#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hkz s ILE 3 N 0.00 4.34 0.14 -1.33 1.01 -1.26 -4.51 121.20 119.59 3hkz s ILE 3 Ca 0.00 1.60 0.05 0.00 0.00 0.00 0.00 60.65 62.30 3hkz s ILE 3 Cb 0.00 -4.08 -0.04 0.00 0.01 0.00 0.00 42.46 38.35 3hkz s ILE 3 CO 0.00 -0.19 0.10 0.20 0.00 0.00 0.00 174.94 175.05 3hkz s ASN 4 N 1.94 5.42 -0.67 3.58 0.01 -1.24 -4.93 114.94 119.05 3hkz s ASN 4 Ca 0.53 -0.14 -0.26 0.00 -0.71 0.00 0.00 52.86 52.29 3hkz s ASN 4 Cb -0.20 -1.39 0.04 0.00 0.41 0.00 0.00 41.25 40.11 3hkz s ASN 4 CO 0.14 0.10 1.14 -0.76 -1.51 0.00 0.00 177.10 176.21 3hkz s LEU 5 N -2.90 3.64 0.00 0.60 1.43 -1.26 -2.98 118.68 117.20 3hkz s LEU 5 Ca 0.30 -0.48 0.27 0.00 -1.03 0.00 0.00 54.13 53.19 3hkz s LEU 5 Cb -0.10 -2.66 0.96 0.00 0.03 0.00 0.00 46.19 44.42 3hkz s LEU 5 CO 0.22 -1.60 1.72 -0.11 0.23 0.00 0.00 176.35 176.81 3hkz n LEU 6 N 8.55 0.34 0.00 1.79 7.94 -0.70 -4.94 117.00 129.98 3hkz n LEU 6 Ca 0.02 0.16 0.00 0.00 -1.11 0.00 0.00 56.01 55.08 3hkz n LEU 6 Cb 0.48 -0.31 0.00 0.00 0.53 0.00 0.00 43.42 44.12 3hkz n LEU 6 CO 0.68 0.07 0.00 1.57 -1.11 0.00 0.00 177.39 178.61 3hkz n HIS 7 N -1.32 0.00 -3.33 1.96 -0.00 -1.24 -4.87 115.22 106.42 3hkz n HIS 7 Ca 0.09 0.00 0.03 0.00 0.46 0.00 0.00 57.72 58.29 3hkz n HIS 7 Cb 0.32 0.00 -0.04 0.00 -0.12 0.00 0.00 29.99 30.15 3hkz n HIS 7 CO 0.00 0.00 0.00 0.21 0.46 0.00 0.00 176.34 177.01 3hkz s LYS 8 N -2.00 0.13 0.00 1.57 2.47 -1.25 -2.10 119.74 118.57 3hkz s LYS 8 Ca 0.00 0.30 0.00 0.00 -1.56 0.00 0.00 55.97 54.71 3hkz s LYS 8 Cb 0.00 0.16 0.00 0.00 -1.46 0.00 0.00 37.83 36.53 3hkz s LYS 8 CO 0.00 -0.04 0.00 -0.40 0.16 0.00 0.00 175.35 175.07 3hkz n ASP 9 N 4.43 0.00 0.13 1.43 5.75 -1.02 -5.01 116.55 122.27 3hkz n ASP 9 Ca -0.09 0.00 0.08 0.00 -0.01 0.00 0.00 54.79 54.77 3hkz n ASP 9 Cb 0.55 0.00 0.04 0.00 -1.03 0.00 0.00 41.12 40.68 3hkz n ASP 9 CO 0.00 0.00 0.00 -0.78 -0.11 0.00 0.00 177.20 176.31 3hkz h ASP 10 N 0.00 0.00 0.00 -1.12 1.82 -2.02 -3.45 116.42 111.65 3hkz h ASP 10 Ca 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.64 3hkz h ASP 10 Cb 0.00 0.00 0.00 0.00 0.68 0.00 0.00 39.33 40.01 3hkz h ASP 10 CO 0.00 0.17 0.00 0.35 -1.61 0.00 0.00 179.24 178.15 3hkz n THR 11 N -2.93 0.19 -1.85 2.25 -2.24 -1.26 -4.41 114.28 104.03 3hkz n THR 11 Ca 0.00 0.06 -0.43 0.00 -2.27 0.00 0.00 64.05 61.41 3hkz n THR 11 Cb 0.62 -0.57 -0.03 0.00 -2.10 0.00 0.00 70.33 68.25 3hkz n THR 11 CO 0.00 0.00 0.00 -0.60 -0.57 0.00 0.00 175.07 173.90 3hkz s ARG 12 N -1.64 3.36 -0.08 -0.78 3.52 -1.25 -4.10 118.95 117.98 3hkz s ARG 12 Ca 0.00 1.75 0.03 0.00 -0.13 0.00 0.00 55.73 57.38 3hkz s ARG 12 Cb 0.00 -4.24 -0.02 0.00 -1.56 0.00 0.00 34.95 29.13 3hkz s ARG 12 CO 0.00 -1.83 -0.16 0.42 -0.81 0.00 0.00 175.30 172.92 3hkz s ILE 13 N 7.06 2.82 -0.06 4.11 1.01 0.08 -2.43 121.20 133.80 3hkz s ILE 13 Ca 0.87 -0.78 0.03 0.00 0.00 0.00 0.00 60.65 60.77 3hkz s ILE 13 Cb -0.28 -2.12 -0.02 0.00 0.01 0.00 0.00 42.46 40.05 3hkz s ILE 13 CO 0.34 0.56 -0.14 -1.81 0.00 0.00 0.00 174.94 173.89 3hkz s ASP 14 N -0.20 4.03 0.21 3.58 1.01 -0.89 -1.44 116.67 122.96 3hkz s ASP 14 Ca -0.00 -0.21 0.07 0.00 0.71 0.00 0.00 52.55 53.11 3hkz s ASP 14 Cb -0.13 -0.96 -0.05 0.00 1.01 0.00 0.00 42.92 42.79 3hkz s ASP 14 CO 0.03 0.32 -0.11 -0.76 0.21 0.00 0.00 175.17 174.86 3hkz s LEU 15 N -0.58 2.51 -0.42 1.23 1.43 -0.98 -1.72 118.68 120.16 3hkz s LEU 15 Ca 0.08 -1.06 0.02 0.00 -1.03 0.00 0.00 54.13 52.14 3hkz s LEU 15 Cb -0.11 -0.57 0.13 0.00 0.03 0.00 0.00 46.19 45.66 3hkz s LEU 15 CO 0.01 -0.26 0.21 -0.69 0.23 0.00 0.00 176.35 175.85 3hkz s VAL 16 N -3.08 1.45 -0.74 -1.59 1.01 -1.16 -1.48 120.40 114.81 3hkz s VAL 16 Ca 0.23 -2.41 -0.26 0.00 0.00 0.00 0.00 61.98 59.54 3hkz s VAL 16 Cb 0.01 -2.03 0.04 0.00 0.00 0.00 0.00 36.38 34.40 3hkz s VAL 16 CO 0.07 -0.84 1.24 -0.36 0.00 0.00 0.00 175.10 175.20 3hkz s PHE 17 N 0.54 2.36 -0.08 5.22 0.40 0.12 -3.70 117.98 122.84 3hkz s PHE 17 Ca 0.16 -0.17 -0.13 0.00 -0.60 0.00 0.00 56.93 56.19 3hkz s PHE 17 Cb -0.23 -4.58 -0.05 0.00 0.51 0.00 0.00 43.02 38.67 3hkz s PHE 17 CO -0.04 -2.00 0.32 -2.00 0.70 0.00 0.00 175.22 172.19 3hkz s GLU 18 N 5.42 3.93 0.00 0.44 2.12 -1.26 -0.31 118.70 129.04 3hkz s GLU 18 Ca 0.33 0.20 0.00 0.00 0.36 0.00 0.00 54.97 55.86 3hkz s GLU 18 Cb -0.09 -3.28 0.00 0.00 0.26 0.00 0.00 34.13 31.02 3hkz s GLU 18 CO 0.13 0.56 0.00 0.41 -0.54 0.00 0.00 175.26 175.82 3hkz n GLY 19 N 2.38 1.89 3.37 -1.50 0.00 0.10 -4.50 105.19 106.94 3hkz n GLY 19 Ca -0.14 -0.21 -0.40 0.00 0.00 0.00 0.00 46.02 45.27 3hkz n GLY 19 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 3hkz n TYR 20 N 0.00 -1.55 -2.49 1.61 4.02 -1.25 -4.86 117.16 112.64 3hkz n TYR 20 Ca 0.00 0.51 -0.40 0.00 -0.01 0.00 0.00 57.90 57.99 3hkz n TYR 20 Cb 0.00 -1.85 -0.04 0.00 -0.02 0.00 0.00 39.34 37.42 3hkz n TYR 20 CO 0.00 0.00 0.00 -1.25 -1.01 0.00 0.00 176.86 174.60 3hkz s PRO 21 N -1.48 4.65 0.22 -0.72 0.04 -1.26 -4.81 135.00 131.64 3hkz s PRO 21 Ca 0.62 1.78 -0.04 0.00 0.04 0.00 0.00 61.00 63.41 3hkz s PRO 21 Cb -0.52 -3.19 0.20 0.00 0.04 0.00 0.00 34.50 31.03 3hkz s PRO 21 CO 0.60 0.23 1.64 1.25 0.04 0.00 0.00 177.00 180.75 3hkz h LEU 22 N 3.82 0.76 0.00 -3.56 5.85 -1.94 -1.41 115.31 118.83 3hkz h LEU 22 Ca -0.47 -0.27 0.00 0.00 0.84 0.00 0.00 57.88 57.98 3hkz h LEU 22 Cb 1.21 -0.21 0.00 0.00 0.37 0.00 0.00 40.66 42.03 3hkz h LEU 22 CO 0.67 0.97 0.00 -1.84 -0.34 0.00 0.00 178.44 177.90 3hkz n GLU 23 N -4.11 0.06 -0.02 1.25 0.00 -1.26 -1.83 120.64 114.72 3hkz n GLU 23 Ca 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 57.16 57.10 3hkz n GLU 23 Cb 0.43 -1.40 -0.02 0.00 0.00 0.00 0.00 31.44 30.45 3hkz n GLU 23 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.13 177.47 3hkz n PHE 24 N -0.90 0.00 -0.31 -1.84 7.35 -0.58 -4.16 117.46 117.03 3hkz n PHE 24 Ca 0.01 0.00 0.15 0.00 -0.76 0.00 0.00 57.45 56.86 3hkz n PHE 24 Cb 0.00 -0.26 0.34 0.00 0.35 0.00 0.00 39.48 39.91 3hkz n PHE 24 CO 0.00 0.00 0.00 0.28 -0.76 0.00 0.00 176.76 176.28 3hkz h VAL 25 N -0.40 0.39 -0.28 -2.13 2.07 -1.22 0.46 116.25 115.15 3hkz h VAL 25 Ca -0.09 -0.11 -0.11 0.00 0.82 0.00 0.00 66.70 67.20 3hkz h VAL 25 Cb 0.67 0.03 -0.00 0.00 -1.52 0.00 0.00 31.29 30.46 3hkz h VAL 25 CO -0.05 0.06 -0.27 -1.13 0.02 0.00 0.00 177.57 176.20 3hkz h ASN 26 N 0.33 0.71 0.62 0.57 -1.24 -1.64 -2.32 115.58 112.60 3hkz h ASN 26 Ca 0.60 -0.47 0.00 0.00 0.71 0.00 0.00 56.30 57.14 3hkz h ASN 26 Cb 1.21 -0.20 0.00 0.00 0.73 0.00 0.00 38.32 40.06 3hkz h ASN 26 CO -0.58 1.03 0.00 0.00 -1.29 0.00 0.00 177.43 176.59 3hkz n ALA 27 N -2.48 2.01 -0.07 1.57 0.00 0.61 0.11 120.51 122.24 3hkz n ALA 27 Ca -0.04 -0.08 -0.11 0.00 0.00 0.00 0.00 53.44 53.21 3hkz n ALA 27 Cb 0.46 -1.34 -0.09 0.00 0.00 0.00 0.00 19.45 18.48 3hkz n ALA 27 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 3hkz h ILE 28 N 0.00 1.04 -0.61 0.00 1.08 -0.23 -2.91 117.51 115.88 3hkz h ILE 28 Ca 0.00 -1.87 0.11 0.00 -0.39 0.00 0.00 64.86 62.71 3hkz h ILE 28 Cb 0.31 2.05 -0.12 0.00 -3.07 0.00 0.00 36.82 35.99 3hkz h ILE 28 CO 0.00 0.35 -0.30 -0.09 -0.69 0.00 0.00 178.15 177.42 3hkz h ARG 29 N -1.00 -0.12 -0.42 2.37 2.43 -1.06 0.16 114.38 116.74 3hkz h ARG 29 Ca -0.07 0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.12 3hkz h ARG 29 Cb 0.77 0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 30.33 3hkz h ARG 29 CO -0.04 -0.08 0.27 0.00 -1.51 0.00 0.00 179.97 178.61 3hkz h ARG 30 N -0.13 0.56 -0.90 0.20 3.08 -0.50 -1.94 114.38 114.74 3hkz h ARG 30 Ca 0.25 -0.04 0.10 0.00 0.07 0.00 0.00 59.98 60.37 3hkz h ARG 30 Cb 0.54 -0.12 -0.07 0.00 