3hkb h TYR 224 Ca -0.41 -0.59 -0.04 0.00 2.00 0.00 0.00 58.73 59.69 3hkb h TYR 224 Cb 1.23 -0.10 -0.01 0.00 1.00 0.00 0.00 36.73 38.86 3hkb h TYR 224 CO 0.00 1.43 -0.19 1.79 -0.00 0.00 0.00 178.16 181.19 3hkb h THR 225 N 0.35 0.54 0.14 -2.88 1.35 -1.98 1.12 112.91 111.55 3hkb h THR 225 Ca -0.15 -0.95 -0.01 0.00 -0.55 0.00 0.00 66.41 64.75 3hkb h THR 225 Cb 1.78 1.65 0.00 0.00 -1.73 0.00 0.00 68.15 69.85 3hkb h THR 225 CO 0.22 0.19 -0.07 0.78 -0.25 0.00 0.00 175.52 176.39 3hkb h ASN 226 N 0.00 -0.15 -0.29 5.36 -0.26 -1.92 -2.74 115.58 115.58 3hkb h ASN 226 Ca -0.00 -0.27 -0.01 0.00 -0.56 0.00 0.00 56.30 55.46 3hkb h ASN 226 Cb 0.63 0.04 -0.01 0.00 -1.06 0.00 0.00 38.32 37.92 3hkb h ASN 226 CO 0.03 0.20 0.14 -0.07 -1.06 0.00 0.00 177.43 176.67 3hkb h LEU 227 N -0.53 0.37 -0.59 1.61 4.07 -1.25 -3.28 115.31 115.70 3hkb h LEU 227 Ca -0.02 -0.12 0.06 0.00 0.08 0.00 0.00 57.88 57.88 3hkb h LEU 227 Cb 0.42 -0.10 -0.05 0.00 1.08 0.00 0.00 40.66 42.01 3hkb h LEU 227 CO 0.03 0.38 0.31 0.78 -1.08 0.00 0.00 178.44 178.86 3hkb h ASN 228 N 0.33 0.43 -0.71 -0.43 2.35 0.13 -2.00 115.58 115.68 3hkb h ASN 228 Ca 0.10 0.04 0.04 0.00 -0.55 0.00 0.00 56.30 55.93 3hkb h ASN 228 Cb 0.11 -0.04 -0.05 0.00 0.05 0.00 0.00 38.32 38.39 3hkb h ASN 228 CO -0.01 0.28 0.43 0.03 -1.65 0.00 0.00 177.43 176.51 3hkb h ARG 229 N 0.57 0.80 0.07 0.81 3.08 -1.56 0.30 114.38 118.46 3hkb h ARG 229 Ca 0.27 -0.05 0.00 0.00 0.07 0.00 0.00 59.98 60.28 3hkb h ARG 229 Cb 0.19 -0.18 -0.01 0.00 0.08 0.00 0.00 29.97 30.05 3hkb h ARG 229 CO -0.19 0.53 -0.08 1.25 -1.07 0.00 0.00 179.97 180.41 3hkb h LEU 230 N 0.82 -0.20 -0.20 3.04 5.85 -1.50 -2.20 115.31 120.91 3hkb h LEU 230 Ca 0.30 0.02 0.02 0.00 0.84 0.00 0.00 57.88 59.06 3hkb h LEU 230 Cb 0.08 0.07 -0.02 0.00 0.37 0.00 0.00 40.66 41.16 3hkb h LEU 230 CO -0.14 -0.12 0.06 0.40 -0.34 0.00 0.00 178.44 178.31 3hkb h ILE 231 N -0.17 0.94 -0.91 4.05 2.04 -0.96 -0.84 117.51 121.67 3hkb h ILE 231 Ca 0.01 -0.05 0.17 0.00 1.00 0.00 0.00 64.86 65.99 3hkb h ILE 231 Cb 0.17 0.77 -0.17 0.00 -0.74 0.00 0.00 36.82 36.85 3hkb h ILE 231 CO -0.03 0.03 -0.25 0.61 0.00 0.00 0.00 178.15 178.51 3hkb n GLY 232 N -1.17 -1.58 0.16 5.37 0.00 0.10 0.02 105.19 108.09 3hkb n GLY 232 Ca -0.03 0.98 -0.10 0.00 0.00 0.00 0.00 46.02 46.88 3hkb n GLY 232 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 3hkb h GLN 233 N 0.00 0.45 -0.58 1.61 5.75 -0.53 0.25 115.11 122.05 3hkb h GLN 233 Ca 0.41 -0.07 -0.05 0.00 -0.15 0.00 0.00 58.65 58.80 3hkb h GLN 233 Cb 0.64 -0.08 -0.02 0.00 1.07 0.00 0.00 27.48 29.09 3hkb h GLN 233 CO -0.93 0.42 0.17 0.82 -2.65 0.00 0.00 178.83 176.66 3hkb h ILE 234 N 0.36 1.24 -0.54 2.39 5.03 -0.28 -0.01 117.51 125.70 3hkb h ILE 234 Ca 0.11 -0.85 -0.03 0.00 -0.12 0.00 0.00 64.86 63.97 3hkb h ILE 234 Cb 0.13 0.69 -0.02 0.00 -3.03 0.00 0.00 36.82 34.58 3hkb h ILE 234 CO -0.01 0.32 0.22 0.58 -0.68 0.00 0.00 178.15 178.57 3hkb h VAL 235 N 0.83 1.22 -0.69 1.67 2.07 -0.25 -2.39 116.25 118.71 3hkb h VAL 235 Ca 0.19 -0.68 0.00 0.00 0.82 0.00 0.00 66.70 67.02 3hkb h VAL 235 Cb 0.31 0.65 -0.03 0.00 -1.52 0.00 0.00 31.29 30.70 3hkb h VAL 235 CO -0.00 0.26 0.43 -1.28 0.02 0.00 0.00 177.57 177.00 3hkb h SER 236 N 0.74 0.81 -0.02 0.57 0.87 -0.22 -1.81 113.55 114.49 3hkb h SER 236 Ca 0.18 -0.04 0.01 0.00 -1.23 0.00 0.00 61.79 60.70 3hkb h SER 236 Cb 0.20 -0.20 -0.00 0.00 -0.44 0.00 0.00 62.40 61.95 3hkb h SER 236 CO -0.01 0.62 0.01 0.28 -0.53 0.00 0.00 176.83 177.19 3hkb h SER 237 N 0.94 0.00 0.03 6.23 0.02 -0.52 0.22 113.55 120.46 3hkb h SER 237 Ca 0.25 0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 61.20 3hkb h SER 237 Cb -0.06 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.48 3hkb h SER 237 CO -0.05 0.00 -0.01 0.40 -1.14 0.00 0.00 176.83 176.03 3hkb h ILE 238 N 0.00 1.27 -0.65 3.27 2.04 -0.91 -3.36 117.51 119.16 3hkb h ILE 238 Ca 0.01 -1.77 -0.07 0.00 1.00 0.00 0.00 64.86 64.03 3hkb h ILE 238 Cb 0.04 2.32 -0.03 0.00 -0.74 0.00 0.00 36.82 38.41 3hkb h ILE 238 CO -0.00 0.40 0.13 0.71 0.00 0.00 0.00 178.15 179.39 3hkb h THR 239 N -0.92 1.26 0.00 -0.27 1.35 -1.06 -3.31 112.91 109.96 3hkb h THR 239 Ca -0.00 -0.98 0.00 0.00 -0.55 0.00 0.00 66.41 64.87 3hkb h THR 239 Cb 0.69 0.64 0.00 0.00 -1.73 0.00 0.00 68.15 67.75 3hkb h THR 239 CO 0.01 0.37 0.00 0.00 -0.25 0.00 0.00 175.52 175.65 3hkb n ALA 240 N -2.45 0.00 -0.29 6.62 0.00 0.74 0.30 120.51 125.43 3hkb n ALA 240 Ca 0.04 0.00 0.08 0.00 0.00 0.00 0.00 53.44 53.56 3hkb n ALA 240 Cb 0.27 0.00 0.19 0.00 0.00 0.00 0.00 19.45 19.91 3hkb n ALA 240 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 3hkb h SER 241 N 0.00 -0.45 0.50 0.00 0.02 -1.80 -0.18 113.55 111.64 3hkb h SER 241 Ca 0.00 0.23 0.00 0.00 -0.84 0.00 0.00 61.79 61.18 3hkb h SER 241 Cb 0.00 0.41 0.00 0.00 0.14 0.00 0.00 62.40 62.95 3hkb h SER 241 CO 0.00 -0.24 -0.41 0.00 -1.14 0.00 0.00 176.83 175.03 3hkb n LEU 242 N -5.42 0.53 -0.03 5.07 -0.00 0.89 -2.07 117.00 115.97 3hkb n LEU 242 Ca 0.16 0.00 -0.20 0.00 -0.00 0.00 0.00 56.01 55.98 3hkb n LEU 242 Cb 0.55 -0.25 -0.13 0.00 -0.00 0.00 0.00 43.42 43.59 3hkb n LEU 242 CO -0.00 0.12 -0.95 0.54 -0.00 0.00 0.00 177.39 177.10 3hkb n ARG 243 N -1.36 0.73 -0.06 1.47 1.74 -0.47 -4.54 116.66 114.17 3hkb n ARG 243 Ca 0.07 0.23 -0.07 0.00 -0.77 0.00 0.00 57.85 57.31 3hkb n ARG 243 Cb 0.34 -1.66 -0.15 0.00 -1.02 0.00 0.00 32.46 29.97 3hkb n ARG 243 CO 0.00 0.00 0.00 1.19 -1.52 0.00 0.00 177.63 177.30 3hkb n PHE 244 N -3.41 0.42 -1.43 -1.55 3.01 -0.20 -3.15 117.46 111.14 3hkb n PHE 244 Ca -0.35 0.15 0.00 0.00 1.01 0.00 0.00 57.45 58.26 3hkb n PHE 244 Cb 1.03 -1.04 0.00 0.00 -0.01 0.00 0.00 39.48 39.46 3hkb n PHE 244 CO 0.00 0.00 0.00 -3.47 1.01 0.00 0.00 176.76 174.30 3hkb n ASP 245 N -2.83 -5.27 -2.65 4.37 2.03 -0.88 -4.90 116.55 106.42 3hkb n ASP 245 Ca -0.24 0.74 -0.03 0.00 0.52 0.00 0.00 54.79 55.78 3hkb n ASP 245 Cb 1.06 -2.85 -0.00 0.00 -0.72 0.00 0.00 41.12 38.60 3hkb n ASP 245 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 3hkb n GLY 246 N 0.83 -1.12 1.45 0.27 0.00 -1.25 -5.08 105.19 100.30 3hkb n GLY 246 Ca 0.00 0.18 0.19 0.00 0.00 0.00 0.00 46.02 46.38 3hkb n GLY 246 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hkb n ALA 247 N -0.32 -3.78 -2.85 4.61 0.00 -1.26 -4.73 120.51 112.18 3hkb n ALA 247 Ca -0.26 0.69 -0.02 0.00 0.00 0.00 0.00 53.44 53.84 3hkb n ALA 247 Cb 0.65 -1.44 -0.02 0.00 0.00 0.00 0.00 19.45 18.65 3hkb n ALA 247 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 3hkb n LEU 248 N -4.32 -5.93 -3.59 0.00 0.00 -1.26 -4.16 117.00 97.74 3hkb n LEU 248 Ca -0.04 1.43 -0.23 0.00 0.00 0.00 0.00 56.01 57.17 3hkb n LEU 248 Cb 0.68 -2.64 0.07 0.00 0.00 0.00 0.00 43.42 41.53 3hkb n LEU 248 CO 0.03 -3.07 0.18 0.59 0.00 0.00 0.00 177.39 175.12 3hkb n ASN 249 N 1.50 -4.84 0.00 1.96 5.03 -1.26 -4.77 115.26 112.88 3hkb n ASN 249 Ca -0.13 -0.60 0.09 0.00 0.87 0.00 0.00 54.58 54.81 3hkb n ASN 249 Cb 0.31 -4.90 0.42 0.00 -1.02 0.00 0.00 39.78 34.59 3hkb n ASN 249 CO 0.00 0.00 0.00 0.55 -1.83 0.00 0.00 177.26 175.98 3hkb n VAL 250 N -4.72 0.63 -3.63 2.41 3.14 -1.26 -3.37 118.33 111.54 3hkb n VAL 250 Ca -0.08 0.16 -0.08 0.00 -2.96 0.00 0.00 64.34 61.37 3hkb n VAL 250 Cb 0.59 -0.85 -0.06 0.00 -1.06 0.00 0.00 33.84 32.46 3hkb n VAL 250 CO 0.00 0.00 0.00 1.51 -6.46 0.00 0.00 176.83 171.88 3hkb s ASP 251 N -2.84 -0.36 0.34 6.55 1.47 -1.26 -4.42 116.67 116.15 3hkb s ASP 251 Ca 0.12 0.63 0.14 0.00 1.18 0.00 0.00 52.55 54.62 3hkb s ASP 251 Cb 0.12 0.61 1.09 0.00 -0.34 0.00 0.00 42.92 44.40 3hkb s ASP 251 CO 0.31 -0.17 1.63 -0.07 0.68 0.00 0.00 175.17 177.55 3hkb h LEU 252 N 3.60 0.33 -0.72 2.11 3.38 -1.88 0.96 115.31 123.09 3hkb h LEU 252 Ca -0.25 0.22 0.12 0.00 0.09 0.00 0.00 57.88 58.05 3hkb h LEU 252 Cb 1.18 0.21 -0.08 0.00 0.09 0.00 0.00 40.66 42.06 3hkb h LEU 252 CO 0.17 -0.24 0.30 0.74 0.09 0.00 0.00 178.44 179.51 3hkb h THR 253 N 0.20 0.74 -0.80 0.22 2.02 -1.97 -1.87 112.91 111.44 3hkb h THR 253 Ca 0.73 -0.17 0.14 0.00 0.77 0.00 0.00 66.41 67.88 3hkb h THR 253 Cb 1.73 0.21 -0.06 0.00 -1.74 0.00 0.00 68.15 68.29 3hkb h THR 253 CO -0.68 0.09 0.53 -0.33 0.37 0.00 0.00 175.52 175.50 3hkb h GLU 254 N 0.49 0.55 0.32 6.66 5.08 -1.19 -1.09 114.58 125.40 3hkb h GLU 254 Ca 0.38 -0.03 -0.00 0.00 -1.00 0.00 0.00 59.36 58.70 3hkb h GLU 254 Cb 0.50 -0.12 -0.03 0.00 0.50 0.00 0.00 28.75 29.60 3hkb h GLU 254 CO -0.35 0.36 -0.51 0.74 -1.00 0.00 0.00 179.01 178.26 3hkb h PHE 255 N 0.56 -1.44 -0.05 4.33 0.04 -1.49 0.34 116.94 119.23 3hkb h PHE 255 Ca 0.39 0.02 0.04 0.00 2.80 0.00 0.00 57.97 61.22 3hkb h PHE 255 Cb 0.72 0.59 -0.06 0.00 2.20 0.00 0.00 35.95 39.40 3hkb h PHE 255 CO -0.00 -0.63 -0.36 0.37 -0.60 0.00 0.00 178.31 177.09 3hkb h GLN 256 N -0.87 -0.47 -0.79 1.51 -0.00 -1.46 0.24 115.11 113.27 3hkb h GLN 256 Ca -0.04 0.03 0.15 0.00 -0.00 0.00 0.00 58.65 58.80 3hkb h GLN 256 Cb 0.81 0.11 -0.15 0.00 0.00 0.00 0.00 27.48 28.25 3hkb h GLN 256 CO -0.16 -0.31 -0.25 1.15 0.00 0.00 0.00 178.83 179.26 3hkb h THR 257 N -0.49 0.17 0.10 2.39 2.02 -0.91 -1.70 112.91 114.49 3hkb h THR 257 Ca 0.07 0.00 -0.31 0.00 0.77 0.00 0.00 66.41 66.94 3hkb h THR 257 Cb 0.59 0.17 -0.01 0.00 -1.74 0.00 0.00 68.15 67.16 3hkb h THR 257 CO -0.32 0.00 -1.57 0.78 0.37 0.00 0.00 175.52 174.79 3hkb h ASN 258 N -0.03 0.33 0.06 4.18 -0.26 0.11 -3.41 115.58 116.56 3hkb h ASN 258 Ca 0.36 -0.49 -0.37 0.00 -0.56 0.00 0.00 56.30 55.23 3hkb h ASN 258 Cb 0.59 -0.11 -0.06 0.00 -1.06 0.00 0.00 38.32 37.68 3hkb h ASN 258 CO -0.82 1.42 -2.31 0.18 -1.06 0.00 0.00 177.43 174.83 3hkb n LEU 259 N -3.41 2.25 -4.47 1.61 4.77 0.81 -4.80 117.00 113.76 3hkb n LEU 259 Ca -0.17 -0.00 -0.36 0.00 -0.03 0.00 0.00 56.01 55.44 3hkb n LEU 259 Cb 1.04 -0.64 -0.12 0.00 -2.33 0.00 0.00 43.42 41.37 3hkb n LEU 259 CO 0.49 0.81 -0.27 0.68 -1.33 0.00 0.00 177.39 177.77 3hkb s VAL 260 N -2.53 4.44 -0.18 4.08 -7.23 -0.65 -4.66 120.40 113.68 3hkb s VAL 260 Ca -0.26 -0.13 0.20 0.00 -1.81 0.00 0.00 61.98 59.98 3hkb s VAL 260 Cb 0.08 -3.07 -0.06 0.00 0.56 0.00 0.00 36.38 33.89 3hkb s VAL 260 CO 0.69 0.34 0.96 1.55 -0.31 0.00 0.00 175.10 178.33 3hkb h PRO 261 N 8.11 0.00 -3.74 4.82 0.13 -1.84 -3.44 132.00 136.05 3hkb h PRO 261 Ca -0.38 0.00 -0.33 0.00 -0.87 0.00 0.00 66.00 64.42 3hkb h PRO 261 Cb 1.18 0.00 -0.33 0.00 0.13 0.00 0.00 31.00 31.98 3hkb h PRO 261 CO 0.58 0.15 -0.74 0.71 -0.23 0.00 0.00 178.00 178.47 3hkb s TYR 262 N -3.14 0.27 0.29 1.56 1.51 -1.26 -5.04 117.35 111.54 3hkb s TYR 262 Ca -0.01 0.01 0.13 0.00 -1.01 0.00 0.00 57.07 56.18 3hkb s TYR 262 Cb 0.09 -0.35 0.98 0.00 -0.11 0.00 0.00 41.96 42.57 3hkb s TYR 262 CO 0.80 -0.11 1.29 -2.30 -1.11 0.00 0.00 175.55 174.12 3hkb n PRO 263 N 3.97 -0.05 0.00 -1.71 -0.02 -1.26 -3.51 135.00 132.41 3hkb n PRO 263 Ca -0.25 1.15 0.00 0.00 -2.02 0.00 0.00 63.50 62.38 3hkb n PRO 263 Cb 0.52 -2.00 0.00 0.00 -0.02 0.00 0.00 33.50 31.99 3hkb n PRO 263 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 3hkb n ARG 264 N -4.93 0.00 -2.41 -0.52 1.74 -1.26 -4.61 116.66 104.67 3hkb n ARG 264 Ca 0.28 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.36 3hkb n ARG 264 Cb 0.94 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 32.38 3hkb n ARG 264 CO 0.00 0.00 0.00 -0.89 -1.52 0.00 0.00 177.63 175.22 3hkb n ILE 265 N 0.00 0.00 0.56 0.55 -0.00 -1.23 -4.66 119.36 114.57 3hkb n ILE 265 Ca 0.00 0.00 0.12 0.00 -0.00 0.00 0.00 62.75 62.87 3hkb n ILE 265 Cb 0.00 0.00 0.26 0.00 -0.00 0.00 0.00 39.64 39.90 3hkb n ILE 265 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.55 177.00 3hkb h HIS 266 N 1.99 0.00 -3.32 1.39 3.86 -1.81 -3.43 115.15 113.83 3hkb h HIS 266 Ca 0.00 0.00 -0.73 0.00 -1.16 0.00 0.00 60.37 58.48 3hkb h HIS 266 Cb 0.00 0.00 -0.26 0.00 1.06 0.00 0.00 27.41 28.21 3hkb h HIS 266 CO 0.00 0.00 -0.37 -0.06 0.86 0.00 0.00 177.93 178.36 3hkb s PHE 267 N -3.15 3.32 0.33 2.45 0.40 -1.26 -2.11 117.98 117.96 3hkb s PHE 267 Ca 0.08 -1.40 -0.16 0.00 -0.60 0.00 0.00 56.93 54.84 3hkb s PHE 267 Cb 0.12 -3.27 -0.09 0.00 0.51 0.00 0.00 43.02 40.29 3hkb s PHE 267 CO 0.67 -0.89 0.77 -2.14 0.70 0.00 0.00 175.22 174.33 3hkb s PRO 268 N 1.50 4.07 -0.31 0.24 0.02 -1.24 -4.58 135.00 134.71 3hkb s PRO 268 Ca 0.04 0.77 -0.16 0.00 0.02 0.00 0.00 61.00 61.66 3hkb s PRO 268 Cb -0.25 -2.44 -0.02 0.00 0.02 0.00 0.00 34.50 31.80 3hkb s PRO 268 CO 0.03 0.15 0.44 -1.17 -0.33 0.00 0.00 177.00 176.12 3hkb s LEU 269 N -2.90 4.21 -0.04 -5.54 0.20 0.10 -4.25 118.68 110.46 3hkb s LEU 269 Ca 0.54 0.13 -0.17 0.00 0.69 0.00 0.00 54.13 55.33 3hkb s LEU 269 Cb -0.11 -2.50 -0.05 0.00 -0.43 0.00 0.00 46.19 43.10 3hkb s LEU 269 CO 0.17 -0.32 0.46 0.00 -0.29 0.00 0.00 176.35 176.37 3hkb s ALA 270 N 2.21 3.58 -0.12 5.97 0.00 -1.26 -1.89 121.76 130.25 3hkb s ALA 270 Ca 0.17 -0.17 -0.02 0.00 0.00 0.00 0.00 51.96 51.93 3hkb s ALA 270 Cb -0.16 -2.54 0.04 0.00 0.00 0.00 0.00 23.12 20.46 3hkb s ALA 270 CO 0.11 0.25 0.03 0.99 0.00 0.00 0.00 175.76 177.14 3hkb s THR 271 N -0.31 0.28 0.06 0.00 2.01 -1.10 -3.10 115.64 113.48 3hkb s THR 271 Ca 0.25 -0.07 0.02 0.00 0.31 0.00 0.00 61.69 62.20 3hkb s THR 271 Cb -0.16 -0.63 -0.04 0.00 0.01 0.00 0.00 72.50 71.68 3hkb s THR 271 CO 0.13 0.03 0.12 -0.47 -0.69 0.00 0.00 174.62 173.74 3hkb s TYR 272 N 1.99 3.30 0.00 4.92 5.04 -1.23 -4.01 117.35 127.37 3hkb s TYR 272 Ca 0.03 0.15 0.00 0.00 -2.44 0.00 0.00 57.07 54.80 3hkb s TYR 272 Cb -0.14 -1.68 0.00 0.00 0.35 0.00 0.00 41.96 40.49 3hkb s TYR 272 CO -0.06 0.55 0.00 0.00 -1.34 0.00 0.00 175.55 174.69 3hkb n ALA 273 N 0.49 0.00 -2.58 3.97 0.00 -1.04 -4.73 120.51 116.63 3hkb n ALA 273 Ca -0.08 0.00 -0.41 0.00 0.00 0.00 0.00 53.44 52.95 3hkb n ALA 273 Cb 0.52 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.90 3hkb n ALA 273 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 3hkb s PRO 274 N 0.00 3.76 -0.40 0.00 0.04 -1.26 -4.92 135.00 132.22 3hkb s PRO 274 Ca 0.00 0.13 -0.05 0.00 0.04 0.00 0.00 61.00 61.12 3hkb s PRO 274 Cb 0.00 -3.78 0.09 0.00 0.04 0.00 0.00 34.50 30.85 3hkb s PRO 274 CO 0.00 -0.67 0.20 0.08 0.04 0.00 0.00 177.00 176.65 3hkb s VAL 275 N 2.65 3.58 -0.11 -0.36 1.01 -1.26 -5.05 120.40 120.85 3hkb s VAL 275 Ca 0.24 -1.74 -0.02 0.00 0.00 0.00 0.00 61.98 60.46 3hkb s VAL 275 Cb -0.15 -3.30 0.04 0.00 0.00 0.00 0.00 36.38 32.97 3hkb s VAL 275 CO 0.14 -0.55 