0.08 0.00 0.00 29.97 30.40 3hkz h ARG 30 CO -0.68 0.39 0.58 0.00 -1.07 0.00 0.00 179.97 179.19 3hkz h ALA 31 N 1.14 1.65 -1.23 0.04 0.00 -1.11 0.35 119.26 120.08 3hkz h ALA 31 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.06 3hkz h ALA 31 Cb -0.04 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 17.55 3hkz h ALA 31 CO -0.03 0.16 0.00 0.43 0.00 0.00 0.00 179.25 179.81 3hkz n SER 32 N -4.54 0.00 -0.49 0.00 7.64 0.47 -1.40 113.62 115.30 3hkz n SER 32 Ca 0.16 0.79 0.41 0.00 1.01 0.00 0.00 58.87 61.24 3hkz n SER 32 Cb 0.33 -0.29 0.69 0.00 -1.01 0.00 0.00 64.21 63.92 3hkz n SER 32 CO 0.00 0.00 0.00 0.24 -3.01 0.00 0.00 175.04 172.27 3hkz h MET 33 N 0.00 0.02 0.00 1.43 2.07 -1.24 -3.36 114.93 113.85 3hkz h MET 33 Ca 0.00 -0.00 0.00 0.00 -2.07 0.00 0.00 59.70 57.63 3hkz h MET 33 Cb 0.00 -0.01 0.00 0.00 -1.87 0.00 0.00 31.60 29.72 3hkz h MET 33 CO 0.00 0.02 0.00 1.28 1.07 0.00 0.00 176.91 179.28 3hkz n LEU 34 N -4.65 0.00 0.00 1.22 4.77 0.12 -4.32 117.00 114.14 3hkz n LEU 34 Ca 0.40 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.38 3hkz n LEU 34 Cb 1.58 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 42.67 3hkz n LEU 34 CO 0.21 0.00 0.34 -1.22 -1.33 0.00 0.00 177.39 175.40 3hkz n TYR 35 N 0.00 0.00 -2.49 -1.77 4.01 -0.49 0.13 117.16 116.56 3hkz n TYR 35 Ca 0.00 0.00 -0.43 0.00 -0.16 0.00 0.00 57.90 57.31 3hkz n TYR 35 Cb 0.00 -0.19 -0.02 0.00 -0.31 0.00 0.00 39.34 38.82 3hkz n TYR 35 CO 0.00 0.00 0.00 0.08 -0.46 0.00 0.00 176.86 176.48 3hkz s VAL 36 N -2.37 4.34 0.63 -0.72 1.01 -1.15 -4.73 120.40 117.41 3hkz s VAL 36 Ca 0.00 1.58 -0.10 0.00 0.00 0.00 0.00 61.98 63.46 3hkz s VAL 36 Cb 0.00 -4.14 -0.02 0.00 0.00 0.00 0.00 36.38 32.23 3hkz s VAL 36 CO 0.00 -0.27 1.02 -2.16 0.00 0.00 0.00 175.10 173.69 3hkz s PRO 37 N 3.64 3.27 0.16 2.72 0.04 -1.26 -3.69 135.00 139.88 3hkz s PRO 37 Ca 0.52 0.52 0.02 0.00 0.04 0.00 0.00 61.00 62.10 3hkz s PRO 37 Cb -0.18 -2.11 -0.05 0.00 0.04 0.00 0.00 34.50 32.20 3hkz s PRO 37 CO 0.15 -0.71 -0.02 0.96 0.04 0.00 0.00 177.00 177.42 3hkz s ILE 38 N -3.18 0.78 0.05 0.56 -4.36 -0.67 -4.91 121.20 109.48 3hkz s ILE 38 Ca 0.55 -1.99 -0.30 0.00 -0.26 0.00 0.00 60.65 58.65 3hkz s ILE 38 Cb -0.11 -2.03 -0.05 0.00 1.25 0.00 0.00 42.46 41.52 3hkz s ILE 38 CO 0.51 -0.57 1.08 -0.32 0.24 0.00 0.00 174.94 175.89 3hkz s MET 39 N -3.87 4.52 0.36 0.37 -2.45 -1.26 -1.65 119.30 115.32 3hkz s MET 39 Ca 0.21 1.60 -0.07 0.00 -1.25 0.00 0.00 55.69 56.18 3hkz s MET 39 Cb 0.05 -3.39 0.02 0.00 1.25 0.00 0.00 34.83 32.77 3hkz s MET 39 CO 0.02 -0.10 0.60 0.00 1.05 0.00 0.00 175.02 176.60 3hkz s ALA 40 N 0.81 0.21 0.10 4.11 0.00 -0.78 -4.38 121.76 121.83 3hkz s ALA 40 Ca 0.54 -1.24 -0.26 0.00 0.00 0.00 0.00 51.96 51.00 3hkz s ALA 40 Cb -0.26 0.97 -0.06 0.00 0.00 0.00 0.00 23.12 23.77 3hkz s ALA 40 CO 0.29 -0.87 0.82 0.08 0.00 0.00 0.00 175.76 176.09 3hkz s VAL 41 N -2.72 4.54 -0.01 0.00 1.01 -1.26 -1.57 120.40 120.39 3hkz s VAL 41 Ca 0.25 1.78 -0.01 0.00 0.00 0.00 0.00 61.98 63.99 3hkz s VAL 41 Cb -0.02 -4.18 -0.00 0.00 0.00 0.00 0.00 36.38 32.17 3hkz s VAL 41 CO 0.17 0.41 -0.02 -0.67 0.00 0.00 0.00 175.10 174.99 3hkz n ASP 42 N 2.40 0.13 -4.65 3.32 -0.08 -0.69 -4.85 116.55 112.12 3hkz n ASP 42 Ca -0.02 0.02 -0.31 0.00 -1.51 0.00 0.00 54.79 52.97 3hkz n ASP 42 Cb 0.49 -0.40 -0.09 0.00 2.34 0.00 0.00 41.12 43.47 3hkz n ASP 42 CO 0.00 0.00 0.00 -1.81 0.12 0.00 0.00 177.20 175.51 3hkz s ASP 43 N -4.36 4.88 -0.13 1.67 1.01 -1.26 -4.99 116.67 113.48 3hkz s ASP 43 Ca -0.02 -0.16 0.01 0.00 0.71 0.00 0.00 52.55 53.09 3hkz s ASP 43 Cb 0.00 -1.15 0.02 0.00 1.01 0.00 0.00 42.92 42.80 3hkz s ASP 43 CO 0.02 0.22 -0.14 -0.69 0.21 0.00 0.00 175.17 174.80 3hkz s VAL 44 N -1.18 1.49 -0.55 -1.27 1.01 -1.26 0.24 120.40 118.86 3hkz s VAL 44 Ca 0.22 -0.59 -0.21 0.00 0.00 0.00 0.00 61.98 61.40 3hkz s VAL 44 Cb -0.11 -1.39 0.06 0.00 0.00 0.00 0.00 36.38 34.93 3hkz s VAL 44 CO 0.14 0.44 0.75 -0.31 0.00 0.00 0.00 175.10 176.12 3hkz s TYR 45 N 1.39 2.93 -0.03 5.22 2.02 0.20 -4.90 117.35 124.18 3hkz s TYR 45 Ca 0.02 -0.50 -0.22 0.00 -0.37 0.00 0.00 57.07 56.00 3hkz s TYR 45 Cb -0.13 -3.83 -0.05 0.00 -0.40 0.00 0.00 41.96 37.55 3hkz s TYR 45 CO -0.08 -1.23 0.64 -0.06 -1.57 0.00 0.00 175.55 173.25 3hkz s PHE 46 N 3.11 3.64 -0.14 2.71 0.40 -1.26 -1.47 117.98 124.97 3hkz s PHE 46 Ca 0.19 1.22 -0.04 0.00 -0.60 0.00 0.00 56.93 57.69 3hkz s PHE 46 Cb -0.18 -2.69 -0.07 0.00 0.51 0.00 0.00 43.02 40.58 3hkz s PHE 46 CO 0.12 0.23 -0.15 -0.89 0.70 0.00 0.00 175.22 175.23 3hkz n ILE 47 N 3.19 0.75 -3.59 0.64 5.41 -0.52 -5.02 119.36 120.21 3hkz n ILE 47 Ca -0.04 -0.23 -0.01 0.00 1.00 0.00 0.00 62.75 63.47 3hkz n ILE 47 Cb 0.51 -1.42 -0.04 0.00 -0.71 0.00 0.00 39.64 37.98 3hkz n ILE 47 CO 0.00 0.00 0.00 -0.70 0.00 0.00 0.00 176.55 175.85 3hkz s GLU 48 N -2.25 0.52 -0.34 0.38 2.12 -1.10 -5.00 118.70 113.04 3hkz s GLU 48 Ca -0.19 1.24 0.04 0.00 0.36 0.00 0.00 54.97 56.42 3hkz s GLU 48 Cb 0.06 0.66 0.17 0.00 0.26 0.00 0.00 34.13 35.28 3hkz s GLU 48 CO 0.26 -0.17 0.47 1.21 -0.54 0.00 0.00 175.26 176.49 3hkz s ASN 49 N 2.58 -0.05 -0.42 -1.70 2.47 -1.25 -0.46 114.94 116.10 3hkz s ASN 49 Ca -0.06 -0.70 0.05 0.00 0.42 0.00 0.00 52.86 52.57 3hkz s ASN 49 Cb -0.09 1.26 0.43 0.00 -1.45 0.00 0.00 41.25 41.39 3hkz s ASN 49 CO -0.19 -0.29 1.26 -0.46 -3.72 0.00 0.00 177.10 173.71 3hkz n ASN 50 N 4.89 5.17 -2.46 -4.21 6.94 -1.23 -4.75 115.26 119.60 3hkz n ASN 50 Ca 0.06 -3.74 -0.07 0.00 -0.02 0.00 0.00 54.58 50.81 3hkz n ASN 50 Cb 0.50 -0.49 0.05 0.00 -2.36 0.00 0.00 39.78 37.49 3hkz n ASN 50 CO 0.00 0.00 0.00 -1.54 -1.03 0.00 0.00 177.26 174.69 3hkz n SER 51 N -0.60 0.04 -0.06 0.53 3.41 -1.26 -4.70 113.62 110.98 3hkz n SER 51 Ca 0.43 -1.12 0.00 0.00 -0.26 0.00 0.00 58.87 57.92 3hkz n SER 51 Cb 0.75 -0.24 0.00 0.00 -0.26 0.00 0.00 64.21 64.46 3hkz n SER 51 CO 0.00 0.00 0.00 -0.81 -0.16 0.00 0.00 175.04 174.07 3hkz n PRO 52 N -1.66 1.00 -3.49 4.33 -0.04 -1.26 -4.50 135.00 129.38 3hkz n PRO 52 Ca 0.04 -0.00 -0.27 0.00 -0.04 0.00 0.00 63.50 63.22 3hkz n PRO 52 Cb 0.14 -1.06 -0.11 0.00 -0.04 0.00 0.00 33.50 32.43 3hkz n PRO 52 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 3hkz s LEU 53 N -0.87 1.94 0.72 1.53 1.43 -1.26 -5.08 118.68 117.08 3hkz s LEU 53 Ca 0.00 -3.09 -0.17 0.00 -1.03 0.00 0.00 54.13 49.84 3hkz s LEU 53 Cb 0.00 -0.64 -0.08 0.00 0.03 0.00 0.00 46.19 45.50 3hkz s LEU 53 CO 0.00 -0.17 0.14 0.00 0.23 0.00 0.00 176.35 176.55 3hkz n TYR 54 N 2.84 -2.07 -0.13 0.29 0.18 -1.26 -4.11 117.16 112.89 3hkz n TYR 54 Ca 0.26 0.31 -0.03 0.00 1.88 0.00 0.00 57.90 60.32 3hkz n TYR 54 Cb 0.44 -1.78 -0.03 0.00 -0.38 0.00 0.00 39.34 37.60 3hkz n TYR 54 CO 0.00 0.00 0.00 -0.25 -2.08 0.00 0.00 176.86 174.53 3hkz n ASP 55 N 1.00 -0.33 -0.03 9.48 9.92 -1.26 -1.57 116.55 133.77 3hkz n ASP 55 Ca 0.07 0.57 -0.09 0.00 -0.53 0.00 0.00 54.79 54.81 3hkz n ASP 55 Cb 0.50 -0.08 -0.02 0.00 -0.64 0.00 0.00 41.12 40.88 3hkz n ASP 55 CO 0.00 0.00 0.00 -0.33 0.13 0.00 0.00 177.20 177.00 3hkz h GLU 56 N 0.00 -0.28 0.02 -1.24 3.07 -2.00 -0.39 114.58 113.77 3hkz h GLU 56 Ca 0.06 0.02 -0.22 0.00 -0.50 0.00 0.00 59.36 58.72 3hkz h GLU 56 Cb 0.14 0.06 -0.02 0.00 -0.84 0.00 0.00 28.75 28.09 3hkz h GLU 56 CO -0.30 -0.19 -1.02 0.97 -1.40 0.00 0.00 179.01 177.08 3hkz h ILE 57 N -0.29 1.65 0.09 3.13 -0.00 -1.58 -2.95 117.51 117.57 3hkz h ILE 57 Ca 0.12 -3.25 -0.00 0.00 -0.00 0.00 0.00 64.86 61.73 3hkz h ILE 57 Cb 0.48 2.81 0.00 0.00 -0.00 0.00 0.00 36.82 40.11 3hkz h ILE 57 CO -0.37 0.93 -0.04 0.25 -0.00 0.00 0.00 178.15 178.92 3hkz h LEU 58 N 0.02 -0.10 -0.98 2.19 6.46 -1.43 -3.03 115.31 118.44 3hkz h LEU 58 Ca -0.03 -0.49 0.34 0.00 -0.12 0.00 0.00 57.88 57.58 3hkz h LEU 58 Cb 1.75 0.03 -0.17 0.00 -0.73 0.00 0.00 40.66 41.55 3hkz h LEU 58 CO 0.14 0.52 0.43 0.00 -0.62 0.00 0.00 178.44 178.91 3hkz h ALA 59 N -0.10 1.84 -0.33 1.25 0.00 -1.13 -1.10 119.26 119.68 3hkz h ALA 59 Ca -0.01 0.25 -0.02 0.00 0.00 0.00 0.00 54.91 55.13 3hkz h ALA 59 Cb 0.58 0.32 -0.01 0.00 0.00 0.00 0.00 17.79 18.68 3hkz h ALA 59 CO 0.02 -0.72 0.12 1.25 0.00 0.00 0.00 179.25 179.92 3hkz h HIS 60 N 0.13 0.52 -0.60 0.00 -0.00 -1.42 -2.16 115.15 111.63 3hkz h HIS 60 Ca 0.74 -0.05 0.07 0.00 -0.00 0.00 0.00 60.37 61.13 3hkz h HIS 60 Cb 1.77 -0.15 -0.04 0.00 -0.00 0.00 0.00 27.41 28.99 3hkz h HIS 60 CO -0.12 0.51 0.40 0.00 -0.00 0.00 0.00 177.93 178.72 3hkz h ARG 61 N 0.39 0.52 -0.60 5.26 3.08 -1.09 -2.53 114.38 119.40 3hkz h ARG 61 Ca 0.11 -0.03 -0.05 0.00 0.07 0.00 0.00 59.98 60.08 3hkz h ARG 61 Cb 0.22 -0.12 -0.03 0.00 0.08 0.00 0.00 29.97 30.13 3hkz h ARG 61 CO -0.01 0.34 0.18 -0.07 -1.07 0.00 0.00 179.97 179.35 3hkz h LEU 62 N 0.53 0.89 -1.14 3.04 3.38 -1.02 -2.72 115.31 118.27 3hkz h LEU 62 Ca 0.26 -0.21 -0.04 0.00 0.09 0.00 0.00 57.88 57.98 3hkz h LEU 62 Cb 0.34 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 40.84 3hkz h LEU 62 CO -0.08 0.86 0.19 0.00 0.09 0.00 0.00 178.44 179.50 3hkz h ALA 63 N 1.06 1.31 -0.00 1.53 0.00 -1.05 -2.75 119.26 119.36 3hkz h ALA 63 Ca 0.19 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.94 3hkz h ALA 63 Cb 0.30 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 17.87 3hkz h ALA 63 CO -0.00 0.50 0.00 1.28 0.00 0.00 0.00 179.25 181.03 3hkz n LEU 64 N -4.32 0.13 -4.69 0.00 4.77 -1.04 -4.47 117.00 107.39 3hkz n LEU 64 Ca 0.04 -0.04 -0.42 0.00 -0.03 0.00 0.00 56.01 55.56 3hkz n LEU 64 Cb 0.18 -0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.24 3hkz n LEU 64 CO 0.39 0.02 1.15 -0.63 -1.33 0.00 0.00 177.39 176.99 3hkz s ILE 65 N -2.00 3.67 0.21 -0.08 1.01 -1.04 -4.97 121.20 118.00 3hkz s ILE 65 Ca 0.46 1.04 -0.30 0.00 0.00 0.00 0.00 60.65 61.85 3hkz s ILE 65 Cb 0.21 -3.67 -0.10 0.00 0.01 0.00 0.00 42.46 38.92 3hkz s ILE 65 CO 0.36 -0.01 1.43 -2.84 0.00 0.00 0.00 174.94 173.88 3hkz s PRO 66 N 2.55 4.29 0.16 2.79 0.02 -1.26 -4.93 135.00 138.62 3hkz s PRO 66 Ca 0.65 2.24 0.10 0.00 0.02 0.00 0.00 61.00 64.01 3hkz s PRO 66 Cb -0.32 -3.15 -0.04 0.00 0.02 0.00 0.00 34.50 31.01 3hkz s PRO 66 CO 0.27 -0.42 -0.23 -0.06 -0.33 0.00 0.00 177.00 176.22 3hkz s PHE 67 N 0.36 2.15 -0.99 6.54 0.40 -1.26 -2.97 117.98 122.20 3hkz s PHE 67 Ca 0.61 -0.39 -0.21 0.00 -0.60 0.00 0.00 56.93 56.34 3hkz s PHE 67 Cb -0.40 -1.10 0.09 0.00 0.51 0.00 0.00 43.02 42.11 3hkz s PHE 67 CO 0.39 0.40 1.31 -1.64 0.70 0.00 0.00 175.22 176.37 3hkz s MET 68 N -2.46 3.61 0.00 0.44 -1.94 -1.18 -4.26 119.30 113.51 3hkz s MET 68 Ca 0.16 -1.44 0.26 0.00 -1.71 0.00 0.00 55.69 52.97 3hkz s MET 68 Cb -0.08 -5.16 0.64 0.00 2.01 0.00 0.00 34.83 32.23 3hkz s MET 68 CO 0.08 -2.01 1.49 0.43 -0.01 0.00 0.00 175.02 175.00 3hkz n SER 69 N 7.81 1.46 0.00 3.03 7.64 -1.15 -4.25 113.62 128.16 3hkz n SER 69 Ca 0.29 -1.22 0.00 0.00 1.01 0.00 0.00 58.87 58.95 3hkz n SER 69 Cb 0.50 0.16 0.00 0.00 -1.01 0.00 0.00 64.21 63.86 3hkz n SER 69 CO 0.00 0.00 0.00 1.21 -3.01 0.00 0.00 175.04 173.24 3hkz n GLU 70 N -0.20 0.00 0.07 1.43 4.07 -1.18 -0.04 120.64 124.78 3hkz n GLU 70 Ca 0.13 0.26 -0.13 0.00 -0.06 0.00 0.00 57.16 57.37 3hkz n GLU 70 Cb 0.39 -0.40 -0.08 0.00 -0.06 0.00 0.00 31.44 31.29 3hkz n GLU 70 CO 0.00 0.00 0.00 0.93 -0.06 0.00 0.00 177.13 178.00 3hkz h GLU 71 N 0.00 -0.15 -1.18 5.31 5.08 -1.84 -3.39 114.58 118.41 3hkz h GLU 71 Ca 0.00 0.01 0.34 0.00 -1.00 0.00 0.00 59.36 58.71 3hkz h GLU 71 Cb 0.00 0.03 -0.05 0.00 0.50 0.00 0.00 28.75 29.23 3hkz h GLU 71 CO 0.00 0.12 0.84 0.00 -1.00 0.00 0.00 179.01 178.97 3hkz h ALA 72 N 0.43 3.05 -0.01 3.43 0.00 -0.67 -0.15 119.26 125.34 3hkz h ALA 72 Ca -0.02 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.87 3hkz h ALA 72 Cb 0.34 0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.22 3hkz h ALA 72 CO 0.03 -1.40 0.06 -0.07 0.00 0.00 0.00 179.25 177.87 3hkz h LEU 73 N 0.03 0.00 0.00 0.00 3.38 -1.56 -2.65 115.31 114.51 3hkz h LEU 73 Ca 0.57 0.00 -0.34 0.00 0.09 0.00 0.00 57.88 58.21 3hkz h LEU 73 Cb 2.22 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 42.90 3hkz h LEU 73 CO -0.04 0.00 -2.26 0.47 0.09 0.00 0.00 178.44 176.70 3hkz n ASP 74 N -3.16 0.57 0.01 -0.43 8.00 -0.07 -4.48 116.55 116.98 3hkz n ASP 74 Ca -0.03 -0.01 0.13 0.00 0.71 0.00 0.00 54.79 55.59 3hkz n ASP 74 Cb 0.13 0.88 0.34 0.00 -0.02 0.00 0.00 41.12 42.45 3hkz n ASP 74 CO 0.00 0.00 0.00 0.35 -0.39 0.00 0.00 177.20 177.16 3hkz n THR 75 N -2.71 0.04 -4.29 -3.53 -2.24 -1.05 -4.94 114.28 95.56 3hkz n THR 75 Ca -0.30 -0.03 -0.17 0.00 -2.27 0.00 0.00 64.05 61.27 3hkz n THR 75 Cb 1.09 0.01 -0.10 0.00 -2.10 0.00 0.00 70.33 69.23 3hkz n THR 75 CO 0.00 0.00 0.00 -0.31 -0.57 0.00 0.00 175.07 174.19 3hkz s TYR 76 N -3.02 1.51 0.30 4.78 1.51 -1.03 -4.95 117.35 116.45 3hkz s TYR 76 Ca 0.11 -0.61 -0.26 0.00 -1.01 0.00 0.00 57.07 55.30 3hkz s TYR 76 Cb 0.17 -0.74 -0.10 0.00 -0.11 0.00 0.00 41.96 41.19 3hkz s TYR 76 CO 0.66 0.22 0.91 1.03 -1.11 0.00 0.00 175.55 177.26 3hkz s ARG 77 N -3.36 4.58 0.15 -0.62 0.52 0.82 -4.88 118.95 116.17 3hkz s ARG 77 Ca 0.17 1.29 -0.25 0.00 -0.52 0.00 0.00 55.73 56.42 3hkz s ARG 77 Cb -0.01 -2.88 -0.08 0.00 0.52 0.00 0.00 34.95 32.50 3hkz s ARG 77 CO 0.04 0.33 0.76 -1.58 0.02 0.00 0.00 175.30 174.87 3hkz s TRP 78 N -1.54 3.89 0.59 -0.53 0.52 -1.26 -4.68 118.94 115.93 3hkz s TRP 78 Ca 0.48 1.60 0.22 0.00 0.02 0.00 0.00 56.10 58.42 3hkz s TRP 78 Cb -0.19 -2.75 0.77 0.00 -1.15 0.00 0.00 33.47 30.14 3hkz s TRP 78 CO 0.24 0.51 1.21 -2.30 0.02 0.00 0.00 176.95 176.64 3hkz n PRO 79 N 1.65 0.02 -0.12 4.98 -0.02 -1.26 -0.42 135.00 139.83 3hkz n PRO 79 Ca -0.06 0.97 -0.10 0.00 -2.02 0.00 0.00 63.50 62.30 3hkz n PRO 79 Cb 0.49 -2.44 -0.02 0.00 -0.02 0.00 0.00 33.50 31.51 3hkz n PRO 79 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 3hkz h GLU 80 N 0.00 0.54 0.00 -0.52 3.07 -1.95 0.63 114.58 116.35 3hkz h GLU 80 Ca 0.42 -0.10 0.00 0.00 -0.50 0.00 0.00 59.36 59.17 3hkz h GLU 80 Cb 2.72 -0.08 0.00 0.00 -0.84 0.00 0.00 28.75 30.54 3hkz h GLU 80 CO -0.00 0.54 0.00 0.93 -1.40 0.00 0.00 179.01 179.08 3hkz h GLU 81 N 0.42 0.00 -0.02 2.33 3.07 -1.10 -2.42 114.58 116.86 3hkz h GLU 81 Ca 0.12 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.98 3hkz h GLU 81 Cb 0.21 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.12 3hkz h GLU 81 CO -0.01 0.00 -0.36 0.00 -1.40 0.00 0.00 179.01 177.24 3hkz s ILE 83 N -2.36 2.72 -1.90 0.00 1.01 0.18 -3.21 121.20 117.64 3hkz s ILE 83 Ca 0.21 0.53 0.00 0.00 0.00 0.00 0.00 60.65 61.39 3hkz s ILE 83 Cb 0.19 -3.34 0.00 0.00 0.01 0.00 0.00 42.46 39.31 3hkz s ILE 83 CO 0.51 0.05 0.00 -0.62 0.00 0.00 0.00 174.94 174.88 3hkz n GLU 84 N 3.70 -1.60 -3.60 2.79 -0.58 -1.26 -4.94 120.64 115.16 3hkz n GLU 84 Ca 0.12 1.07 -0.40 0.00 -0.42 0.00 0.00 57.16 57.53 3hkz n GLU 84 Cb 0.39 -5.58 -0.08 0.00 -0.57 0.00 0.00 31.44 25.60 3hkz n GLU 84 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 3hkz s THR 86 N 0.72 5.08 0.04 0.00 2.01 -1.26 -4.85 115.64 117.38 3hkz s THR 86 Ca 0.11 -1.57 0.00 0.00 0.31 0.00 0.00 61.69 60.55 3hkz s THR 86 Cb -0.22 -4.51 0.00 0.00 0.01 0.00 0.00 72.50 67.79 3hkz s THR 86 CO -0.03 -1.12 0.00 1.21 -0.69 0.00 0.00 174.62 173.98 3hkz n GLU 87 N 5.56 -0.28 -1.23 4.92 2.13 -1.26 -4.96 120.64 125.53 3hkz n GLU 87 Ca 0.01 0.22 -0.04 