0.04 -0.51 0.00 0.00 0.00 175.10 174.21 3hkb s ILE 276 N 1.26 0.24 0.01 2.22 1.10 -1.26 -4.82 121.20 119.95 3hkb s ILE 276 Ca 0.04 -0.03 -0.33 0.00 -0.51 0.00 0.00 60.65 59.82 3hkb s ILE 276 Cb -0.23 -0.59 -0.11 0.00 0.15 0.00 0.00 42.46 41.68 3hkb s ILE 276 CO -0.02 0.04 1.84 -1.54 -2.11 0.00 0.00 174.94 173.16 3hkb n SER 277 N 5.17 3.63 -4.62 4.50 3.41 -1.26 -1.91 113.62 122.54 3hkb n SER 277 Ca -0.07 0.98 -0.45 0.00 -0.26 0.00 0.00 58.87 59.07 3hkb n SER 277 Cb 0.49 -1.44 -0.02 0.00 -0.26 0.00 0.00 64.21 62.99 3hkb n SER 277 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3hkb n ALA 278 N 6.12 0.18 0.00 7.33 0.00 0.08 -0.07 120.51 134.15 3hkb n ALA 278 Ca 0.20 0.40 0.00 0.00 0.00 0.00 0.00 53.44 54.04 3hkb n ALA 278 Cb 0.33 -2.10 0.00 0.00 0.00 0.00 0.00 19.45 17.68 3hkb n ALA 278 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 3hkb n GLU 279 N 0.99 0.00 0.00 0.00 0.00 -1.26 -4.77 120.64 115.60 3hkb n GLU 279 Ca 0.10 0.00 0.12 0.00 0.00 0.00 0.00 57.16 57.38 3hkb n GLU 279 Cb 0.32 0.00 0.27 0.00 0.00 0.00 0.00 31.44 32.03 3hkb n GLU 279 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.13 178.76 3hkb n LYS 280 N -0.19 0.73 -0.29 5.31 5.02 0.90 -4.61 118.16 125.03 3hkb n LYS 280 Ca 0.00 -0.48 0.11 0.00 -2.02 0.00 0.00 58.31 55.93 3hkb n LYS 280 Cb 0.00 -1.49 0.26 0.00 -0.02 0.00 0.00 35.03 33.78 3hkb n LYS 280 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3hkb h ALA 281 N 3.58 1.14 0.00 7.82 0.00 -1.86 0.19 119.26 130.13 3hkb h ALA 281 Ca 0.00 0.24 0.00 0.00 0.00 0.00 0.00 54.91 55.15 3hkb h ALA 281 Cb 0.55 0.38 0.00 0.00 0.00 0.00 0.00 17.79 18.71 3hkb h ALA 281 CO 0.00 -0.47 0.00 0.66 0.00 0.00 0.00 179.25 179.44 3hkb n TYR 282 N -5.29 0.00 -1.48 0.00 4.02 -1.26 -4.83 117.16 108.32 3hkb n TYR 282 Ca 0.20 0.00 -0.30 0.00 -0.01 0.00 0.00 57.90 57.79 3hkb n TYR 282 Cb 0.64 -0.03 0.21 0.00 -0.02 0.00 0.00 39.34 40.15 3hkb n TYR 282 CO 0.00 0.00 0.00 -1.01 -1.01 0.00 0.00 176.86 174.84 3hkb s HIS 283 N -1.73 1.00 0.22 -0.72 3.76 0.67 -4.99 115.29 113.50 3hkb s HIS 283 Ca 0.00 0.41 -0.31 0.00 -0.15 0.00 0.00 55.06 55.02 3hkb s HIS 283 Cb 0.00 -3.76 -0.10 0.00 1.11 0.00 0.00 32.58 29.83 3hkb s HIS 283 CO 0.00 -3.31 1.49 -1.21 -0.85 0.00 0.00 174.74 170.86 3hkb s GLU 284 N -5.63 4.24 0.24 1.40 0.41 -1.26 -4.98 118.70 113.12 3hkb s GLU 284 Ca 0.72 2.33 -0.30 0.00 -0.41 0.00 0.00 54.97 57.32 3hkb s GLU 284 Cb -0.07 -3.12 -0.09 0.00 -1.78 0.00 0.00 34.13 29.07 3hkb s GLU 284 CO 0.55 -0.50 1.14 1.14 -0.49 0.00 0.00 175.26 177.10 3hkb s GLN 285 N 0.17 4.58 0.23 1.61 -2.07 -1.26 -5.00 119.66 117.92 3hkb s GLN 285 Ca 0.63 1.83 -0.30 0.00 -1.82 0.00 0.00 55.36 55.71 3hkb s GLN 285 Cb -0.43 -3.21 -0.09 0.00 -1.09 0.00 0.00 33.01 28.20 3hkb s GLN 285 CO 0.39 0.08 1.06 -0.51 -1.32 0.00 0.00 175.29 174.99 3hkb s LEU 286 N -0.95 4.55 0.66 2.60 1.02 -1.26 -5.03 118.68 120.27 3hkb s LEU 286 Ca 0.48 2.12 -0.16 0.00 0.02 0.00 0.00 54.13 56.59 3hkb s LEU 286 Cb -0.32 -3.61 0.00 0.00 0.02 0.00 0.00 46.19 42.28 3hkb s LEU 286 CO 0.39 -0.10 1.14 -0.94 0.02 0.00 0.00 176.35 176.86 3hkb s SER 287 N -0.64 4.98 0.59 2.29 1.04 -1.26 -4.83 113.70 115.87 3hkb s SER 287 Ca 0.46 2.11 0.29 0.00 0.48 0.00 0.00 55.95 59.29 3hkb s SER 287 Cb -0.29 -2.56 1.69 0.00 0.10 0.00 0.00 66.02 64.95 3hkb s SER 287 CO 0.37 -1.72 2.11 0.58 0.98 0.00 0.00 173.24 175.55 3hkb h VAL 288 N 0.12 0.45 0.09 5.02 2.07 -1.97 0.47 116.25 122.49 3hkb h VAL 288 Ca -0.47 0.00 -0.26 0.00 0.82 0.00 0.00 66.70 66.78 3hkb h VAL 288 Cb 1.26 0.85 0.03 0.00 -1.52 0.00 0.00 31.29 31.90 3hkb h VAL 288 CO 0.53 0.00 -1.09 0.00 0.02 0.00 0.00 177.57 177.03 3hkb h ALA 289 N 1.78 0.01 -0.29 1.67 0.00 -1.91 -3.02 119.26 117.50 3hkb h ALA 289 Ca 0.08 -0.73 -0.12 0.00 0.00 0.00 0.00 54.91 54.14 3hkb h ALA 289 Cb 0.45 0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.33 3hkb h ALA 289 CO -0.00 0.61 -0.31 1.49 0.00 0.00 0.00 179.25 181.04 3hkb h GLU 290 N 0.18 0.61 0.00 0.00 4.81 -1.28 -0.96 114.58 117.93 3hkb h GLU 290 Ca -0.16 -0.27 -0.19 0.00 -0.13 0.00 0.00 59.36 58.61 3hkb h GLU 290 Cb 1.78 -0.02 -0.03 0.00 0.63 0.00 0.00 28.75 31.11 3hkb h GLU 290 CO 0.21 0.85 -1.08 -0.84 -0.73 0.00 0.00 179.01 177.42 3hkb h ILE 291 N 0.52 1.10 -0.56 2.32 3.07 -1.50 -2.58 117.51 119.88 3hkb h ILE 291 Ca 0.06 -2.71 -0.08 0.00 1.55 0.00 0.00 64.86 63.68 3hkb h ILE 291 Cb 0.80 2.51 -0.02 0.00 -0.27 0.00 0.00 36.82 39.83 3hkb h ILE 291 CO 0.07 0.63 0.04 0.74 -1.05 0.00 0.00 178.15 178.58 3hkb h THR 292 N 0.00 1.26 -0.04 0.16 2.02 -1.41 -2.90 112.91 112.00 3hkb h THR 292 Ca -0.09 -1.06 -0.05 0.00 0.77 0.00 0.00 66.41 65.99 3hkb h THR 292 Cb 1.68 0.84 -0.01 0.00 -1.74 0.00 0.00 68.15 68.92 3hkb h THR 292 CO 0.09 0.38 -0.20 0.78 0.37 0.00 0.00 175.52 176.94 3hkb h ASN 293 N 0.85 0.06 -0.41 4.18 2.35 -1.13 -2.41 115.58 119.07 3hkb h ASN 293 Ca 0.16 -0.01 0.08 0.00 -0.55 0.00 0.00 56.30 55.98 3hkb h ASN 293 Cb 0.49 -0.02 -0.02 0.00 0.05 0.00 0.00 38.32 38.82 3hkb h ASN 293 CO 0.02 0.27 0.28 0.00 -1.65 0.00 0.00 177.43 176.35 3hkb h ALA 294 N 1.74 2.12 0.00 -0.83 0.00 -1.24 -2.59 119.26 118.46 3hkb h ALA 294 Ca 0.01 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.87 3hkb h ALA 294 Cb 0.39 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 3hkb h ALA 294 CO 0.03 -0.22 -0.17 0.00 0.00 0.00 0.00 179.25 178.89 3hkb n PHE 296 N -3.60 2.99 -3.82 0.00 3.01 -0.97 -4.86 117.46 110.20 3hkb n PHE 296 Ca -0.01 -2.62 -0.28 0.00 1.01 0.00 0.00 57.45 55.54 3hkb n PHE 296 Cb 0.31 -1.15 -0.16 0.00 -0.01 0.00 0.00 39.48 38.47 3hkb n PHE 296 CO 0.00 0.00 0.00 -2.00 1.01 0.00 0.00 176.76 175.77 3hkb s GLU 297 N -3.67 1.06 0.42 -1.08 2.56 -0.98 -5.02 118.70 111.99 3hkb s GLU 297 Ca 0.60 -0.61 0.21 0.00 0.00 0.00 0.00 54.97 55.17 3hkb s GLU 297 Cb 0.48 -2.24 1.16 0.00 2.00 0.00 0.00 34.13 35.54 3hkb s GLU 297 CO 0.02 -0.60 1.80 -1.00 -0.56 0.00 0.00 175.26 174.92 3hkb h PRO 298 N 8.13 0.33 0.00 4.30 0.13 -1.89 0.46 132.00 143.46 3hkb h PRO 298 Ca -0.18 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 64.93 3hkb h PRO 298 Cb 1.10 -0.07 0.00 0.00 0.13 0.00 0.00 31.00 32.16 3hkb h PRO 298 CO 0.37 0.22 0.00 0.00 -0.23 0.00 0.00 178.00 178.36 3hkb n ALA 299 N -2.52 1.25 0.01 -0.56 0.00 -1.26 -0.31 120.51 117.11 3hkb n ALA 299 Ca 0.24 -0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.68 3hkb n ALA 299 Cb 0.88 -1.01 0.00 0.00 0.00 0.00 0.00 19.45 19.32 3hkb n ALA 299 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 3hkb n ASN 300 N -1.27 1.55 -3.18 0.00 3.02 0.15 -4.82 115.26 110.71 3hkb n ASN 300 Ca 0.00 -1.52 0.00 0.00 -0.03 0.00 0.00 54.58 53.04 3hkb n ASN 300 Cb 0.00 -0.01 0.00 0.00 -0.61 0.00 0.00 39.78 39.17 3hkb n ASN 300 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3hkb n GLN 301 N -0.22 0.95 0.00 3.52 6.02 0.58 -3.47 117.38 124.76 3hkb n GLN 301 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.99 3hkb n GLN 301 Cb 0.14 0.00 0.00 0.00 1.02 0.00 0.00 30.24 31.40 3hkb n GLN 301 CO 0.00 0.00 0.00 -1.33 -1.01 0.00 0.00 177.06 174.72 3hkb n MET 302 N -0.04 0.00 -3.91 -1.09 2.81 -1.18 -4.80 117.12 108.91 3hkb n MET 302 Ca 