0.00 0.66 0.00 0.00 57.16 58.01 3hkz n GLU 87 Cb 0.44 -0.27 -0.02 0.00 0.27 0.00 0.00 31.44 31.86 3hkz n GLU 87 CO 0.00 0.00 0.00 0.09 -0.41 0.00 0.00 177.13 176.81 3hkz n ASN 88 N -1.67 -3.32 -3.12 4.31 3.02 -1.26 -4.96 115.26 108.26 3hkz n ASN 88 Ca -0.00 0.09 -0.34 0.00 -0.03 0.00 0.00 54.58 54.29 3hkz n ASN 88 Cb 0.04 -1.36 0.00 0.00 -0.61 0.00 0.00 39.78 37.85 3hkz n ASN 88 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3hkz h GLU 90 N 3.37 0.06 0.00 0.00 5.08 -1.93 -0.39 114.58 120.77 3hkz h GLU 90 Ca 0.39 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.71 3hkz h GLU 90 Cb 0.41 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.66 3hkz h GLU 90 CO 1.07 0.54 0.00 1.63 -1.00 0.00 0.00 179.01 181.25 3hkz n LYS 91 N -3.95 0.59 -0.04 2.33 5.02 -1.26 -3.34 118.16 117.50 3hkz n LYS 91 Ca -0.02 0.00 -0.07 0.00 -2.02 0.00 0.00 58.31 56.20 3hkz n LYS 91 Cb 0.52 -1.11 -0.03 0.00 -0.02 0.00 0.00 35.03 34.39 3hkz n LYS 91 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3hkz s TYR 93 N -2.16 3.18 0.00 0.00 4.12 -0.97 -4.30 117.35 117.23 3hkz s TYR 93 Ca -0.11 -0.94 0.00 0.00 0.02 0.00 0.00 57.07 56.04 3hkz s TYR 93 Cb 0.04 -2.31 0.00 0.00 -1.52 0.00 0.00 41.96 38.17 3hkz s TYR 93 CO 0.17 -0.58 0.00 -2.37 0.02 0.00 0.00 175.55 172.79 3hkz n THR 94 N 4.91 0.00 -3.28 -0.71 5.66 -1.13 -4.87 114.28 114.85 3hkz n THR 94 Ca -0.14 0.00 0.03 0.00 -3.05 0.00 0.00 64.05 60.89 3hkz n THR 94 Cb 0.48 0.00 -0.04 0.00 -1.55 0.00 0.00 70.33 69.22 3hkz n THR 94 CO 0.00 0.00 0.00 -0.54 -3.05 0.00 0.00 175.07 171.48 3hkz s LYS 95 N 0.21 0.15 0.20 1.09 1.02 -1.26 -4.50 119.74 116.65 3hkz s LYS 95 Ca 0.00 0.38 0.06 0.00 0.02 0.00 0.00 55.97 56.43 3hkz s LYS 95 Cb 0.00 0.23 -0.04 0.00 -0.52 0.00 0.00 37.83 37.50 3hkz s LYS 95 CO 0.00 -0.06 0.13 0.96 -0.92 0.00 0.00 175.35 175.46 3hkz s ILE 96 N 2.25 4.32 0.02 2.17 -4.36 -1.26 -4.24 121.20 120.10 3hkz s ILE 96 Ca -0.01 -1.27 0.04 0.00 -0.26 0.00 0.00 60.65 59.15 3hkz s ILE 96 Cb -0.03 -3.25 -0.01 0.00 1.25 0.00 0.00 42.46 40.41 3hkz s ILE 96 CO -0.17 -0.20 -0.12 -0.31 0.24 0.00 0.00 174.94 174.39 3hkz s TYR 97 N -1.89 1.02 -0.12 1.37 1.51 -1.26 -1.00 117.35 116.98 3hkz s TYR 97 Ca 0.31 -0.27 -0.04 0.00 -1.01 0.00 0.00 57.07 56.06 3hkz s TYR 97 Cb -0.09 -0.63 0.05 0.00 -0.11 0.00 0.00 41.96 41.18 3hkz s TYR 97 CO 0.23 -0.00 0.13 0.42 -1.11 0.00 0.00 175.55 175.22 3hkz s ILE 98 N -0.58 -0.20 -0.41 2.71 1.09 -1.10 -1.33 121.20 121.37 3hkz s ILE 98 Ca 0.02 0.17 0.07 0.00 -1.10 0.00 0.00 60.65 59.80 3hkz s ILE 98 Cb -0.06 -0.40 0.22 0.00 -1.06 0.00 0.00 42.46 41.17 3hkz s ILE 98 CO 0.00 -0.01 0.47 -0.62 -0.10 0.00 0.00 174.94 174.69 3hkz n GLU 99 N 5.31 0.65 -3.85 2.79 1.02 -1.26 -2.20 120.64 123.10 3hkz n GLU 99 Ca -0.05 -3.30 -0.22 0.00 -0.02 0.00 0.00 57.16 53.58 3hkz n GLU 99 Cb 0.50 -1.42 -0.04 0.00 -0.02 0.00 0.00 31.44 30.45 3hkz n GLU 99 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3hkz s ALA 100 N -0.86 3.79 0.06 0.62 0.00 -1.10 -4.97 121.76 119.29 3hkz s ALA 100 Ca 0.34 -1.73 -0.04 0.00 0.00 0.00 0.00 51.96 50.53 3hkz s ALA 100 Cb 0.12 -1.03 -0.02 0.00 0.00 0.00 0.00 23.12 22.19 3hkz s ALA 100 CO -0.13 -0.02 0.06 -2.00 0.00 0.00 0.00 175.76 173.66 3hkz s GLU 101 N -3.98 0.65 -0.36 0.00 2.12 -1.26 -2.10 118.70 113.77 3hkz s GLU 101 Ca 0.41 -1.02 -0.13 0.00 0.36 0.00 0.00 54.97 54.59 3hkz s GLU 101 Cb -0.04 0.25 -0.00 0.00 0.26 0.00 0.00 34.13 34.59 3hkz s GLU 101 CO 0.26 -0.16 0.26 0.00 -0.54 0.00 0.00 175.26 175.08 3hkz s ALA 102 N -3.50 3.49 0.00 6.30 0.00 -0.86 -5.02 121.76 122.17 3hkz s ALA 102 Ca 0.03 -1.50 0.00 0.00 0.00 0.00 0.00 51.96 50.49 3hkz s ALA 102 Cb 0.04 -2.73 0.00 0.00 0.00 0.00 0.00 23.12 20.43 3hkz s ALA 102 CO -0.09 -1.14 0.41 -0.35 0.00 0.00 0.00 175.76 174.59 3hkz n PRO 103 N 5.12 0.00 -2.51 0.00 -0.04 -1.26 -3.18 135.00 133.13 3hkz n PRO 103 Ca -0.12 0.32 -0.01 0.00 -0.04 0.00 0.00 63.50 63.65 3hkz n PRO 103 Cb 0.49 -1.07 0.07 0.00 -0.04 0.00 0.00 33.50 32.95 3hkz n PRO 103 CO 0.00 0.00 0.00 -1.71 -0.04 0.00 0.00 175.50 173.75 3hkz n ASN 104 N -1.46 0.24 -3.55 3.54 2.85 -1.26 -4.56 115.26 111.06 3hkz n ASN 104 Ca 0.00 -2.09 -0.15 0.00 -0.11 0.00 0.00 54.58 52.24 3hkz n ASN 104 Cb 0.00 0.01 -0.05 0.00 1.24 0.00 0.00 39.78 40.98 3hkz n ASN 104 CO 0.00 0.00 0.00 -1.83 -2.11 0.00 0.00 177.26 173.32 3hkz s GLU 105 N -1.74 1.05 0.41 1.20 -1.05 -1.26 -4.97 118.70 112.33 3hkz s GLU 105 Ca 0.19 -0.14 -0.23 0.00 -0.15 0.00 0.00 54.97 54.64 3hkz s GLU 105 Cb 0.35 0.48 -0.09 0.00 -0.44 0.00 0.00 34.13 34.43 3hkz s GLU 105 CO -0.08 -0.37 1.01 -2.14 0.95 0.00 0.00 175.26 174.62 3hkz s PRO 106 N -2.23 4.20 -0.16 -4.83 0.02 -1.26 -0.76 135.00 129.98 3hkz s PRO 106 Ca -0.06 1.37 -0.09 0.00 0.02 0.00 0.00 61.00 62.24 3hkz s PRO 106 Cb -0.01 -2.44 0.06 0.00 0.02 0.00 0.00 34.50 32.13 3hkz s PRO 106 CO 0.00 -0.08 0.40 0.50 -0.33 0.00 0.00 177.00 177.48 3hkz s ARG 107 N -2.68 0.38 -0.32 5.54 3.52 0.41 -4.88 118.95 120.91 3hkz s ARG 107 Ca 0.59 0.77 -0.16 0.00 -0.13 0.00 0.00 55.73 56.79 3hkz s ARG 107 Cb -0.18 -0.03 -0.02 0.00 -1.56 0.00 0.00 34.95 33.16 3hkz s ARG 107 CO 0.22 -0.16 0.42 1.41 -0.81 0.00 0.00 175.30 176.39 3hkz s MET 108 N 1.39 3.71 0.58 5.12 -2.45 -1.26 0.14 119.30 126.52 3hkz s MET 108 Ca -0.10 -0.20 -0.18 0.00 -1.25 0.00 0.00 55.69 53.97 3hkz s MET 108 Cb -0.09 -3.77 -0.04 0.00 1.25 0.00 0.00 34.83 32.19 3hkz s MET 108 CO -0.12 -0.50 1.12 0.42 1.05 0.00 0.00 175.02 176.98 3hkz s ILE 109 N 2.17 3.24 0.37 10.11 -1.09 -0.03 -4.96 121.20 131.01 3hkz s ILE 109 Ca 0.15 0.70 0.04 0.00 -2.23 0.00 0.00 60.65 59.31 3hkz s ILE 109 Cb -0.16 -3.24 -0.03 0.00 -1.58 0.00 0.00 42.46 37.45 3hkz s ILE 109 CO 0.12 -0.23 0.15 -0.31 -1.23 0.00 0.00 174.94 173.43 3hkz s TYR 110 N -1.98 1.75 -0.51 3.97 1.51 -1.26 -1.36 117.35 119.47 3hkz s TYR 110 Ca 0.70 -1.32 0.25 0.00 -1.01 0.00 0.00 57.07 55.69 3hkz s TYR 110 Cb -0.22 -1.05 0.95 0.00 -0.11 0.00 0.00 41.96 41.53 3hkz s TYR 110 CO 0.31 -0.39 1.74 0.66 -1.11 0.00 0.00 175.55 176.77 3hkz h SER 111 N 1.95 0.00 0.09 2.29 4.64 -1.62 -2.61 113.55 118.29 3hkz h SER 111 Ca -0.34 0.00 -0.12 0.00 -0.47 0.00 0.00 61.79 60.86 3hkz h SER 111 Cb 1.26 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.34 3hkz h SER 111 CO 0.54 0.00 -0.40 0.07 -0.87 0.00 0.00 176.83 176.17 3hkz h LYS 112 N 0.00 0.40 -0.74 4.77 2.10 -1.84 -2.96 116.57 118.30 3hkz h LYS 112 Ca 0.00 -0.19 0.00 0.00 -2.00 0.00 0.00 60.65 58.46 3hkz h LYS 112 Cb 0.48 -0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.81 3hkz h LYS 112 CO 0.00 0.74 0.00 -0.25 -2.00 0.00 0.00 179.45 177.94 3hkz n ASP 113 N -4.03 0.74 -4.65 7.07 8.00 -0.98 -4.72 116.55 117.97 3hkz n ASP 113 Ca -0.01 -1.70 -0.37 0.00 0.71 0.00 0.00 54.79 53.41 3hkz n ASP 113 Cb 0.49 -0.37 -0.09 0.00 -0.02 0.00 0.00 41.12 41.14 3hkz n ASP 113 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 3hkz s ILE 114 N -1.14 5.28 -0.04 0.53 1.09 -1.12 -4.56 121.20 121.25 3hkz s ILE 114 Ca 0.00 0.40 -0.25 0.00 -1.10 0.00 0.00 60.65 59.70 3hkz s ILE 114 Cb 0.00 -3.60 -0.21 0.00 -1.06 0.00 0.00 42.46 37.59 3hkz s ILE 114 CO 0.00 0.29 1.14 0.11 -0.10 0.00 0.00 174.94 176.37 3hkz h LYS 115 N 7.59 0.11 0.00 2.79 1.57 -1.49 -3.47 116.57 123.66 3hkz h LYS 115 Ca -0.36 -0.08 0.00 0.00 -1.87 0.00 0.00 60.65 58.33 3hkz h LYS 115 Cb 1.17 0.02 0.00 0.00 0.08 0.00 0.00 32.23 33.49 3hkz h LYS 115 CO 0.67 0.73 0.00 0.45 -0.57 0.00 0.00 179.45 180.73 3hkz n SER 116 N -4.67 0.00 0.00 0.86 2.88 -1.26 -4.78 113.62 106.65 3hkz n SER 116 Ca -0.09 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.45 