0.00 0.00 -0.25 0.00 -1.81 0.00 0.00 57.70 55.64 3hkb n MET 302 Cb 0.00 -0.01 -0.17 0.00 -0.71 0.00 0.00 33.22 32.32 3hkb n MET 302 CO 0.00 0.00 0.00 0.08 1.51 0.00 0.00 175.97 177.56 3hkb s VAL 303 N 0.00 0.77 -0.34 2.03 1.01 -1.26 -0.27 120.40 122.33 3hkb s VAL 303 Ca 0.00 -0.14 -0.28 0.00 0.00 0.00 0.00 61.98 61.55 3hkb s VAL 303 Cb 0.00 -0.83 -0.01 0.00 0.00 0.00 0.00 36.38 35.54 3hkb s VAL 303 CO 0.00 0.32 1.70 -0.54 0.00 0.00 0.00 175.10 176.58 3hkb s LYS 304 N 1.69 3.41 0.00 2.72 1.02 -1.26 -4.83 119.74 122.50 3hkb s LYS 304 Ca 0.03 1.32 0.00 0.00 0.02 0.00 0.00 55.97 57.34 3hkb s LYS 304 Cb -0.13 -4.15 0.00 0.00 -0.52 0.00 0.00 37.83 33.03 3hkb s LYS 304 CO -0.06 -1.76 0.00 0.00 -0.92 0.00 0.00 175.35 172.61 3hkb s ASP 306 N 1.86 -1.06 0.00 0.00 2.15 -1.26 -5.00 116.67 113.37 3hkb s ASP 306 Ca 0.00 0.37 0.20 0.00 0.43 0.00 0.00 52.55 53.55 3hkb s ASP 306 Cb 0.00 1.85 0.54 0.00 -0.30 0.00 0.00 42.92 45.02 3hkb s ASP 306 CO 0.00 -0.29 1.45 -0.81 -0.17 0.00 0.00 175.17 175.34 3hkb n PRO 307 N 5.41 2.17 -1.87 4.34 -0.05 -1.26 -3.65 135.00 140.09 3hkb n PRO 307 Ca 0.01 -1.78 -0.35 0.00 -0.05 0.00 0.00 63.50 61.33 3hkb n PRO 307 Cb 0.52 -1.44 -0.01 0.00 -0.05 0.00 0.00 33.50 32.52 3hkb n PRO 307 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 175.50 175.99 3hkb n ARG 308 N 0.98 3.35 0.19 0.54 3.00 -1.26 -4.19 116.66 119.27 3hkb n ARG 308 Ca 0.18 -3.23 0.00 0.00 -0.01 0.00 0.00 57.85 54.79 3hkb n ARG 308 Cb 0.47 -2.32 0.00 0.00 0.00 0.00 0.00 32.46 30.61 3hkb n ARG 308 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 177.63 179.21 3hkb n HIS 309 N 0.48 -4.29 -1.22 -1.55 -0.00 -1.24 -5.12 115.22 102.28 3hkb n HIS 309 Ca 0.53 1.32 0.00 0.00 -0.00 0.00 0.00 57.72 59.56 3hkb n HIS 309 Cb 0.36 3.37 0.00 0.00 -0.00 0.00 0.00 29.99 33.72 3hkb n HIS 309 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 3hkb n GLY 310 N -1.43 0.10 3.38 1.57 0.00 -1.25 -5.03 105.19 102.53 3hkb n GLY 310 Ca 0.00 -1.81 -0.24 0.00 0.00 0.00 0.00 46.02 43.97 3hkb n GLY 310 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3hkb s LYS 311 N -0.73 1.40 -0.08 1.61 1.02 -1.26 -4.89 119.74 116.81 3hkb s LYS 311 Ca 0.00 -1.48 -0.18 0.00 0.02 0.00 0.00 55.97 54.33 3hkb s LYS 311 Cb 0.00 -1.56 -0.05 0.00 -0.52 0.00 0.00 37.83 35.70 3hkb s LYS 311 CO 0.00 0.32 0.50 0.71 -0.92 0.00 0.00 175.35 175.96 3hkb s TYR 312 N -1.94 3.57 -0.37 3.18 1.51 0.44 -1.19 117.35 122.55 3hkb s TYR 312 Ca 0.19 0.97 0.03 0.00 -1.01 0.00 0.00 57.07 57.25 3hkb s TYR 312 Cb -0.06 -2.54 0.06 0.00 -0.11 0.00 0.00 41.96 39.31 3hkb s TYR 312 CO 0.08 0.26 0.85 0.00 -1.11 0.00 0.00 175.55 175.63 3hkb n MET 313 N 3.26 1.22 -3.63 -0.62 0.00 -0.74 -0.87 117.12 115.75 3hkb n MET 313 Ca -0.08 -1.19 -0.08 0.00 0.00 0.00 0.00 57.70 56.35 3hkb n MET 313 Cb 0.52 -1.08 -0.07 0.00 0.00 0.00 0.00 33.22 32.59 3hkb n MET 313 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 3hkb s ALA 314 N -0.65 -2.00 0.10 3.17 0.00 -1.24 -4.93 121.76 116.21 3hkb s ALA 314 Ca 0.06 1.79 0.01 0.00 0.00 0.00 0.00 51.96 53.82 3hkb s ALA 314 Cb 0.03 -1.34 -0.04 0.00 0.00 0.00 0.00 23.12 21.77 3hkb s ALA 314 CO 0.05 -0.23 -0.04 0.00 0.00 0.00 0.00 175.76 175.53 3hkb s LEU 317 N 1.37 4.14 -0.54 0.00 1.43 -0.38 -2.01 118.68 122.68 3hkb s LEU 317 Ca 0.21 1.52 -0.06 0.00 -1.03 0.00 0.00 54.13 54.77 3hkb s LEU 317 Cb 0.05 -3.54 0.14 0.00 0.03 0.00 0.00 46.19 42.87 3hkb s LEU 317 CO -0.10 -0.71 0.38 -0.76 0.23 0.00 0.00 176.35 175.39 3hkb s LEU 318 N 3.34 5.54 0.29 1.79 1.02 -1.26 -0.91 118.68 128.48 3hkb s LEU 318 Ca 0.49 -2.34 -0.18 0.00 0.02 0.00 0.00 54.13 52.12 3hkb s LEU 318 Cb -0.18 -1.93 -0.09 0.00 0.02 0.00 0.00 46.19 44.01 3hkb s LEU 318 CO 0.10 -0.53 0.76 -0.31 0.02 0.00 0.00 176.35 176.38 3hkb s TYR 319 N 0.70 3.49 0.01 0.29 1.51 0.13 -1.71 117.35 121.77 3hkb s TYR 319 Ca 0.11 1.34 0.03 0.00 -1.01 0.00 0.00 57.07 57.55 3hkb s TYR 319 Cb -0.22 -2.61 -0.01 0.00 -0.11 0.00 0.00 41.96 39.01 3hkb s TYR 319 CO -0.03 0.18 -0.10 1.03 -1.11 0.00 0.00 175.55 175.52 3hkb s ARG 320 N -2.55 0.75 0.13 -0.62 0.52 -0.03 -1.47 118.95 115.68 3hkb s ARG 320 Ca 0.50 -0.48 0.00 0.00 -0.52 0.00 0.00 55.73 55.23 3hkb s ARG 320 Cb -0.13 -0.71 0.00 0.00 0.52 0.00 0.00 34.95 34.63 3hkb s ARG 320 CO 0.19 0.18 0.00 0.41 0.02 0.00 0.00 175.30 176.10 3hkb n GLY 321 N 2.45 -2.15 3.66 -3.53 0.00 0.28 -1.46 105.19 104.45 3hkb n GLY 321 Ca -0.16 -1.97 -0.43 0.00 0.00 0.00 0.00 46.02 43.47 3hkb n GLY 321 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3hkb s ASP 322 N -3.36 6.79 -0.23 1.61 2.15 -1.23 -3.91 116.67 118.49 3hkb s ASP 322 Ca 0.00 1.95 -0.26 0.00 0.43 0.00 0.00 52.55 54.66 3hkb s ASP 322 Cb 0.00 -2.54 0.07 0.00 -0.30 0.00 0.00 42.92 40.16 3hkb s ASP 322 CO 0.00 -0.86 0.72 -0.69 -0.17 0.00 0.00 175.17 174.17 3hkb s VAL 323 N 3.82 0.00 -0.05 1.11 1.01 -1.26 -4.84 120.40 120.20 3hkb s VAL 323 Ca 0.64 0.00 0.04 0.00 0.00 0.00 0.00 61.98 62.66 3hkb s VAL 323 Cb -0.27 -1.00 -0.02 0.00 0.00 0.00 0.00 36.38 35.08 3hkb s VAL 323 CO 0.22 0.00 -0.16 -0.69 0.00 0.00 0.00 175.10 174.47 3hkb s VAL 324 N 0.06 2.88 0.31 2.92 1.01 -1.26 -5.01 120.40 121.31 3hkb s VAL 324 Ca -0.02 -0.79 0.06 0.00 0.00 0.00 0.00 61.98 61.23 3hkb s VAL 324 Cb -0.04 -2.11 0.30 0.00 0.00 0.00 0.00 36.38 34.53 3hkb s VAL 324 CO 0.03 0.59 1.80 -0.65 0.00 0.00 0.00 175.10 176.87 3hkb h PRO 325 N 5.45 0.78 -1.17 2.72 0.11 -2.02 -1.48 132.00 136.38 3hkb h PRO 325 Ca -0.45 -0.05 0.34 0.00 0.11 0.00 0.00 66.00 65.95 3hkb h PRO 325 Cb 1.15 -0.18 -0.09 0.00 0.11 0.00 0.00 31.00 31.99 3hkb h PRO 325 CO 0.50 0.52 0.78 -0.22 -0.21 0.00 0.00 178.00 179.37 3hkb h LYS 326 N 0.80 0.21 0.00 1.05 3.64 -1.99 0.34 116.57 120.63 3hkb h LYS 326 Ca 0.54 -0.01 -0.00 0.00 -1.27 0.00 0.00 60.65 59.91 3hkb h LYS 326 Cb 0.79 -0.05 -0.00 0.00 -0.41 0.00 0.00 32.23 32.57 3hkb h LYS 326 CO -0.32 0.14 -0.00 -0.44 -2.27 0.00 0.00 179.45 176.55 3hkb h ASP 327 N 0.21 0.00 -0.85 4.20 3.32 -1.69 -2.63 116.42 118.98 3hkb h ASP 327 Ca 0.65 -0.68 0.10 0.00 0.02 0.00 0.00 57.03 57.13 3hkb h ASP 327 Cb 2.02 0.00 -0.08 0.00 0.22 0.00 0.00 39.33 41.50 3hkb h ASP 327 CO -0.24 0.84 0.49 0.58 -1.72 0.00 0.00 179.24 179.18 3hkb h VAL 328 N -1.00 0.89 0.83 -1.35 2.07 -1.21 0.83 116.25 117.32 3hkb h VAL 328 Ca -0.00 -0.28 -0.04 0.00 0.82 0.00 0.00 66.70 67.21 3hkb h VAL 328 Cb 0.68 0.02 -0.00 0.00 -1.52 0.00 0.00 31.29 30.47 3hkb h VAL 328 CO -0.00 0.15 -0.49 0.78 0.02 0.00 0.00 177.57 178.03 3hkb h ASN 329 N 0.80 -1.22 0.06 0.57 -0.26 -0.49 -0.44 115.58 114.61 3hkb h ASN 329 Ca 0.42 0.06 -0.01 0.00 -0.56 0.00 0.00 56.30 56.21 3hkb h ASN 329 Cb 0.41 0.35 -0.00 0.00 -1.06 0.00 0.00 38.32 38.01 3hkb h ASN 329 CO -0.26 -0.76 -0.03 0.00 -1.06 0.00 0.00 177.43 175.31 3hkb h ALA 330 N -1.17 1.61 0.02 -0.83 0.00 -0.89 -1.70 119.26 116.31 3hkb h ALA 330 Ca -0.11 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.77 3hkb h ALA 330 Cb 0.98 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.76 3hkb h ALA 330 CO 0.13 0.04 -0.01 0.00 0.00 0.00 0.00 179.25 179.41 3hkb h ALA 331 N 1.97 -0.03 -0.87 0.00 0.00 0.74 -3.27 119.26 117.80 3hkb h ALA 331 Ca -0.00 -0.32 0.22 0.00 0.00 0.00 0.00 54.91 54.81 3hkb h ALA 331 Cb 0.07 0.01 -0.05 0.00 0.00 0.00 0.00 17.79 17.82 3hkb h ALA 331 CO 0.00 -0.18 0.60 0.82 0.00 0.00 0.00 179.25 180.49 3hkb h ILE 332 N -0.70 0.64 -0.24 0.00 2.04 -0.17 -1.69 117.51 117.39 3hkb h ILE 332 Ca -0.00 -0.08 0.06 0.00 1.00 0.00 0.00 64.86 65.84 3hkb h ILE 332 Cb 0.65 0.38 -0.07 0.00 -0.74 0.00 0.00 36.82 37.04 3hkb h ILE 332 CO 0.00 0.04 -0.27 0.00 0.00 0.00 0.00 178.15 177.92 3hkb h ALA 333 N 1.60 -0.20 0.00 1.87 0.00 -1.47 -2.68 119.26 118.38 3hkb h ALA 333 Ca 0.44 0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.42 3hkb h ALA 333 Cb 1.35 0.56 0.00 0.00 0.00 0.00 0.00 17.79 19.70 3hkb h ALA 333 CO -0.11 -0.71 0.00 1.79 0.00 0.00 0.00 179.25 180.22 3hkb h THR 334 N -0.29 0.00 -0.35 0.00 1.35 -1.44 -2.67 112.91 109.51 3hkb h THR 334 Ca 0.13 -0.68 -0.04 0.00 -0.55 0.00 0.00 66.41 65.27 3hkb h THR 334 Cb 0.49 1.68 -0.01 0.00 -1.73 0.00 0.00 68.15 68.58 3hkb h THR 334 CO -0.40 0.00 0.06 0.40 -0.25 0.00 0.00 175.52 175.33 3hkb h ILE 335 N 0.00 1.24 0.25 6.82 2.04 -1.32 -2.81 117.51 123.73 3hkb h ILE 335 Ca 0.00 -0.84 -0.01 0.00 1.00 0.00 0.00 64.86 65.01 3hkb h ILE 335 Cb 0.83 1.11 0.00 0.00 -0.74 0.00 0.00 36.82 38.03 3hkb h ILE 335 CO 0.00 0.28 -0.12 0.07 0.00 0.00 0.00 178.15 178.38 3hkb h LYS 336 N 0.41 -0.32 0.39 2.37 -0.00 -1.23 -3.00 116.57 115.19 3hkb h LYS 336 Ca 0.11 0.02 -0.01 0.00 -0.00 0.00 0.00 60.65 60.77 3hkb h LYS 336 Cb 0.36 0.07 -0.03 0.00 -0.00 0.00 0.00 32.23 32.63 3hkb h LYS 336 CO 0.01 -0.18 -0.48 1.15 -0.00 0.00 0.00 179.45 179.95 3hkb h THR 337 N -0.38 0.07 -2.14 0.07 2.02 -1.54 -3.12 112.91 107.89 3hkb h THR 337 Ca -0.03 0.00 -0.76 0.00 0.77 0.00 0.00 66.41 66.38 3hkb h THR 337 Cb 0.29 0.07 -0.29 0.00 -1.74 0.00 0.00 68.15 66.47 3hkb h THR 337 CO 0.06 0.00 0.80 0.29 0.37 0.00 0.00 175.52 177.03 3hkb n LYS 338 N -5.53 4.30 -0.64 6.66 4.01 -1.06 -4.95 118.16 120.94 3hkb n LYS 338 Ca -0.11 -4.32 0.00 0.00 -0.51 0.00 0.00 58.31 53.37 3hkb n LYS 338 Cb 0.44 -2.37 0.00 0.00 -0.51 0.00 0.00 35.03 32.58 3hkb n LYS 338 CO 0.00 0.00 0.00 -2.13 -1.11 0.00 0.00 177.40 174.16 3hkb n ARG 339 N -0.25 0.00 -3.67 1.97 3.00 -1.13 -4.91 116.66 111.66 3hkb n ARG 339 Ca 0.47 0.00 -0.39 0.00 -0.00 0.00 0.00 57.85 57.94 3hkb n ARG 339 Cb 0.28 0.00 -0.10 0.00 0.00 0.00 0.00 32.46 32.64 3hkb n ARG 339 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.63 178.62 3hkb s THR 340 N -2.56 3.82 0.00 5.15 2.01 -1.26 -4.94 115.64 117.86 3hkb s THR 340 Ca 0.00 -1.71 0.00 0.00 0.31 0.00 0.00 61.69 60.29 3hkb s THR 340 Cb 0.00 -3.46 0.00 0.00 0.01 0.00 0.00 72.50 69.05 3hkb s THR 340 CO 0.00 -0.60 0.68 2.30 -0.69 0.00 0.00 174.62 176.31 3hkb n ILE 341 N 4.79 0.00 -2.91 1.82 -0.00 -1.26 -4.96 119.36 116.83 3hkb n ILE 341 Ca -0.07 1.18 -0.12 0.00 -0.00 0.00 0.00 62.75 63.74 3hkb n ILE 341 Cb 0.42 -2.18 0.06 0.00 -0.00 0.00 0.00 39.64 37.94 3hkb n ILE 341 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.55 176.55 3hkb n GLN 342 N -1.03 -2.79 -4.11 6.28 6.02 -1.26 -4.80 117.38 115.69 3hkb n GLN 342 Ca 0.00 0.66 -0.32 0.00 -0.01 0.00 0.00 57.00 57.33 3hkb n GLN 342 Cb 0.00 -4.89 -0.07 0.00 1.02 0.00 0.00 30.24 26.30 3hkb n GLN 342 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 177.06 175.99 3hkb s PHE 343 N -3.29 3.21 -0.02 1.08 0.40 -1.26 -0.42 117.98 117.68 3hkb s PHE 343 Ca 0.24 0.13 -0.30 0.00 -0.60 0.00 0.00 56.93 56.40 3hkb s PHE 343 Cb -0.03 -1.68 -0.04 0.00 0.51 0.00 0.00 43.02 41.78 3hkb s PHE 343 CO 0.56 0.53 1.24 0.54 0.70 0.00 0.00 175.22 178.78 3hkb s VAL 344 N -1.26 4.10 0.00 -0.44 0.11 -0.05 -4.83 120.40 118.04 3hkb s VAL 344 Ca 0.25 1.46 0.00 0.00 -2.93 0.00 0.00 61.98 60.76 3hkb s VAL 344 Cb -0.12 -3.94 0.00 0.00 -1.53 0.00 0.00 36.38 30.79 3hkb s VAL 344 CO 0.17 0.02 0.00 -0.67 -3.33 0.00 0.00 175.10 171.29 3hkb n ASP 345 N 4.96 0.00 -2.17 3.54 -0.08 -1.26 -2.25 116.55 119.29 3hkb n ASP 345 Ca 0.11 0.00 -0.27 0.00 -1.51 0.00 0.00 54.79 53.12 3hkb n ASP 345 Cb 0.46 0.00 0.03 0.00 2.34 0.00 0.00 41.12 43.95 3hkb n ASP 345 CO 0.00 0.00 0.00 -2.67 0.12 0.00 0.00 177.20 174.65 3hkb n TRP 346 N 0.00 2.94 -4.47 -0.67 4.27 -1.26 -5.01 117.44 113.24 3hkb n TRP 346 Ca 0.00 -2.49 -0.23 0.00 -3.89 0.00 0.00 57.50 50.89 3hkb n TRP 346 Cb 0.00 -0.55 -0.09 0.00 -1.36 0.00 0.00 31.31 29.31 3hkb n TRP 346 CO 0.00 0.00 0.00 0.00 -2.29 0.00 0.00 177.69 175.40 3hkb n PRO 348 N -0.79 0.35 -3.66 0.00 -0.04 -1.26 -4.98 135.00 124.63 3hkb n PRO 348 Ca -0.04 0.00 -0.32 0.00 -0.04 0.00 0.00 63.50 63.10 3hkb n PRO 348 Cb 0.66 0.00 -0.08 0.00 -0.04 0.00 0.00 33.50 34.03 3hkb n PRO 348 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 3hkb n THR 349 N -1.21 2.50 0.00 0.52 -2.24 -1.26 -4.90 114.28 107.69 3hkb n THR 349 Ca 0.00 -5.09 0.00 0.00 -2.27 0.00 0.00 64.05 56.69 3hkb n THR 349 Cb 0.00 -2.23 0.00 0.00 -2.10 0.00 0.00 70.33 66.00 3hkb n THR 349 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3hkb n GLY 350 N 1.82 -0.22 2.53 3.38 0.00 -1.26 -5.02 105.19 106.41 3hkb n GLY 350 Ca 0.23 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.20 3hkb n GLY 350 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3hkb n PHE 351 N 0.00 -2.81 -2.91 1.61 3.01 -1.24 -4.98 117.46 110.14 3hkb n PHE 351 Ca 0.00 1.16 -0.41 0.00 1.01 0.00 0.00 57.45 59.21 3hkb n PHE 351 Cb 0.00 -3.51 -0.04 0.00 -0.01 0.00 0.00 39.48 35.92 3hkb n PHE 351 CO 0.00 0.00 0.00 0.15 1.01 0.00 0.00 176.76 177.92 3hkb s LYS 352 N -2.04 4.35 -0.13 -1.08 -0.14 -1.18 -4.88 119.74 114.65 3hkb s LYS 352 Ca 0.15 1.02 -0.04 0.00 -1.36 0.00 0.00 55.97 55.74 3hkb s LYS 352 Cb -0.04 -3.54 -0.03 0.00 -1.68 0.00 0.00 37.83 32.54 3hkb s LYS 352 CO 0.60 -0.22 0.02 0.08 -0.76 0.00 0.00 175.35 175.07 3hkb s VAL 353 N 1.77 4.47 -0.05 3.17 1.01 -1.26 -1.25 120.40 128.26 3hkb s VAL 353 Ca 0.39 -0.17 0.05 0.00 0.00 0.00 0.00 61.98 62.26 3hkb s VAL 353 Cb -0.17 -2.94 -0.01 0.00 0.00 0.00 0.00 36.38 33.26 3hkb s VAL 353 CO 0.15 0.55 -0.21 -0.83 0.00 0.00 0.00 175.10 174.76 3hkb s GLY 354 N -0.32 1.10 -0.09 4.51 0.00 -0.09 -4.91 107.32 107.51 3hkb s GLY 354 Ca 0.07 -0.87 0.03 0.00 0.00 0.00 0.00 44.72 43.96 3hkb s GLY 354 CO 0.02 -0.53 -0.20 -0.42 0.00 0.00 0.00 173.10 171.97 3hkb s ILE 355 N -0.11 1.77 -0.26 0.90 1.01 -1.26 0.19 121.20 123.44 3hkb s ILE 355 Ca -0.02 -0.84 0.03 0.00 0.00 0.00 0.00 60.65 59.81 3hkb s ILE 355 Cb -0.12 -1.55 0.06 0.00 0.01 0.00 0.00 42.46 40.86 3hkb s ILE 355 CO 0.02 0.50 -0.08 0.21 0.00 0.00 0.00 174.94 175.59 3hkb s ASN 356 N 0.51 4.35 0.57 3.58 2.47 -0.54 -5.00 114.94 120.88 3hkb s ASN 356 Ca -0.16 -1.43 0.29 0.00 0.42 0.00 0.00 52.86 51.98 3hkb s ASN 356 Cb -0.17 -1.47 1.71 0.00 -1.45 0.00 0.00 41.25 39.88 3hkb s ASN 356 CO 0.06 -0.22 2.20 1.88 -3.72 0.00 0.00 177.10 177.30 3hkb h TYR 357 N 7.80 0.00 -2.78 0.43 0.99 -1.88 0.81 116.97 122.33 3hkb h TYR 357 Ca -0.17 0.00 -0.57 0.00 2.00 0.00 0.00 58.73 59.99 3hkb h TYR 357 Cb 1.04 0.00 -0.03 0.00 1.00 0.00 0.00 36.73 38.75 3hkb h TYR 357 CO 0.59 0.04 1.13 -1.14 -0.00 0.00 0.00 178.16 178.77 3hkb s GLN 358 N -4.49 3.78 0.77 4.88 2.00 -1.26 -3.48 119.66 121.87 3hkb s GLN 358 Ca -0.04 1.63 -0.12 0.00 -2.00 0.00 0.00 55.36 54.83 3hkb s GLN 358 Cb 0.14 -4.03 0.06 0.00 0.80 0.00 0.00 33.01 29.98 3hkb s GLN 358 CO 0.56 -1.31 1.11 -2.14 -0.50 0.00 0.00 175.29 173.01 3hkb s PRO 359 N 4.69 2.12 0.27 1.67 0.02 -1.26 -3.33 135.00 139.17 3hkb s PRO 359 Ca 0.71 1.32 -0.30 0.00 0.02 0.00 0.00 61.00 62.75 3hkb s PRO 359 Cb -0.24 -1.87 -0.10 0.00 0.02 0.00 0.00 34.50 32.31 3hkb s PRO 359 CO 0.29 -1.76 1.33 -1.25 -0.33 0.00 0.00 177.00 175.28 3hkb s PRO 360 N -4.65 4.36 0.31 5.54 0.04 -1.26 -4.83 135.00 134.50 3hkb s PRO 360 Ca 0.64 2.16 0.07 0.00 0.04 0.00 0.00 61.00 63.91 3hkb s PRO 360 Cb -0.20 -3.13 -0.02 0.00 0.04 0.00 0.00 34.50 31.20 3hkb s PRO 360 CO 0.53 -0.24 0.34 0.95 0.04 0.00 0.00 177.00 178.62 3hkb s THR 361 N -0.45 4.11 0.00 1.26 -4.23 -1.26 -4.60 115.64 110.46 3hkb s THR 361 Ca 0.54 -1.20 0.00 0.00 -1.18 0.00 0.00 61.69 59.85 3hkb s THR 361 Cb -0.39 -3.39 -0.00 0.00 1.34 0.00 0.00 72.50 70.06 3hkb s THR 361 CO 0.45 -0.22 -0.02 0.68 -0.54 0.00 0.00 174.62 174.97 3hkb s VAL 362 N -2.19 0.12 0.04 2.29 -7.23 -1.26 -5.03 120.40 107.15 3hkb s VAL 362 Ca 0.40 -0.13 -0.31 0.00 -1.81 0.00 0.00 61.98 60.13 3hkb s VAL 362 Cb -0.08 -0.12 -0.10 0.00 0.56 0.00 0.00 36.38 36.64 3hkb s VAL 362 CO 0.28 -0.01 1.93 0.52 -0.31 0.00 0.00 175.10 177.52 3hkb n VAL 363 N 2.93 0.66 0.25 1.32 0.31 -1.26 -4.86 118.33 117.68 3hkb n VAL 363 Ca -0.13 -0.12 0.12 0.00 -0.01 0.00 0.00 64.34 64.20 3hkb n VAL 363 Cb 0.59 -2.22 0.68 0.00 -0.91 0.00 0.00 33.84 31.98 3hkb n VAL 363 CO 0.00 0.00 0.00 1.55 -1.32 0.00 0.00 176.83 177.06 3hkb h PRO 364 N 9.96 0.00 -0.10 5.55 0.13 -2.00 0.36 132.00 145.90 3hkb h PRO 364 Ca -0.49 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.64 3hkb h PRO 364 Cb 1.24 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.37 3hkb h PRO 364 CO 0.94 0.14 0.00 0.41 -0.23 0.00 0.00 178.00 179.26 3hkb n GLY 365 N -0.54 0.29 0.00 1.56 0.00 -1.26 -4.98 105.19 100.26 3hkb n GLY 365 Ca -0.01 -0.47 0.00 0.00 0.00 0.00 0.00 46.02 45.54 3hkb n GLY 365 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hkb n GLY 366 N 1.19 -1.68 0.08 -0.02 0.00 0.11 -5.03 105.19 99.84 3hkb n GLY 366 Ca 0.17 -1.51 -0.05 0.00 0.00 0.00 0.00 46.02 44.63 3hkb n GLY 366 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3hkb n ASP 367 N -1.09 0.10 -4.85 1.61 8.00 -1.26 -4.90 116.55 114.17 3hkb n ASP 367 Ca 0.00 0.00 -0.27 0.00 0.71 0.00 0.00 54.79 55.23 3hkb n ASP 367 Cb 0.00 1.23 -0.05 0.00 -0.02 0.00 0.00 41.12 42.28 3hkb n ASP 367 CO 0.00 0.00 0.00 -1.48 -0.39 0.00 0.00 177.20 175.33 3hkb s LEU 368 N -5.23 3.99 0.54 0.64 0.05 -1.26 -0.74 118.68 116.67 3hkb s LEU 368 Ca -0.09 -0.01 -0.02 0.00 0.05 0.00 0.00 54.13 54.06 3hkb s LEU 368 Cb 0.08 -2.59 0.02 0.00 -2.05 0.00 0.00 46.19 41.64 3hkb s LEU 368 CO 0.83 0.07 0.79 0.00 -0.55 0.00 0.00 176.35 177.50 3hkb s ALA 369 N -1.71 3.63 0.02 1.48 0.00 -0.81 -4.38 121.76 119.98 3hkb s ALA 369 Ca 0.32 -1.03 -0.30 0.00 0.00 0.00 0.00 51.96 50.94 3hkb s ALA 369 Cb -0.11 -2.28 -0.06 0.00 0.00 0.00 0.00 23.12 20.68 3hkb s ALA 369 CO 0.25 -0.68 1.38 -1.59 0.00 0.00 0.00 175.76 175.12 3hkb s LYS 370 N -4.79 4.30 0.17 0.00 0.00 -1.26 -4.89 119.74 113.28 3hkb s LYS 370 Ca 0.53 1.95 0.08 0.00 0.00 0.00 0.00 55.97 58.53 3hkb s LYS 370 Cb -0.10 -3.52 -0.04 0.00 0.00 0.00 0.00 37.83 34.17 3hkb s LYS 370 CO 0.40 -0.53 -0.02 0.08 0.00 0.00 0.00 175.35 175.28 3hkb s VAL 371 N 2.14 3.61 0.16 1.79 1.01 -1.26 -4.97 120.40 122.89 3hkb s VAL 371 Ca 0.63 -1.45 0.06 0.00 0.00 0.00 0.00 61.98 61.22 3hkb s VAL 371 Cb -0.32 -2.80 -0.16 0.00 0.00 0.00 0.00 36.38 33.11 3hkb s VAL 371 CO 0.27 -0.09 1.37 1.56 0.00 0.00 0.00 175.10 178.21 3hkb h GLN 372 N 2.80 0.08 -1.70 2.72 1.08 -1.95 -3.40 115.11 114.74 3hkb h GLN 372 Ca -0.47 -0.10 0.06 0.00 -1.45 0.00 0.00 58.65 56.69 3hkb h GLN 372 Cb 1.20 0.03 -0.25 0.00 -0.05 0.00 0.00 27.48 28.41 3hkb h GLN 372 CO 0.57 0.92 0.29 -0.98 -0.95 0.00 0.00 178.83 178.68 3hkb s ARG 373 N -3.06 0.53 0.24 1.46 1.70 -1.26 -3.77 118.95 114.79 3hkb s ARG 373 Ca -0.01 0.81 0.03 0.00 -0.47 0.00 0.00 55.73 56.09 3hkb s ARG 373 Cb 0.10 0.17 -0.05 0.00 -0.57 0.00 0.00 34.95 34.60 3hkb s ARG 373 CO 0.81 -0.09 0.02 0.00 -1.08 0.00 0.00 175.30 174.96 3hkb s ALA 374 N 1.01 1.85 0.28 7.88 0.00 -0.53 -4.76 121.76 127.49 3hkb s ALA 374 Ca -0.05 -1.81 0.02 0.00 0.00 0.00 0.00 51.96 50.12 3hkb s ALA 374 Cb -0.04 0.59 -0.06 0.00 0.00 0.00 0.00 23.12 23.61 3hkb s ALA 374 CO -0.12 -0.29 0.08 0.08 0.00 0.00 0.00 175.76 175.51 3hkb s VAL 375 N -3.46 0.81 0.00 0.00 1.01 -1.26 -0.85 120.40 116.65 3hkb s VAL 375 Ca 0.31 -2.00 0.00 0.00 0.00 0.00 0.00 61.98 60.28 3hkb s VAL 375 Cb 0.06 -2.69 0.00 0.00 0.00 0.00 0.00 36.38 33.76 3hkb s VAL 375 CO 0.10 -0.01 0.00 0.00 0.00 0.00 0.00 175.10 175.19 3hkb n MET 377 N -0.25 -0.12 -3.65 0.00 0.00 -1.25 -3.28 117.12 108.57 3hkb n MET 377 Ca 0.00 0.30 -0.37 0.00 0.00 0.00 0.00 57.70 57.63 3hkb n MET 377 Cb 0.00 -0.39 -0.11 0.00 0.00 0.00 0.00 33.22 32.73 3hkb n MET 377 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 175.97 175.46 3hkb s LEU 378 N -0.41 3.99 -0.03 -0.89 1.43 -0.85 -2.71 118.68 119.20 3hkb s LEU 378 Ca 0.01 0.02 0.02 0.00 -1.03 0.00 0.00 54.13 53.14 3hkb s LEU 378 Cb -0.00 -2.09 0.01 0.00 0.03 0.00 0.00 46.19 44.14 3hkb s LEU 378 CO 0.01 0.00 -0.08 -0.94 0.23 0.00 0.00 176.35 175.58 3hkb s SER 379 N 1.44 1.13 -1.12 2.29 1.04 -0.79 -2.08 113.70 115.62 3hkb s SER 379 Ca 0.07 -0.17 -0.16 0.00 0.48 0.00 0.00 55.95 56.17 3hkb s SER 379 Cb -0.15 -0.40 0.14 0.00 0.10 0.00 0.00 66.02 65.71 3hkb s SER 379 CO 0.08 0.02 1.36 0.21 0.98 0.00 0.00 173.24 175.88 3hkb s ASN 380 N 0.46 6.88 0.06 7.02 3.04 -0.93 0.02 114.94 131.50 3hkb s ASN 380 Ca -0.07 -2.58 0.02 0.00 0.04 0.00 0.00 52.86 50.27 3hkb s ASN 380 Cb -0.11 -2.42 -0.04 0.00 -1.54 0.00 0.00 41.25 37.14 3hkb s ASN 380 CO 0.01 -0.92 0.11 0.28 -3.04 0.00 0.00 177.10 173.54 3hkb s THR 381 N 2.29 4.75 -1.71 -5.21 -1.32 -1.26 -1.79 115.64 111.39 3hkb s THR 381 Ca 0.40 -0.62 0.23 0.00 -1.21 0.00 0.00 61.69 60.49 3hkb s THR 381 Cb -0.03 -3.27 0.52 0.00 -1.51 0.00 0.00 72.50 68.21 3hkb s THR 381 CO -0.03 0.17 1.73 0.35 -2.21 0.00 0.00 174.62 174.64 3hkb n THR 382 N 0.56 0.16 0.19 5.08 -2.24 -0.34 -2.83 114.28 114.85 3hkb n THR 382 Ca -0.09 0.04 0.06 0.00 -2.27 0.00 0.00 64.05 61.79 3hkb n THR 382 Cb 0.52 -0.68 0.30 0.00 -2.10 0.00 0.00 70.33 68.37 3hkb n THR 382 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3hkb h ALA 383 N 3.24 0.93 -0.35 6.98 0.00 -1.88 -2.93 119.26 125.26 3hkb h ALA 383 Ca 0.00 -0.33 0.10 0.00 0.00 0.00 0.00 54.91 54.68 3hkb h ALA 383 Cb 0.10 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 3hkb h ALA 383 CO 0.00 0.46 0.28 0.97 0.00 0.00 0.00 179.25 180.96 3hkb h ILE 384 N 0.00 0.69 -1.18 0.00 2.10 -1.90 -0.31 117.51 116.92 3hkb h ILE 384 Ca -0.00 0.00 0.34 0.00 1.08 0.00 0.00 64.86 66.28 3hkb h ILE 384 Cb 0.97 0.80 -0.05 0.00 -1.09 0.00 0.00 36.82 37.45 3hkb h ILE 384 CO 0.05 0.00 0.85 0.00 -1.08 0.00 0.00 178.15 177.96 3hkb h ALA 385 N 1.77 3.11 -0.82 0.18 0.00 -1.76 0.13 119.26 121.87 3hkb h ALA 385 