3hkz n SER 116 Cb 0.38 -0.02 0.00 0.00 -0.75 0.00 0.00 64.21 63.82 3hkz n SER 116 CO 0.00 0.00 0.00 1.21 -1.23 0.00 0.00 175.04 175.02 3hkz n GLU 117 N -1.00 0.00 -2.31 -1.46 2.13 -1.26 -4.52 120.64 112.21 3hkz n GLU 117 Ca 0.00 0.00 -0.41 0.00 0.66 0.00 0.00 57.16 57.41 3hkz n GLU 117 Cb 0.00 0.00 -0.03 0.00 0.27 0.00 0.00 31.44 31.68 3hkz n GLU 117 CO 0.00 0.00 0.00 0.34 -0.41 0.00 0.00 177.13 177.06 3hkz s ASP 118 N 0.00 6.01 0.00 4.31 3.68 -1.26 -4.88 116.67 124.53 3hkz s ASP 118 Ca 0.00 0.39 0.09 0.00 2.13 0.00 0.00 52.55 55.16 3hkz s ASP 118 Cb 0.00 -2.54 0.53 0.00 -1.45 0.00 0.00 42.92 39.46 3hkz s ASP 118 CO 0.00 -1.78 0.97 -0.81 0.13 0.00 0.00 175.17 173.68 3hkz n PRO 119 N 8.69 0.30 0.00 4.34 -0.04 -1.26 -1.34 135.00 145.69 3hkz n PRO 119 Ca 0.14 0.00 0.12 0.00 -0.04 0.00 0.00 63.50 63.73 3hkz n PRO 119 Cb 0.49 -1.47 0.34 0.00 -0.04 0.00 0.00 33.50 32.82 3hkz n PRO 119 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 3hkz n SER 120 N -0.97 0.41 -3.67 3.54 3.41 -1.26 -4.65 113.62 110.42 3hkz n SER 120 Ca 0.07 -0.12 -0.28 0.00 -0.26 0.00 0.00 58.87 58.27 3hkz n SER 120 Cb 0.03 0.09 -0.12 0.00 -0.26 0.00 0.00 64.21 63.95 3hkz n SER 120 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 3hkz s VAL 121 N -2.98 1.55 0.17 -3.33 1.01 -0.45 -4.70 120.40 111.67 3hkz s VAL 121 Ca 0.12 -3.12 0.10 0.00 0.00 0.00 0.00 61.98 59.08 3hkz s VAL 121 Cb 0.18 -2.05 -0.04 0.00 0.00 0.00 0.00 36.38 34.47 3hkz s VAL 121 CO 0.66 -1.03 -0.20 0.68 0.00 0.00 0.00 175.10 175.20 3hkz s VAL 122 N -0.29 2.00 0.48 2.92 -7.23 -1.26 -4.84 120.40 112.18 3hkz s VAL 122 Ca 0.24 -1.95 -0.20 0.00 -1.81 0.00 0.00 61.98 58.26 3hkz s VAL 122 Cb -0.10 -1.94 -0.12 0.00 0.56 0.00 0.00 36.38 34.79 3hkz s VAL 122 CO -0.11 -0.24 0.38 -2.65 -0.31 0.00 0.00 175.10 172.17 3hkz n PRO 123 N 0.29 0.40 0.00 4.82 -0.02 -1.26 -3.07 135.00 136.15 3hkz n PRO 123 Ca -0.13 0.15 0.14 0.00 -2.02 0.00 0.00 63.50 61.64 3hkz n PRO 123 Cb 0.57 -1.43 0.78 0.00 -0.02 0.00 0.00 33.50 33.40 3hkz n PRO 123 CO 0.00 0.00 0.00 0.44 1.98 0.00 0.00 175.50 177.92 3hkz n ILE 124 N -1.24 0.04 -3.15 4.25 -6.64 -1.16 -4.48 119.36 106.99 3hkz n ILE 124 Ca 0.11 0.01 0.04 0.00 -1.77 0.00 0.00 62.75 61.14 3hkz n ILE 124 Cb 0.43 -0.54 -0.00 0.00 -1.44 0.00 0.00 39.64 38.10 3hkz n ILE 124 CO 0.00 0.00 0.00 -0.55 -1.77 0.00 0.00 176.55 174.23 3hkz s SER 125 N -2.38 -1.32 -0.45 7.28 0.15 -1.26 -5.05 113.70 110.67 3hkz s SER 125 Ca 0.33 0.14 -0.06 0.00 0.70 0.00 0.00 55.95 57.06 3hkz s SER 125 Cb 0.20 1.83 -0.06 0.00 -1.71 0.00 0.00 66.02 66.28 3hkz s SER 125 CO 0.41 -0.24 1.59 0.61 1.20 0.00 0.00 173.24 176.81 3hkz n GLY 126 N 5.32 2.28 0.00 9.45 0.00 -1.26 -2.89 105.19 118.09 3hkz n GLY 126 Ca 0.06 -0.53 0.00 0.00 0.00 0.00 0.00 46.02 45.56 3hkz n GLY 126 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 3hkz n ASP 127 N 5.11 0.00 -4.74 1.61 2.03 -1.26 -3.88 116.55 115.43 3hkz n ASP 127 Ca 0.26 -0.94 -0.35 0.00 0.52 0.00 0.00 54.79 54.28 3hkz n ASP 127 Cb 0.12 0.00 -0.08 0.00 -0.72 0.00 0.00 41.12 40.44 3hkz n ASP 127 CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 3hkz s ILE 128 N 0.00 5.41 -0.40 5.18 1.01 -1.14 -4.91 121.20 126.34 3hkz s ILE 128 Ca 0.00 0.21 -0.28 0.00 0.00 0.00 0.00 60.65 60.58 3hkz s ILE 128 Cb 0.00 -3.48 -0.01 0.00 0.01 0.00 0.00 42.46 38.99 3hkz s ILE 128 CO 0.00 0.44 1.65 -2.16 0.00 0.00 0.00 174.94 174.88 3hkz s PRO 129 N 0.31 3.34 -0.01 2.79 0.04 -1.26 -1.81 135.00 138.40 3hkz s PRO 129 Ca 0.09 1.12 -0.10 0.00 0.04 0.00 0.00 61.00 62.15 3hkz s PRO 129 Cb -0.11 -4.15 -0.06 0.00 0.04 0.00 0.00 34.50 30.22 3hkz s PRO 129 CO -0.01 -1.85 0.65 0.82 0.04 0.00 0.00 177.00 176.64 3hkz h ILE 130 N 6.67 0.00 -3.32 0.56 1.08 -1.51 -3.49 117.51 117.50 3hkz h ILE 130 Ca -0.30 -0.26 -0.04 0.00 -0.39 0.00 0.00 64.86 63.86 3hkz h ILE 130 Cb 1.14 0.00 -0.05 0.00 -3.07 0.00 0.00 36.82 34.85 3hkz h ILE 130 CO 1.08 0.00 0.10 0.54 -0.69 0.00 0.00 178.15 179.18 3hkz s VAL 131 N -2.94 0.00 -0.16 1.67 0.11 -1.23 -5.02 120.40 112.83 3hkz s VAL 131 Ca -0.05 -1.19 -0.03 0.00 -2.93 0.00 0.00 61.98 57.78 3hkz s VAL 131 Cb 0.01 -2.43 -0.02 0.00 -1.53 0.00 0.00 36.38 32.40 3hkz s VAL 131 CO 0.16 0.00 -0.05 -0.22 -3.33 0.00 0.00 175.10 171.66 3hkz s LEU 132 N -3.04 3.15 -0.29 2.54 1.98 -1.26 -0.85 118.68 120.91 3hkz s LEU 132 Ca 0.18 -0.18 -0.05 0.00 -2.89 0.00 0.00 54.13 51.19 3hkz s LEU 132 Cb -0.04 -1.76 0.02 0.00 0.66 0.00 0.00 46.19 45.08 3hkz s LEU 132 CO 0.11 0.15 0.05 -0.76 -1.89 0.00 0.00 176.35 174.00 3hkz s LEU 133 N 0.48 3.79 -0.27 -0.68 1.43 0.37 -4.31 118.68 119.48 3hkz s LEU 133 Ca -0.04 -0.87 -0.11 0.00 -1.03 0.00 0.00 54.13 52.08 3hkz s LEU 133 Cb -0.14 -1.81 -0.05 0.00 0.03 0.00 0.00 46.19 44.21 3hkz s LEU 133 CO 0.03 -0.21 0.17 -0.83 0.23 0.00 0.00 176.35 175.75 3hkz s GLY 134 N 1.42 1.91 0.00 -3.19 0.00 -1.26 0.16 107.32 106.36 3hkz s GLY 134 Ca 0.01 -1.09 0.00 0.00 0.00 0.00 0.00 44.72 43.64 3hkz s GLY 134 CO 0.01 0.63 0.00 -1.30 0.00 0.00 0.00 173.10 172.43 3hkz n THR 135 N 5.01 0.00 -1.27 0.90 -2.24 0.06 -2.40 114.28 114.35 3hkz n THR 135 Ca -0.14 0.00 -0.09 0.00 -2.27 0.00 0.00 64.05 61.54 3hkz n THR 135 Cb 0.52 0.00 -0.04 0.00 -2.10 0.00 0.00 70.33 68.71 3hkz n THR 135 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 3hkz n ASN 136 N 0.80 -4.37 -4.98 3.42 4.13 -1.19 -5.00 115.26 108.06 3hkz n ASN 136 Ca 0.00 0.23 -0.20 0.00 1.68 0.00 0.00 54.58 56.29 3hkz n ASN 136 Cb 0.00 -2.69 -0.00 0.00 -1.54 0.00 0.00 39.78 35.54 3hkz n ASN 136 CO 0.00 0.00 0.00 -1.10 0.28 0.00 0.00 177.26 176.44 3hkz s GLN 137 N -2.64 3.14 -0.28 3.52 -0.21 -1.01 -4.99 119.66 117.19 3hkz s GLN 137 Ca 0.00 -0.91 -0.13 0.00 0.02 0.00 0.00 55.36 54.34 3hkz s GLN 137 Cb 0.00 -2.79 0.10 0.00 1.00 0.00 0.00 33.01 31.32 3hkz s GLN 137 CO 0.00 0.05 0.65 0.21 -2.12 0.00 0.00 175.29 174.07 3hkz s LYS 138 N -4.21 0.62 -0.18 2.91 2.20 -1.26 -2.04 119.74 117.78 3hkz s LYS 138 Ca 0.45 1.29 -0.04 0.00 -0.36 0.00 0.00 55.97 57.31 3hkz s LYS 138 Cb -0.10 0.45 -0.02 0.00 -1.51 0.00 0.00 37.83 36.65 3hkz s LYS 138 CO 0.32 -0.18 -0.02 0.42 -0.36 0.00 0.00 175.35 175.54 3hkz s ILE 139 N 2.20 3.91 -0.40 5.43 1.01 -0.89 -3.54 121.20 128.91 3hkz s ILE 139 Ca -0.08 -0.34 0.02 0.00 0.00 0.00 0.00 60.65 60.25 3hkz s ILE 139 Cb -0.08 -2.74 0.12 0.00 0.01 0.00 0.00 42.46 39.76 3hkz s ILE 139 CO -0.19 0.46 0.17 -0.55 0.00 0.00 0.00 174.94 174.83 3hkz s SER 140 N 0.74 4.01 0.10 3.58 0.15 0.39 -2.70 113.70 119.97 3hkz s SER 140 Ca -0.01 -2.34 0.02 0.00 0.70 0.00 0.00 55.95 54.32 3hkz s SER 140 Cb -0.14 -1.16 -0.04 0.00 -1.71 0.00 0.00 66.02 62.97 3hkz s SER 140 CO 0.02 -0.32 -0.07 -1.48 1.20 0.00 0.00 173.24 172.59 3hkz s LEU 141 N 0.69 2.49 -0.16 3.45 0.05 -0.93 -1.45 118.68 122.82 3hkz s LEU 141 Ca 0.14 -0.97 -0.05 0.00 0.05 0.00 0.00 54.13 53.31 3hkz s LEU 141 Cb -0.22 -0.10 0.06 0.00 -2.05 0.00 0.00 46.19 43.88 3hkz s LEU 141 CO -0.08 -0.43 0.10 -0.70 -0.55 0.00 0.00 176.35 174.69 3hkz s GLU 142 N -3.63 0.06 0.00 1.48 2.12 -0.54 -2.72 118.70 115.47 3hkz s GLU 142 Ca 0.10 0.00 0.00 0.00 0.36 0.00 0.00 54.97 55.44 3hkz s GLU 142 Cb 0.04 -1.61 0.00 0.00 0.26 0.00 0.00 34.13 32.82 3hkz s GLU 142 CO -0.04 -0.63 0.00 0.00 -0.54 0.00 0.00 175.26 174.05 3hkz n ALA 143 N 5.29 0.00 -3.52 6.30 0.00 -0.17 0.59 120.51 129.00 3hkz n ALA 143 Ca -0.06 0.00 -0.10 0.00 0.00 0.00 0.00 53.44 53.27 3hkz n ALA 143 Cb 0.49 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.91 3hkz n ALA 143 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 3hkz s ARG 144 N 0.14 0.80 -0.00 0.00 3.52 0.14 -4.15 118.95 119.39 3hkz s ARG 144 Ca 0.00 -0.12 -0.02 0.00 -0.13 0.00 0.00 55.73 55.46 3hkz s ARG 144 Cb 0.00 0.37 -0.00 0.00 -1.56 0.00 0.00 34.95 33.76 3hkz s ARG 144 CO 0.00 -0.32 0.03 -0.51 -0.81 0.00 0.00 175.30 173.70 3hkz s LEU 145 N -1.95 1.94 0.22 -0.88 1.02 -1.26 -1.70 118.68 116.06 3hkz s LEU 145 Ca 0.01 -0.16 0.00 0.00 0.02 0.00 0.00 54.13 54.00 3hkz s LEU 145 Cb -0.01 0.21 -0.04 0.00 0.02 0.00 0.00 46.19 46.37 3hkz s LEU 145 CO -0.04 -0.16 0.15 0.00 0.02 0.00 0.00 176.35 176.32 3hkz s ARG 146 N -0.69 1.27 0.70 1.70 1.70 -0.61 -2.85 118.95 120.18 3hkz s ARG 146 Ca -0.08 -1.68 -0.11 0.00 -0.47 0.00 0.00 55.73 53.40 3hkz s ARG 146 Cb -0.05 0.28 0.01 0.00 -0.57 0.00 0.00 34.95 34.62 3hkz s ARG 146 CO -0.00 -0.43 1.06 -0.51 -1.08 0.00 0.00 175.30 174.35 3hkz s LEU 147 N -3.19 3.12 -0.03 -1.89 1.43 -1.26 -1.87 118.68 114.99 3hkz s LEU 147 Ca 0.39 1.64 -0.29 0.00 -1.03 0.00 0.00 54.13 54.84 3hkz s LEU 147 Cb 0.06 -4.49 0.08 0.00 0.03 0.00 0.00 46.19 41.87 3hkz s LEU 147 CO 0.14 -1.51 0.74 -0.83 0.23 0.00 0.00 176.35 175.12 3hkz s GLY 148 N -3.75 -0.52 0.27 -3.19 0.00 -0.66 -4.70 107.32 94.77 3hkz s GLY 148 Ca 0.58 1.27 -0.08 0.00 0.00 0.00 0.00 44.72 46.49 3hkz s GLY 148 CO 0.55 0.76 0.58 -0.19 0.00 0.00 0.00 173.10 174.80 3hkz s TYR 149 N -1.84 3.45 0.00 1.90 1.51 -1.26 -1.67 117.35 119.44 3hkz s TYR 149 Ca -0.06 0.82 0.00 0.00 -1.01 0.00 0.00 57.07 56.83 3hkz s TYR 149 Cb -0.00 -2.23 0.00 0.00 -0.11 0.00 0.00 41.96 39.61 3hkz s TYR 149 CO 0.02 0.19 0.80 0.41 -1.11 0.00 0.00 175.55 175.87 3hkz n GLY 150 N -0.54 -3.35 0.42 0.71 0.00 0.36 -1.71 105.19 101.07 3hkz n GLY 150 Ca 0.00 0.66 0.23 0.00 0.00 0.00 0.00 46.02 46.91 3hkz n GLY 150 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 3hkz h LYS 151 N 0.00 0.32 0.00 1.61 1.63 -1.76 -3.04 116.57 115.32 3hkz h LYS 151 Ca 0.00 -0.02 0.00 0.00 -0.85 0.00 0.00 60.65 59.78 3hkz h LYS 151 Cb 0.00 -0.07 0.00 0.00 -0.60 0.00 0.00 32.23 31.56 3hkz h LYS 151 CO 0.00 0.21 0.00 -1.91 -3.45 0.00 0.00 179.45 174.30 3hkz n GLU 152 N -4.50 0.00 -1.99 1.90 2.13 -0.70 -4.31 120.64 113.17 3hkz n GLU 152 Ca 0.22 0.20 0.01 0.00 0.66 0.00 0.00 57.16 58.25 3hkz n GLU 152 Cb 0.84 -0.59 0.04 0.00 0.27 0.00 0.00 31.44 32.01 3hkz n GLU 152 CO 0.00 0.00 0.00 0.72 -0.41 0.00 0.00 177.13 177.44 3hkz n HIS 153 N -0.45 0.62 0.00 4.31 8.25 -1.25 -5.04 115.22 121.67 3hkz n HIS 153 Ca 0.00 -1.29 0.00 0.00 -0.26 0.00 0.00 57.72 56.17 3hkz n HIS 153 Cb 0.00 -0.20 0.00 0.00 1.12 0.00 0.00 29.99 30.91 3hkz n HIS 153 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3hkz n ALA 154 N -0.09 0.00 0.69 -1.41 0.00 -1.15 -4.41 120.51 114.15 3hkz n ALA 154 Ca 0.09 0.00 0.13 0.00 0.00 0.00 0.00 53.44 53.66 3hkz n ALA 154 Cb 0.98 0.00 0.33 0.00 0.00 0.00 0.00 19.45 20.76 3hkz n ALA 154 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.50 177.86 3hkz n LYS 155 N -0.59 0.21 0.00 0.00 -0.00 -1.26 -3.47 118.16 113.05 3hkz n LYS 155 Ca 0.00 0.12 0.14 0.00 -0.00 0.00 0.00 58.31 58.57 3hkz n LYS 155 Cb 0.00 -1.69 0.57 0.00 -0.00 0.00 0.00 35.03 33.91 3hkz n LYS 155 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.40 178.59 3hkz n PHE 156 N -2.03 0.00 -1.70 5.58 0.99 -1.26 -4.89 117.46 114.14 3hkz n PHE 156 Ca 0.05 0.00 -0.44 0.00 -0.00 0.00 0.00 57.45 57.06 3hkz n PHE 156 Cb 0.41 -0.16 -0.03 0.00 -1.00 0.00 0.00 39.48 38.70 3hkz n PHE 156 CO 0.00 0.00 0.00 -0.89 -0.00 0.00 0.00 176.76 175.87 3hkz n ILE 157 N -0.86 0.61 0.21 4.37 5.41 -1.23 -3.83 119.36 124.04 3hkz n ILE 157 Ca 0.14 -0.15 0.12 0.00 1.00 0.00 0.00 62.75 63.86 3hkz n ILE 157 Cb 0.29 -1.74 0.02 0.00 -0.71 0.00 0.00 39.64 37.50 3hkz n ILE 157 CO 0.00 0.00 0.00 -0.81 0.00 0.00 0.00 176.55 175.74 3hkz n PRO 158 N 2.70 0.53 -3.98 0.38 -0.04 -1.26 -4.97 135.00 128.36 3hkz n PRO 158 Ca 0.12 0.10 -0.13 0.00 -0.04 0.00 0.00 63.50 63.55 3hkz n PRO 158 Cb 0.33 -1.78 -0.14 0.00 -0.04 0.00 0.00 33.50 31.87 3hkz n PRO 158 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 3hkz s VAL 159 N -3.33 0.15 -0.37 0.52 0.11 -1.26 -2.92 120.40 113.30 3hkz s VAL 159 Ca 0.01 -0.08 0.07 0.00 -2.93 0.00 0.00 61.98 59.04 3hkz s VAL 159 Cb 0.11 -0.14 0.65 0.00 -1.53 0.00 0.00 36.38 35.47 3hkz s VAL 159 CO 0.78 0.04 1.76 -1.54 -3.33 0.00 0.00 175.10 172.81 3hkz n SER 160 N 3.05 4.24 -3.59 3.54 3.41 -0.89 -4.86 113.62 118.51 3hkz n SER 160 Ca -0.12 -3.23 -0.06 0.00 -0.26 0.00 0.00 58.87 55.19 3hkz n SER 160 Cb 0.59 -0.76 -0.04 0.00 -0.26 0.00 0.00 64.21 63.75 3hkz n SER 160 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 3hkz s LEU 161 N -2.79 -0.22 0.00 1.04 2.96 -1.25 -4.88 118.68 113.54 3hkz s LEU 161 Ca 0.50 0.16 0.00 0.00 -0.22 0.00 0.00 54.13 54.57 3hkz s LEU 161 Cb 0.41 1.55 0.00 0.00 0.50 0.00 0.00 46.19 48.65 3hkz s LEU 161 CO 0.11 -0.26 0.35 -1.20 -1.32 0.00 0.00 176.35 174.03 3hkz n SER 162 N 0.36 -0.34 -4.67 3.68 7.64 -1.16 -3.99 113.62 115.14 3hkz n SER 162 Ca -0.05 -0.70 -0.46 0.00 1.01 0.00 0.00 58.87 58.67 3hkz n SER 162 Cb 0.59 0.10 -0.04 0.00 -1.01 0.00 0.00 64.21 63.85 3hkz n SER 162 CO 0.00 0.00 0.00 0.52 -3.01 0.00 0.00 175.04 172.55 3hkz n VAL 163 N 0.00 0.05 -3.97 0.44 0.31 -1.22 -4.75 118.33 109.19 3hkz n VAL 163 Ca -0.10 -0.01 -0.34 0.00 -0.01 0.00 0.00 64.34 63.89 3hkz n VAL 163 Cb 0.40 -1.53 -0.14 0.00 -0.91 0.00 0.00 33.84 31.65 3hkz n VAL 163 CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 3hkz s VAL 164 N 1.15 2.72 0.09 2.52 1.01 -1.26 -2.54 120.40 124.09 3hkz s VAL 164 Ca 0.80 -1.39 0.08 0.00 0.00 0.00 0.00 61.98 61.48 3hkz s VAL 164 Cb -0.69 -2.53 -0.03 0.00 0.00 0.00 0.00 36.38 33.12 3hkz s VAL 164 CO 0.39 -0.02 -0.22 0.00 0.00 0.00 0.00 175.10 175.25 3hkz s ARG 165 N 1.22 1.24 0.40 2.72 1.04 -1.08 -4.99 118.95 119.50 3hkz s ARG 165 Ca -0.05 -1.13 -0.26 0.00 -1.04 0.00 0.00 55.73 53.24 3hkz s ARG 165 Cb -0.19 -1.50 -0.09 0.00 -2.04 0.00 0.00 34.95 31.13 3hkz s ARG 165 CO -0.03 0.36 1.34 0.71 -0.04 0.00 0.00 175.30 177.64 3hkz s TYR 166 N -1.06 2.78 0.10 5.89 2.02 -1.26 -1.99 117.35 123.84 3hkz s TYR 166 Ca 0.08 1.37 -0.30 0.00 -0.37 0.00 0.00 57.07 57.84 3hkz s TYR 166 Cb -0.10 -3.74 -0.06 0.00 -0.40 0.00 0.00 41.96 37.66 3hkz s TYR 166 CO 0.04 -2.26 1.05 -0.47 -1.57 0.00 0.00 175.55 172.34 3hkz s TYR 167 N -1.22 3.66 0.23 2.71 5.04 -0.84 -4.83 117.35 122.09 3hkz s TYR 167 Ca 0.56 1.64 0.05 0.00 -2.44 0.00 0.00 57.07 56.88 3hkz s TYR 167 Cb -0.40 -3.19 -0.03 0.00 0.35 0.00 0.00 41.96 38.69 3hkz s TYR 167 CO 0.52 -0.32 0.28 -1.25 -1.34 0.00 0.00 175.55 173.44 3hkz s PRO 168 N 0.23 3.24 -0.26 4.97 0.04 -1.26 -2.46 135.00 139.49 3hkz s PRO 168 Ca 0.50 -0.84 0.00 0.00 0.04 0.00 0.00 61.00 60.71 3hkz s PRO 168 Cb -0.26 -2.78 0.05 0.00 0.04 0.00 0.00 34.50 31.55 3hkz s PRO 168 CO 0.31 0.44 -0.07 0.15 0.04 0.00 0.00 177.00 177.86 3hkz s LYS 169 N -3.78 2.47 -0.35 4.56 -0.14 0.42 -4.77 119.74 118.15 3hkz s LYS 169 Ca 0.33 -1.21 -0.06 0.00 -1.36 0.00 0.00 55.97 53.68 3hkz s LYS 169 Cb -0.09 -2.98 0.06 0.00 -1.68 0.00 0.00 37.83 33.14 3hkz s LYS 169 CO 0.27 -0.53 0.12 0.08 -0.76 0.00 0.00 175.35 174.54 3hkz s VAL 170 N 1.21 3.67 0.29 3.17 1.01 -1.26 -2.74 120.40 125.75 3hkz s VAL 170 Ca -0.05 -1.32 0.08 0.00 0.00 0.00 0.00 61.98 60.69 3hkz s VAL 170 Cb -0.19 -3.16 -0.03 0.00 0.00 0.00 0.00 36.38 33.00 3hkz s VAL 170 CO -0.04 -0.28 0.20 -1.61 0.00 0.00 0.00 175.10 173.37 3hkz s GLU 171 N 1.35 2.73 -0.06 2.72 2.02 -1.06 -5.03 118.70 121.37 3hkz s GLU 171 Ca -0.00 -1.22 0.06 0.00 0.02 0.00 0.00 54.97 53.82 3hkz s GLU 171 Cb -0.20 -2.45 -0.01 0.00 0.10 0.00 0.00 34.13 31.57 3hkz s GLU 171 CO 0.01 0.28 -0.24 0.42 