Ca 0.17 -0.04 0.08 0.00 0.00 0.00 0.00 54.91 55.12 3hkb h ALA 385 Cb 0.73 0.09 -0.07 0.00 0.00 0.00 0.00 17.79 18.53 3hkb h ALA 385 CO -0.00 -1.45 0.48 0.93 0.00 0.00 0.00 179.25 179.21 3hkb h GLU 386 N 0.00 0.80 0.00 0.00 5.08 -1.28 -0.52 114.58 118.66 3hkb h GLU 386 Ca 0.56 -0.05 -0.02 0.00 -1.00 0.00 0.00 59.36 58.85 3hkb h GLU 386 Cb 2.24 -0.18 -0.00 0.00 0.50 0.00 0.00 28.75 31.31 3hkb h GLU 386 CO -0.01 0.53 -0.09 0.00 -1.00 0.00 0.00 179.01 178.45 3hkb h ALA 387 N 1.44 1.18 0.00 3.43 0.00 -0.94 -1.61 119.26 122.76 3hkb h ALA 387 Ca 0.39 -0.08 -0.15 0.00 0.00 0.00 0.00 54.91 55.06 3hkb h ALA 387 Cb 0.31 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.06 3hkb h ALA 387 CO -0.23 0.11 -0.74 -1.49 0.00 0.00 0.00 179.25 176.91 3hkb h TRP 388 N 0.00 0.00 0.00 0.00 -0.00 -1.15 -3.12 115.95 111.69 3hkb h TRP 388 Ca -0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 58.89 58.89 3hkb h TRP 388 Cb 0.34 0.00 0.00 0.00 -0.00 0.00 0.00 29.16 29.50 3hkb h TRP 388 CO 0.00 0.74 -0.00 0.00 -0.00 0.00 0.00 178.44 179.17 3hkb h ALA 389 N 1.26 -0.00 -1.00 1.49 0.00 -0.87 -2.48 119.26 117.66 3hkb h ALA 389 Ca -0.01 -0.44 0.27 0.00 0.00 0.00 0.00 54.91 54.73 3hkb h ALA 389 Cb 1.44 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 19.17 3hkb h ALA 389 CO 0.10 -0.04 0.69 0.00 0.00 0.00 0.00 179.25 180.00 3hkb h ARG 390 N -0.94 0.17 0.15 0.00 3.08 -1.40 0.56 114.38 116.00 3hkb h ARG 390 Ca -0.00 -0.01 -0.01 0.00 0.07 0.00 0.00 59.98 60.03 3hkb h ARG 390 Cb 0.89 -0.04 0.00 0.00 0.08 0.00 0.00 29.97 30.90 3hkb h ARG 390 CO 0.00 0.11 -0.07 1.25 -1.07 0.00 0.00 179.97 180.19 3hkb h LEU 391 N 0.17 -0.18 -1.36 3.04 5.85 -1.64 -3.21 115.31 117.99 3hkb h LEU 391 Ca 0.51 0.01 0.36 0.00 0.84 0.00 0.00 57.88 59.60 3hkb h LEU 391 Cb 1.69 0.05 -0.12 0.00 0.37 0.00 0.00 40.66 42.65 3hkb h LEU 391 CO -0.11 0.00 0.76 0.44 -0.34 0.00 0.00 178.44 179.19 3hkb h ASP 392 N -0.46 0.33 0.33 1.25 3.45 -0.32 0.17 116.42 121.18 3hkb h ASP 392 Ca -0.02 0.12 -0.02 0.00 0.43 0.00 0.00 57.03 57.54 3hkb h ASP 392 Cb 0.16 0.09 0.00 0.00 -0.56 0.00 0.00 39.33 39.02 3hkb h ASP 392 CO 0.03 -0.08 -0.16 -0.74 -1.57 0.00 0.00 179.24 176.72 3hkb h HIS 393 N 0.21 -0.41 -0.13 4.55 2.76 -0.15 0.24 115.15 122.22 3hkb h HIS 393 Ca 0.73 -0.01 0.03 0.00 -2.20 0.00 0.00 60.37 58.92 3hkb h HIS 393 Cb 2.11 0.14 -0.06 0.00 1.55 0.00 0.00 27.41 31.15 3hkb h HIS 393 CO -0.00 -0.17 -0.55 0.87 -1.30 0.00 0.00 177.93 176.78 3hkb h LYS 394 N -0.59 -0.57 -0.38 5.26 6.56 -0.75 -2.34 116.57 123.76 3hkb h LYS 394 Ca -0.05 0.04 0.08 0.00 -1.06 0.00 0.00 60.65 59.66 3hkb h LYS 394 Cb 0.43 0.13 -0.08 0.00 -0.57 0.00 0.00 32.23 32.14 3hkb h LYS 394 CO 0.07 -0.38 -0.20 0.35 -2.06 0.00 0.00 179.45 177.23 3hkb h PHE 395 N -0.59 -0.52 -0.91 -1.35 3.57 -0.82 0.85 116.94 117.18 3hkb h PHE 395 Ca 0.03 0.04 0.11 0.00 3.53 0.00 0.00 57.97 61.69 3hkb h PHE 395 Cb 0.69 0.29 -0.08 0.00 2.79 0.00 0.00 35.95 39.63 3hkb h PHE 395 CO -0.58 -0.28 0.54 -0.44 -2.23 0.00 0.00 178.31 175.31 3hkb h ASP 396 N -0.14 0.78 1.48 0.41 3.32 -0.39 -0.95 116.42 120.92 3hkb h ASP 396 Ca 0.19 0.05 -0.09 0.00 0.02 0.00 0.00 57.03 57.20 3hkb h ASP 396 Cb 0.43 -0.10 -0.01 0.00 0.22 0.00 0.00 39.33 39.87 3hkb h ASP 396 CO -0.47 0.42 -0.44 0.25 -1.72 0.00 0.00 179.24 177.29 3hkb h LEU 397 N 0.87 0.00 0.00 1.55 6.46 -0.29 -0.10 115.31 123.80 3hkb h LEU 397 Ca 0.45 0.00 -0.01 0.00 -0.12 0.00 0.00 57.88 58.20 3hkb h LEU 397 Cb 0.44 0.00 -0.00 0.00 -0.73 0.00 0.00 40.66 40.37 3hkb h LEU 397 CO -0.27 0.44 -0.10 0.24 -0.62 0.00 0.00 178.44 178.14 3hkb h MET 398 N 0.00 0.00 -0.85 1.25 2.86 -1.25 -3.38 114.93 113.56 3hkb h MET 398 Ca -0.00 0.00 0.23 0.00 -2.06 0.00 0.00 59.70 57.87 3hkb h MET 398 Cb 1.29 0.00 -0.04 0.00 0.06 0.00 0.00 31.60 32.91 3hkb h MET 398 CO 0.06 0.32 0.60 -0.92 1.06 0.00 0.00 176.91 178.02 3hkb h TYR 399 N -1.00 0.13 0.00 -0.22 3.20 -0.95 0.45 116.97 118.58 3hkb h TYR 399 Ca -0.01 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.86 3hkb h TYR 399 Cb 0.37 -0.04 0.00 0.00 1.54 0.00 0.00 36.73 38.61 3hkb h TYR 399 CO 0.06 0.03 0.10 0.00 -1.64 0.00 0.00 178.16 176.71 3hkb n ALA 400 N -2.66 0.82 -0.52 1.82 0.00 -0.07 -0.70 120.51 119.21 3hkb n ALA 400 Ca 0.18 0.02 0.00 0.00 0.00 0.00 0.00 53.44 53.63 3hkb n ALA 400 Cb 0.85 -0.85 0.00 0.00 0.00 0.00 0.00 19.45 19.46 3hkb n ALA 400 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 3hkb n LYS 401 N -1.50 0.08 -0.84 0.00 5.02 0.14 -4.98 118.16 116.09 3hkb n LYS 401 Ca -0.00 -0.46 0.00 0.00 -2.02 0.00 0.00 58.31 55.83 3hkb n LYS 401 Cb 0.10 -0.74 0.00 0.00 -0.02 0.00 0.00 35.03 34.37 3hkb n LYS 401 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 3hkb n ARG 402 N -0.07 -0.60 0.00 1.97 5.12 0.13 -4.89 116.66 118.31 3hkb n ARG 402 Ca 0.00 0.15 0.00 0.00 -1.93 0.00 0.00 57.85 56.07 3hkb n ARG 402 Cb 0.20 -4.00 0.00 0.00 -1.16 0.00 0.00 32.46 27.51 3hkb n ARG 402 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 3hkb n ALA 403 N 1.00 0.00 -1.15 7.54 0.00 -1.17 0.14 120.51 126.86 3hkb n ALA 403 Ca 0.00 0.00 0.02 0.00 0.00 0.00 0.00 53.44 53.46 3hkb n ALA 403 Cb 0.15 0.00 0.02 0.00 0.00 0.00 0.00 19.45 19.62 3hkb n ALA 403 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 3hkb n PHE 404 N 0.00 0.00 -0.20 0.00 3.01 -1.26 -4.88 117.46 114.13 3hkb n PHE 404 Ca 0.00 -0.25 0.15 0.00 1.01 0.00 0.00 57.45 58.36 3hkb n PHE 404 Cb 0.00 -0.05 0.48 0.00 -0.01 0.00 0.00 39.48 39.90 3hkb n PHE 404 CO 0.00 0.00 0.00 0.28 1.01 0.00 0.00 176.76 178.05 3hkb h VAL 405 N 3.25 0.79 0.00 -4.37 2.07 0.77 -0.94 116.25 117.83 3hkb h VAL 405 Ca 0.00 -0.16 0.00 0.00 0.82 0.00 0.00 66.70 67.36 3hkb h VAL 405 Cb 1.04 0.27 0.00 0.00 -1.52 0.00 0.00 31.29 31.08 3hkb h VAL 405 CO 0.00 0.09 0.00 1.12 0.02 0.00 0.00 177.57 178.80 3hkb h HIS 406 N 0.48 0.00 0.00 1.57 2.07 -1.90 0.35 115.15 117.72 3hkb h HIS 406 Ca 0.40 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.92 3hkb h HIS 406 Cb 0.85 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.83 3hkb h HIS 406 CO -0.00 0.00 0.00 -1.49 -3.07 0.00 0.00 177.93 173.37 3hkb h TRP 407 N 0.00 0.00 0.01 6.12 4.06 -1.54 -2.66 115.95 121.94 3hkb h TRP 407 Ca 0.00 0.00 -0.32 0.00 2.06 0.00 0.00 58.89 60.63 3hkb h TRP 407 Cb 0.17 0.00 -0.05 0.00 -1.00 0.00 0.00 29.16 28.28 3hkb h TRP 407 CO 0.00 0.00 -1.73 0.66 -3.56 0.00 0.00 178.44 173.81 3hkb n TYR 408 N -3.08 0.70 -0.18 0.49 4.02 0.12 -3.58 117.16 115.66 3hkb n TYR 408 Ca 0.03 0.29 0.29 0.00 -0.01 0.00 0.00 57.90 58.50 3hkb n TYR 408 Cb 0.43 -1.07 0.72 0.00 -0.02 0.00 0.00 39.34 39.40 3hkb n TYR 408 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 176.86 176.13 3hkb h VAL 409 N -0.91 0.43 -0.07 -0.72 2.07 -1.55 0.53 116.25 116.02 3hkb h VAL 409 Ca -0.47 0.00 -0.16 0.00 0.82 0.00 0.00 66.70 66.89 3hkb h VAL 409 Cb 1.46 0.49 -0.01 0.00 -1.52 0.00 0.00 31.29 31.70 3hkb h VAL 409 CO -0.26 0.00 -0.66 1.23 0.02 0.00 0.00 177.57 177.90 3hkb h GLY 410 N 0.00 0.34 -1.08 2.17 0.00 -1.57 -1.80 103.07 101.12 3hkb h GLY 410 Ca 0.43 -0.45 0.00 0.00 0.00 0.00 0.00 47.33 47.31 3hkb h GLY 410 CO -0.00 0.40 0.00 1.18 0.00 0.00 0.00 176.54 178.11 3hkb n GLU 411 N -3.85 1.71 -2.31 4.80 -0.58 0.14 -4.90 120.64 115.65 3hkb n GLU 411 Ca -0.03 -0.89 0.00 0.00 -0.42 0.00 0.00 57.16 55.82 3hkb n GLU 411 Cb 0.66 -1.31 0.00 0.00 -0.57 0.00 0.00 31.44 30.22 3hkb n GLU 411 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3hkb n GLY 412 N 0.72 0.86 3.67 0.62 0.00 -0.68 -4.73 105.19 105.65 3hkb n GLY 412 Ca 0.08 -0.62 -0.33 0.00 0.00 0.00 0.00 46.02 45.15 3hkb n GLY 412 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 3hkb s MET 413 N -4.61 2.81 0.20 1.61 1.75 -0.98 -4.99 119.30 115.09 3hkb s MET 413 Ca 0.00 -0.57 -0.30 0.00 -1.25 0.00 0.00 55.69 53.58 3hkb s MET 413 Cb 0.00 -2.68 -0.08 0.00 2.84 0.00 0.00 34.83 34.91 3hkb s MET 413 CO 0.00 0.64 1.11 -2.00 -0.65 0.00 0.00 175.02 174.12 3hkb s GLU 414 N -1.33 4.59 0.40 4.11 2.56 -1.26 -3.85 118.70 123.92 3hkb s GLU 414 Ca 0.17 1.75 0.08 0.00 0.00 0.00 0.00 54.97 56.97 3hkb s GLU 414 Cb -0.11 -3.26 0.82 0.00 2.00 0.00 0.00 34.13 33.58 3hkb s GLU 414 CO 0.07 0.09 1.98 1.49 -0.56 0.00 0.00 175.26 178.33 3hkb h GLU 415 N 4.86 0.38 0.00 4.30 4.81 -1.98 -0.53 114.58 126.42 3hkb h GLU 415 Ca -0.45 -0.06 0.00 0.00 -0.13 0.00 0.00 59.36 58.73 3hkb h GLU 415 Cb 1.21 -0.07 0.00 0.00 0.63 0.00 0.00 28.75 30.52 3hkb h GLU 415 CO 0.71 0.37 0.00 0.41 -0.73 0.00 0.00 179.01 179.78 3hkb n GLY 416 N -1.15 -0.97 0.16 1.92 0.00 -1.26 -2.41 105.19 101.48 3hkb n GLY 416 Ca 0.01 -0.06 0.06 0.00 0.00 0.00 0.00 46.02 46.03 3hkb n GLY 416 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 3hkb h GLU 417 N 0.00 0.00 0.36 1.61 4.81 -1.47 -1.88 114.58 118.00 3hkb h GLU 417 Ca 0.00 0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 59.21 3hkb h GLU 417 Cb 0.23 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.62 3hkb h GLU 417 CO 0.00 0.29 -0.17 0.74 -0.73 0.00 0.00 179.01 179.13 3hkb h PHE 418 N 0.00 -0.45 -0.93 0.92 -1.00 -1.56 -2.91 116.94 111.01 3hkb h PHE 418 Ca -0.02 -0.01 0.14 0.00 2.81 0.00 0.00 57.97 60.90 3hkb h PHE 418 Cb 1.25 0.15 -0.15 0.00 3.61 0.00 0.00 35.95 40.81 3hkb h PHE 418 CO 0.00 -0.14 -0.36 0.43 -1.61 0.00 0.00 178.31 176.63 3hkb n SER 419 N -5.11 -0.61 0.13 2.17 7.64 -1.18 -1.74 113.62 114.92 3hkb n SER 419 Ca -0.08 1.62 -0.02 0.00 1.01 0.00 0.00 58.87 61.40 3hkb n SER 419 Cb 0.26 -0.37 0.13 0.00 -1.01 0.00 0.00 64.21 63.22 3hkb n SER 419 CO 0.00 0.00 0.00 -0.08 -3.01 0.00 0.00 175.04 171.95 3hkb h GLU 420 N 0.00 0.00 -0.13 1.43 4.81 -1.44 -1.28 114.58 117.97 3hkb h GLU 420 Ca 0.32 0.00 -0.16 0.00 -0.13 0.00 0.00 59.36 59.39 3hkb h GLU 420 Cb 0.55 0.00 0.01 0.00 0.63 0.00 0.00 28.75 29.94 3hkb h GLU 420 CO -0.92 0.67 -0.56 0.00 -0.73 0.00 0.00 179.01 177.46 3hkb h ALA 421 N 1.33 0.24 -0.40 2.92 0.00 -1.13 -2.85 119.26 119.37 3hkb h ALA 421 Ca -0.01 -0.52 -0.05 0.00 0.00 0.00 0.00 54.91 54.33 3hkb h ALA 421 Cb 1.21 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.96 3hkb h ALA 421 CO 0.09 0.47 0.05 -0.09 0.00 0.00 0.00 179.25 179.76 3hkb h ARG 422 N 0.26 0.61 -0.70 0.00 9.65 -1.20 -1.47 114.38 121.53 3hkb h ARG 422 Ca -0.03 -0.12 0.09 0.00 -1.10 0.00 0.00 59.98 58.81 3hkb h ARG 422 Cb 1.20 -0.09 -0.05 0.00 -1.39 0.00 0.00 29.97 29.64 3hkb h ARG 422 CO 0.12 0.60 0.46 0.93 2.80 0.00 0.00 179.97 184.88 3hkb h GLU 423 N 0.59 0.58 0.12 0.20 5.08 -1.18 -0.70 114.58 119.28 3hkb h GLU 423 Ca 0.13 -0.04 -0.30 0.00 -1.00 0.00 0.00 59.36 58.15 3hkb h GLU 423 Cb 0.30 -0.13 0.03 0.00 0.50 0.00 0.00 28.75 29.45 3hkb h GLU 423 CO 0.01 0.39 -1.25 0.22 -1.00 0.00 0.00 179.01 177.37 3hkb h ASP 424 N 0.60 0.86 0.28 1.42 3.58 -1.14 -2.75 116.42 119.28 3hkb h ASP 424 Ca 0.32 -0.80 -0.04 0.00 0.42 0.00 0.00 57.03 56.93 3hkb h ASP 424 Cb 0.45 -0.27 -0.01 0.00 1.72 0.00 0.00 39.33 41.22 3hkb h ASP 424 CO -0.11 1.60 -0.20 0.24 -2.88 0.00 0.00 179.24 177.89 3hkb h MET 425 N 0.27 0.00 0.21 0.28 2.86 -0.72 0.14 114.93 117.97 3hkb h MET 425 Ca -0.19 0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.44 3hkb h MET 425 Cb 1.93 0.00 0.00 0.00 0.06 0.00 0.00 31.60 33.59 3hkb h MET 425 CO 0.24 0.20 -0.10 0.00 1.06 0.00 0.00 176.91 178.31 3hkb h ALA 426 N 1.80 -0.29 -0.92 6.32 0.00 -1.18 -2.40 119.26 122.60 3hkb h ALA 426 Ca -0.00 -0.19 0.13 0.00 0.00 0.00 0.00 54.91 54.85 3hkb h ALA 426 Cb 0.40 0.11 -0.07 0.00 0.00 0.00 0.00 17.79 18.23 3hkb h ALA 426 CO 0.03 -0.47 0.59 0.00 0.00 0.00 0.00 179.25 179.39 3hkb h ALA 427 N 0.00 1.71 0.27 0.00 0.00 -0.97 0.11 119.26 120.38 3hkb h ALA 427 Ca -0.03 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 3hkb h ALA 427 Cb 0.47 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.10 3hkb h ALA 427 CO 0.05 0.06 -0.13 1.25 0.00 0.00 0.00 179.25 180.48 3hkb h LEU 428 N 0.81 -0.31 -1.84 0.00 5.85 -0.82 0.12 115.31 119.12 3hkb h LEU 428 Ca 0.45 -0.19 0.21 0.00 0.84 0.00 0.00 57.88 59.20 3hkb h LEU 428 Cb 0.59 0.08 -0.04 0.00 0.37 0.00 0.00 40.66 41.66 3hkb h LEU 428 CO -0.22 0.05 0.56 -0.33 -0.34 0.00 0.00 178.44 178.17 3hkb h GLU 429 N -0.70 0.13 0.38 1.25 5.08 -0.81 0.28 114.58 120.19 3hkb h GLU 429 Ca -0.04 -0.01 -0.02 0.00 -1.00 0.00 0.00 59.36 58.30 3hkb h GLU 429 Cb 0.48 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.71 3hkb h GLU 429 CO 0.06 0.09 -0.18 -0.22 -1.00 0.00 0.00 179.01 177.75 3hkb h LYS 430 N 0.13 -0.50 -0.81 2.33 3.64 -0.63 -3.02 116.57 117.72 3hkb h LYS 430 Ca 0.39 0.03 0.11 0.00 -1.27 0.00 0.00 60.65 59.91 3hkb h LYS 430 Cb 1.35 0.11 -0.12 0.00 -0.41 0.00 0.00 32.23 33.16 3hkb h LYS 430 CO -0.06 -0.19 -0.47 -0.44 -2.27 0.00 0.00 179.45 176.02 3hkb h ASP 431 N -0.97 -1.69 -0.40 4.20 3.32 0.28 -0.79 116.42 120.37 3hkb h ASP 431 Ca -0.05 0.29 0.01 0.00 0.02 0.00 0.00 57.03 57.29 3hkb h ASP 431 Cb 0.54 0.79 -0.02 0.00 0.22 0.00 0.00 39.33 40.85 3hkb h ASP 431 CO 0.09 -0.30 0.27 1.88 -1.72 0.00 0.00 179.24 179.46 3hkb h TYR 432 N -0.11 0.50 0.00 4.55 0.99 -1.08 -0.81 116.97 121.01 3hkb h TYR 432 Ca 0.22 0.01 -0.07 0.00 2.00 0.00 0.00 58.73 60.89 3hkb h TYR 432 Cb 0.53 -0.17 -0.01 0.00 1.00 0.00 0.00 36.73 38.08 3hkb h TYR 432 CO -0.85 0.31 -0.47 1.49 -0.00 0.00 0.00 178.16 178.64 3hkb h GLU 433 N 0.53 0.00 -0.16 4.88 4.81 -1.20 -3.28 114.58 120.17 3hkb h GLU 433 Ca 0.15 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.38 3hkb h GLU 433 Cb -0.04 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.34 3hkb h GLU 433 CO -0.03 0.29 0.00 0.39 -0.73 0.00 0.00 179.01 178.93 3hkb n GLU 434 N -3.12 1.44 -0.55 1.92 1.02 -0.32 -2.84 120.64 118.18 3hkb n GLU 434 Ca 0.01 -0.67 0.08 0.00 -0.02 0.00 0.00 57.16 56.57 3hkb n GLU 434 Cb 0.67 -1.23 0.31 0.00 -0.02 0.00 0.00 31.44 31.17 3hkb n GLU 434 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 3hkb n VAL 435 N -0.02 2.01 -4.24 2.62 0.31 -1.15 -4.92 118.33 112.94 3hkb n VAL 435 Ca 0.10 -1.41 -0.34 0.00 -0.01 0.00 0.00 64.34 62.68 3hkb n VAL 435 Cb 0.18 0.00 -0.11 0.00 -0.91 0.00 0.00 33.84 33.00 3hkb n VAL 435 CO 0.00 0.00 0.00 -0.83 -1.32 0.00 0.00 176.83 174.68 3hkb s GLY 436 N -1.20 1.79 0.00 2.92 0.00 -1.13 -4.93 107.32 104.77 3hkb s GLY 436 Ca 0.45 -0.80 0.00 0.00 0.00 0.00 0.00 44.72 44.37 3hkb s GLY 436 CO 0.17 -0.01 0.00 1.55 0.00 0.00 0.00 173.10 174.81