0.02 0.00 0.00 175.26 175.74 3hkz s ILE 172 N -2.24 2.02 0.00 -1.63 1.09 -1.26 -3.61 121.20 115.57 3hkz s ILE 172 Ca 0.36 -1.04 0.00 0.00 -1.10 0.00 0.00 60.65 58.87 3hkz s ILE 172 Cb -0.07 -1.72 0.00 0.00 -1.06 0.00 0.00 42.46 39.62 3hkz s ILE 172 CO 0.25 0.56 0.16 0.18 -0.10 0.00 0.00 174.94 175.98 3hkz n LEU 173 N 3.05 0.32 -3.66 2.97 4.77 -0.14 -5.00 117.00 119.31 3hkz n LEU 173 Ca -0.18 -0.52 -0.05 0.00 -0.03 0.00 0.00 56.01 55.23 3hkz n LEU 173 Cb 0.52 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.60 3hkz n LEU 173 CO 0.26 0.08 0.72 0.00 -1.33 0.00 0.00 177.39 177.12 3hkz s ALA 174 N -0.40 -1.74 -0.43 -1.18 0.00 -1.25 -5.05 121.76 111.70 3hkz s ALA 174 Ca 0.00 0.48 -0.26 0.00 0.00 0.00 0.00 51.96 52.18 3hkz s ALA 174 Cb 0.00 0.54 0.02 0.00 0.00 0.00 0.00 23.12 23.69 3hkz s ALA 174 CO 0.00 -0.91 0.97 1.21 0.00 0.00 0.00 175.76 177.03 3hkz s ASN 175 N -2.77 6.59 -0.24 0.00 2.47 -1.26 -4.98 114.94 114.75 3hkz s ASN 175 Ca 0.10 0.34 -0.03 0.00 0.42 0.00 0.00 52.86 53.69 3hkz s ASN 175 Cb -0.01 -2.47 0.01 0.00 -1.45 0.00 0.00 41.25 37.33 3hkz s ASN 175 CO -0.02 -1.02 -0.05 0.00 -3.72 0.00 0.00 177.10 172.28 3hkz n GLU 177 N 4.73 0.00 0.15 0.00 -0.58 -1.26 -3.64 120.64 120.05 3hkz n GLU 177 Ca -0.17 0.39 0.13 0.00 -0.42 0.00 0.00 57.16 57.09 3hkz n GLU 177 Cb 0.49 -1.25 0.52 0.00 -0.57 0.00 0.00 31.44 30.62 3hkz n GLU 177 CO 0.00 0.00 0.00 0.87 -0.48 0.00 0.00 177.13 177.52 3hkz h LYS 178 N 0.00 0.00 -1.15 3.49 1.57 -1.97 -3.31 116.57 115.20 3hkz h LYS 178 Ca 0.00 0.00 0.36 0.00 -1.87 0.00 0.00 60.65 59.14 3hkz h LYS 178 Cb 0.00 0.00 -0.07 0.00 0.08 0.00 0.00 32.23 32.24 3hkz h LYS 178 CO 0.00 0.00 0.79 0.00 -0.57 0.00 0.00 179.45 179.67 3hkz n ALA 179 N -1.81 1.11 -0.03 3.86 0.00 -1.24 0.68 120.51 123.08 3hkz n ALA 179 Ca 0.02 0.51 -0.15 0.00 0.00 0.00 0.00 53.44 53.82 3hkz n ALA 179 Cb 0.24 -0.74 -0.10 0.00 0.00 0.00 0.00 19.45 18.85 3hkz n ALA 179 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 3hkz h VAL 180 N 0.00 1.44 0.01 0.00 2.07 -1.83 -3.26 116.25 114.67 3hkz h VAL 180 Ca 0.62 -1.71 -0.19 0.00 0.82 0.00 0.00 66.70 66.23 3hkz h VAL 180 Cb 2.26 2.37 -0.02 0.00 -1.52 0.00 0.00 31.29 34.37 3hkz h VAL 180 CO -0.15 0.49 -0.89 0.78 0.02 0.00 0.00 177.57 177.82 3hkz h ASN 181 N -0.22 0.06 0.47 0.57 2.35 -0.04 -3.34 115.58 115.43 3hkz h ASN 181 Ca -0.02 -0.05 -0.23 0.00 -0.55 0.00 0.00 56.30 55.45 3hkz h ASN 181 Cb 0.94 -0.02 -0.00 0.00 0.05 0.00 0.00 38.32 39.29 3hkz h ASN 181 CO 0.06 0.92 -0.99 -0.37 -1.65 0.00 0.00 177.43 175.40 3hkz h VAL 182 N 0.02 1.45 -3.27 2.81 -1.51 -1.54 -3.43 116.25 110.79 3hkz h VAL 182 Ca -0.02 -2.64 -0.59 0.00 -1.23 0.00 0.00 66.70 62.22 3hkz h VAL 182 Cb 1.56 2.55 -0.08 0.00 -2.13 0.00 0.00 31.29 33.19 3hkz h VAL 182 CO 0.12 0.78 0.50 0.00 -1.23 0.00 0.00 177.57 177.73 3hkz n PRO 184 N 5.99 4.02 0.00 0.00 -0.04 -1.26 -4.08 135.00 139.64 3hkz n PRO 184 Ca 0.06 -2.46 0.09 0.00 -0.04 0.00 0.00 63.50 61.14 3hkz n PRO 184 Cb 0.47 -2.09 -0.01 0.00 -0.04 0.00 0.00 33.50 31.84 3hkz n PRO 184 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 3hkz n GLU 185 N 0.51 1.55 -2.87 0.54 -0.58 -1.26 -5.01 120.64 113.53 3hkz n GLU 185 Ca 0.22 -0.82 -0.12 0.00 -0.42 0.00 0.00 57.16 56.02 3hkz n GLU 185 Cb 0.98 -1.33 0.06 0.00 -0.57 0.00 0.00 31.44 30.58 3hkz n GLU 185 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3hkz n GLY 186 N 1.23 -0.61 0.38 0.62 0.00 -1.26 -4.84 105.19 100.71 3hkz n GLY 186 Ca 0.07 0.33 -0.18 0.00 0.00 0.00 0.00 46.02 46.24 3hkz n GLY 186 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3hkz n VAL 187 N -2.89 1.18 -3.04 1.61 0.31 -1.26 -4.27 118.33 109.96 3hkz n VAL 187 Ca -0.07 -0.16 -0.41 0.00 -0.01 0.00 0.00 64.34 63.68 3hkz n VAL 187 Cb 0.60 -1.86 -0.06 0.00 -0.91 0.00 0.00 33.84 31.61 3hkz n VAL 187 CO 0.00 0.00 0.00 -0.36 -1.32 0.00 0.00 176.83 175.15 3hkz s PHE 188 N -2.43 3.25 -0.29 3.52 0.40 -1.26 -1.83 117.98 119.33 3hkz s PHE 188 Ca -0.26 0.80 -0.03 0.00 -0.60 0.00 0.00 56.93 56.83 3hkz s PHE 188 Cb 0.09 -3.00 0.03 0.00 0.51 0.00 0.00 43.02 40.65 3hkz s PHE 188 CO 0.34 -0.43 0.01 -2.00 0.70 0.00 0.00 175.22 173.84 3hkz s GLU 189 N 2.69 2.69 -0.22 0.44 2.12 -1.09 -4.75 118.70 120.58 3hkz s GLU 189 Ca 0.29 -1.10 -0.15 0.00 0.36 0.00 0.00 54.97 54.37 3hkz s GLU 189 Cb -0.15 -3.21 -0.04 0.00 0.26 0.00 0.00 34.13 30.99 3hkz s GLU 189 CO 0.10 -0.53 0.35 -0.51 -0.54 0.00 0.00 175.26 174.13 3hkz s LEU 190 N 1.34 4.13 -1.04 2.70 1.43 -1.25 -3.73 118.68 122.26 3hkz s LEU 190 Ca -0.02 0.40 -0.03 0.00 -1.03 0.00 0.00 54.13 53.46 3hkz s LEU 190 Cb -0.18 -2.42 0.25 0.00 0.03 0.00 0.00 46.19 43.86 3hkz s LEU 190 CO -0.01 -0.07 2.09 0.29 0.23 0.00 0.00 176.35 178.89 3hkz n LYS 191 N 4.58 4.61 -2.65 1.70 5.02 -1.24 -4.78 118.16 125.39 3hkz n LYS 191 Ca -0.10 -3.98 -0.01 0.00 -2.02 0.00 0.00 58.31 52.20 3hkz n LYS 191 Cb 0.51 -2.46 0.00 0.00 -0.02 0.00 0.00 35.03 33.06 3hkz n LYS 191 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 3hkz n ASP 192 N 0.46 -6.37 -0.25 4.39 2.03 -1.26 -4.46 116.55 111.09 3hkz n ASP 192 Ca 0.53 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.84 3hkz n ASP 192 Cb 0.28 -4.25 0.00 0.00 -0.72 0.00 0.00 41.12 36.43 3hkz n ASP 192 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 3hkz n GLY 193 N -1.43 0.79 2.73 0.27 0.00 -1.26 -5.07 105.19 101.22 3hkz n GLY 193 Ca 0.01 -0.68 -0.30 0.00 0.00 0.00 0.00 46.02 45.05 3hkz n GLY 193 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3hkz s LYS 194 N -4.09 0.79 0.00 1.61 1.02 -1.26 -5.02 119.74 112.79 3hkz s LYS 194 Ca 0.00 -1.21 0.00 0.00 0.02 0.00 0.00 55.97 54.78 3hkz s LYS 194 Cb 0.00 -2.05 0.00 0.00 -0.52 0.00 0.00 37.83 35.26 3hkz s LYS 194 CO 0.00 -1.01 0.55 1.28 -0.92 0.00 0.00 175.35 175.25 3hkz n LEU 195 N 4.67 1.28 -4.42 3.17 4.77 -1.26 -3.59 117.00 121.61 3hkz n LEU 195 Ca -0.00 -0.64 -0.36 0.00 -0.03 0.00 0.00 56.01 54.98 3hkz n LEU 195 Cb 0.41 -0.46 0.07 0.00 -2.33 0.00 0.00 43.42 41.12 3hkz n LEU 195 CO 0.13 0.27 -0.06 -1.54 -1.33 0.00 0.00 177.39 174.86 3hkz n SER 196 N 0.14 -1.71 -4.24 -1.43 3.41 -1.24 -4.71 113.62 103.84 3hkz n SER 196 Ca 0.00 0.52 -0.42 0.00 -0.26 0.00 0.00 58.87 58.71 3hkz n SER 196 Cb 0.27 -1.18 -0.08 0.00 -0.26 0.00 0.00 64.21 62.97 3hkz n SER 196 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 3hkz s VAL 197 N -2.01 4.45 0.18 -3.33 1.01 -1.26 -2.68 120.40 116.75 3hkz s VAL 197 Ca 0.62 -1.69 -0.06 0.00 0.00 0.00 0.00 61.98 60.86 3hkz s VAL 197 Cb -0.32 -3.89 -0.04 0.00 0.00 0.00 0.00 36.38 32.12 3hkz s VAL 197 CO 0.61 -0.77 1.50 0.50 0.00 0.00 0.00 175.10 176.94 3hkz h LYS 198 N 8.55 0.71 -3.50 2.72 3.64 -1.70 -3.39 116.57 123.60 3hkz h LYS 198 Ca -0.23 -0.40 -0.60 0.00 -1.27 0.00 0.00 60.65 58.15 3hkz h LYS 198 Cb 1.08 0.03 -0.40 0.00 -0.41 0.00 0.00 32.23 32.53 3hkz h LYS 198 CO 0.89 1.02 -0.75 -0.80 -2.27 0.00 0.00 179.45 177.55 3hkz s ASN 199 N -6.89 3.98 0.10 4.20 0.01 -1.20 -4.95 114.94 110.20 3hkz s ASN 199 Ca -0.09 -1.92 0.02 0.00 -0.71 0.00 0.00 52.86 50.16 3hkz s ASN 199 Cb 0.11 -0.96 -0.24 0.00 0.41 0.00 0.00 41.25 40.57 3hkz s ASN 199 CO 0.86 -0.38 1.20 -0.08 -1.51 0.00 0.00 177.10 177.19 3hkz h GLU 200 N 7.71 0.12 0.00 -0.60 4.81 -1.88 -3.29 114.58 121.46 3hkz h GLU 200 Ca -0.09 -0.21 0.00 0.00 -0.13 0.00 0.00 59.36 58.92 3hkz h GLU 200 Cb 0.99 0.08 0.00 0.00 0.63 0.00 0.00 28.75 30.45 3hkz h GLU 200 CO 0.47 1.09 0.00 1.28 -0.73 0.00 0.00 179.01 181.13 3hkz n LEU 201 N -3.43 0.00 -0.08 1.64 4.77 -1.26 -3.66 117.00 114.98 3hkz n LEU 201 Ca -0.04 0.01 -0.08 0.00 -0.03 0.00 0.00 56.01 55.87 3hkz n LEU 201 Cb 0.98 -0.01 -0.03 0.00 -2.33 0.00 0.00 43.42 42.03 3hkz n LEU 201 CO 0.50 -0.01 -0.58 -1.20 -1.33 0.00 0.00 177.39 174.77 3hkz n SER 202 N -1.01 1.90 -4.38 -1.43 7.64 -1.24 -5.03 113.62 110.06 3hkz n SER 202 Ca 0.09 0.43 -0.40 0.00 1.01 0.00 0.00 58.87 60.00 3hkz n SER 202 Cb 0.04 -0.79 0.01 0.00 -1.01 0.00 0.00 64.21 62.47 3hkz n SER 202 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3hkz s THR 204 N -1.70 -0.70 0.00 0.00 -4.23 -1.26 -4.56 115.64 103.19 3hkz s THR 204 Ca 0.63 0.00 0.00 0.00 -1.18 0.00 0.00 61.69 61.14 3hkz s THR 204 Cb -0.54 -1.00 0.00 0.00 1.34 0.00 0.00 72.50 72.30 3hkz s THR 204 CO 0.60 0.00 0.00 -0.11 -0.54 0.00 0.00 174.62 174.57 3hkz n LEU 205 N 5.10 0.00 0.00 4.79 7.94 -1.26 -4.65 117.00 128.93 3hkz n LEU 205 Ca -0.14 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.76 3hkz n LEU 205 Cb 0.52 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.47 3hkz n LEU 205 CO -0.03 0.00 0.00 0.00 -1.11 0.00 0.00 177.39 176.25 3hkz n GLU 207 N 0.00 0.00 -0.11 0.00 1.02 -1.26 -4.95 120.64 115.34 3hkz n GLU 207 Ca 0.00 0.09 -0.03 0.00 -0.02 0.00 0.00 57.16 57.20 3hkz n GLU 207 Cb 0.00 -2.48 0.20 0.00 -0.02 0.00 0.00 31.44 29.15 3hkz n GLU 207 CO 0.00 0.00 0.00 0.93 1.18 0.00 0.00 177.13 179.24 3hkz h GLU 208 N 1.31 0.79 -0.36 3.49 4.39 -1.93 -2.33 114.58 119.93 3hkz h GLU 208 Ca 0.00 -0.16 0.00 0.00 0.34 0.00 0.00 59.36 59.54 3hkz h GLU 208 Cb 0.00 -0.12 -0.02 0.00 -0.10 0.00 0.00 28.75 28.52 3hkz h GLU 208 CO 0.00 0.73 0.23 0.00 -1.16 0.00 0.00 179.01 178.80 3hkz h LEU 210 N 0.48 0.94 -2.03 0.00 3.38 -1.79 0.68 115.31 116.97 3hkz h LEU 210 Ca 0.13 0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.12 3hkz h LEU 210 Cb -0.02 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 40.54 3hkz h LEU 210 CO -0.03 0.58 0.00 -0.09 0.09 0.00 0.00 178.44 178.99 3hkz h ARG 211 N 1.05 0.00 0.00 1.13 2.43 -1.08 -3.16 114.38 114.75 3hkz h ARG 211 Ca 0.43 0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 59.57 3hkz h ARG 211 Cb 0.27 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 29.81 3hkz h ARG 211 CO -0.18 0.00 -1.17 0.66 -1.51 0.00 0.00 179.97 177.77 3hkz n TYR 212 N -2.64 0.00 -0.57 2.20 4.02 0.34 -4.77 117.16 115.75 3hkz n TYR 212 Ca -0.02 0.00 0.10 0.00 -0.01 0.00 0.00 57.90 57.97 3hkz n TYR 212 Cb 0.07 -0.10 0.34 0.00 -0.02 0.00 0.00 39.34 39.63 3hkz n TYR 212 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 3hkz n ASN 214 N 1.15 -4.80 -1.19 0.00 4.05 -1.24 -0.19 115.26 113.03 3hkz n ASN 214 Ca 0.25 0.19 -0.11 0.00 0.45 0.00 0.00 54.58 55.36 3hkz n ASN 214 Cb 0.82 -4.12 -0.01 0.00 1.23 0.00 0.00 39.78 37.70 3hkz n ASN 214 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 3hkz n GLY 215 N -0.73 0.08 0.05 8.20 0.00 -1.26 -4.91 105.19 106.62 3hkz n GLY 215 Ca -0.19 -0.44 0.13 0.00 0.00 0.00 0.00 46.02 45.52 3hkz n GLY 215 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3hkz n SER 216 N -0.04 0.42 -4.16 1.61 7.64 0.74 -4.51 113.62 115.32 3hkz n SER 216 Ca -0.13 0.51 -0.34 0.00 1.01 0.00 0.00 58.87 59.93 3hkz n SER 216 Cb 0.57 -0.61 -0.15 0.00 -1.01 0.00 0.00 64.21 63.01 3hkz n SER 216 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 3hkz s ILE 217 N -3.05 2.56 -0.14 0.44 1.01 -1.26 -0.96 121.20 119.80 3hkz s ILE 217 Ca 0.12 -1.14 -0.17 0.00 0.00 0.00 0.00 60.65 59.47 3hkz s ILE 217 Cb 0.16 -2.30 -0.04 0.00 0.01 0.00 0.00 42.46 40.28 3hkz s ILE 217 CO 0.57 0.22 0.43 -0.60 0.00 0.00 0.00 174.94 175.56 3hkz s ARG 218 N 1.27 4.30 -0.42 2.79 3.52 -1.24 -4.85 118.95 124.32 3hkz s ARG 218 Ca -0.01 0.34 0.03 0.00 -0.13 0.00 0.00 55.73 55.96 3hkz s ARG 218 Cb -0.17 -3.45 0.12 0.00 -1.56 0.00 0.00 34.95 29.89 3hkz s ARG 218 CO -0.06 0.14 0.18 0.42 -0.81 0.00 0.00 175.30 175.16 3hkz s ILE 219 N 0.72 1.89 0.43 4.11 1.01 -1.26 -2.55 121.20 125.55 3hkz s ILE 219 Ca 0.23 -2.56 0.08 0.00 0.00 0.00 0.00 60.65 58.39 3hkz s ILE 219 Cb -0.15 -2.35 0.00 0.00 0.01 0.00 0.00 42.46 39.98 3hkz s ILE 219 CO 0.08 -0.76 0.50 -0.94 0.00 0.00 0.00 174.94 173.82 3hkz s SER 220 N 0.48 5.35 -0.13 3.58 1.04 -1.11 -4.93 113.70 117.98 3hkz s SER 220 Ca 0.15 -0.60 0.00 0.00 0.48 0.00 0.00 55.95 55.98 3hkz s SER 220 Cb -0.23 -0.54 -0.01 0.00 0.10 0.00 0.00 66.02 65.35 3hkz s SER 220 CO -0.06 -0.76 -0.14 -0.36 0.98 0.00 0.00 173.24 172.90 3hkz s PHE 221 N -2.43 2.80 0.11 5.02 0.40 -1.26 -0.44 117.98 122.18 3hkz s PHE 221 Ca 0.52 -0.73 -0.31 0.00 -0.60 0.00 0.00 56.93 55.81 3hkz s PHE 221 Cb -0.07 -1.85 -0.10 0.00 0.51 0.00 0.00 43.02 41.52 3hkz s PHE 221 CO 0.31 -0.27 1.72 0.08 0.70 0.00 0.00 175.22 177.75 3hkz s VAL 222 N 0.45 2.71 -0.33 -0.44 1.01 -1.03 -4.84 120.40 117.93 3hkz s VAL 222 Ca -0.10 0.28 -0.31 0.00 0.00 0.00 0.00 61.98 61.84 3hkz s VAL 222 Cb -0.16 -3.18 -0.08 0.00 0.00 0.00 0.00 36.38 32.96 3hkz s VAL 222 CO 0.05 0.00 2.25 -0.62 0.00 0.00 0.00 175.10 176.78 3hkz n GLU 223 N 5.30 1.41 -2.07 2.72 1.02 -1.26 -2.58 120.64 125.18 3hkz n GLU 223 Ca 0.16 0.35 -0.08 0.00 -0.02 0.00 0.00 57.16 57.57 3hkz n GLU 223 Cb 0.39 -2.88 -0.01 0.00 -0.02 0.00 0.00 31.44 28.93 3hkz n GLU 223 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 3hkz n ASP 224 N 11.37 -3.05 -4.34 1.62 8.00 -1.26 -4.59 116.55 124.30 3hkz n ASP 224 Ca 0.37 0.01 -0.34 0.00 0.71 0.00 0.00 54.79 55.54 3hkz n ASP 224 Cb 0.35 -2.25 -0.14 0.00 -0.02 0.00 0.00 41.12 39.06 3hkz n ASP 224 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 3hkz s LYS 225 N -4.25 3.39 0.08 -1.24 1.02 -1.06 0.02 119.74 117.69 3hkz s LYS 225 Ca 0.00 -0.65 0.03 0.00 0.02 0.00 0.00 55.97 55.38 3hkz s LYS 225 Cb 0.00 -2.84 -0.03 0.00 -0.52 0.00 0.00 37.83 34.43 3hkz s LYS 225 CO 0.00 -0.01 -0.09 0.71 -0.92 0.00 0.00 175.35 175.03 3hkz s TYR 226 N 0.97 0.95 -0.20 3.18 1.51 0.57 -1.99 117.35 122.34 3hkz s TYR 226 Ca -0.01 -0.63 -0.02 0.00 -1.01 0.00 0.00 57.07 55.39 3hkz s TYR 226 Cb -0.15 -0.54 -0.00 0.00 -0.11 0.00 0.00 41.96 41.17 3hkz s TYR 226 CO -0.00 -0.04 -0.09 0.42 -1.11 0.00 0.00 175.55 174.73 3hkz s ILE 227 N -2.23 3.00 0.32 2.71 1.01 -0.84 0.15 121.20 125.32 3hkz s ILE 227 Ca 0.02 -0.62 -0.07 0.00 0.00 0.00 0.00 60.65 59.98 3hkz s ILE 227 Cb -0.04 -2.34 -0.06 0.00 0.01 0.00 0.00 42.46 40.04 3hkz s ILE 227 CO -0.00 0.46 0.62 -0.22 0.00 0.00 0.00 174.94 175.80 3hkz s LEU 228 N 1.33 3.99 -0.35 2.97 2.96 -0.55 -2.63 118.68 126.41 3hkz s LEU 228 Ca 0.04 0.85 0.03 0.00 -0.22 0.00 0.00 54.13 54.82 3hkz s LEU 228 Cb -0.14 -3.68 0.15 0.00 0.50 0.00 0.00 46.19 43.02 3hkz s LEU 228 CO -0.05 -0.26 0.38 -1.61 -1.32 0.00 0.00 176.35 173.50 3hkz s GLU 229 N -3.64 0.56 -0.14 1.98 2.02 -1.05 -2.31 118.70 116.12 3hkz s GLU 229 Ca 0.46 -0.53 -0.13 0.00 0.02 0.00 0.00 54.97 54.79 3hkz s GLU 229 Cb -0.11 -0.59 -0.05 0.00 0.10 0.00 0.00 34.13 33.49 3hkz s GLU 229 CO 0.30 -1.14 0.30 0.42 0.02 0.00 0.00 175.26 175.16 3hkz s ILE 230 N 1.81 5.29 -0.29 -1.63 -1.09 -0.52 -2.96 121.20 121.81 3hkz s ILE 230 Ca 0.14 0.56 -0.03 0.00 -2.23 0.00 0.00 60.65 59.09 3hkz s ILE 230 Cb -0.14 -3.62 0.10 0.00 -1.58 0.00 0.00 42.46 37.22 3hkz s ILE 230 CO -0.14 0.43 0.12 -0.70 -1.23 0.00 0.00 174.94 173.42 3hkz s GLU 231 N 0.14 0.33 0.77 2.79 2.12 -1.26 -0.74 118.70 122.85 3hkz s GLU 231 Ca 0.17 -0.65 -0.14 0.00 0.36 0.00 0.00 54.97 54.72 3hkz s GLU 231 Cb -0.13 -1.42 0.06 0.00 0.26 0.00 0.00 34.13 32.90 3hkz s GLU 231 CO 0.05 -0.99 1.21 0.45 -0.54 0.00 0.00 175.26 175.44 3hkz s SER 232 N 1.97 3.88 0.32 -1.70 0.15 -1.26 -2.09 113.70 114.98 3hkz s SER 232 Ca 0.09 2.35 0.24 0.00 0.70 0.00 0.00 55.95 59.33 3hkz s SER 232 Cb -0.16 -2.59 0.53 0.00 -1.71 0.00 0.00 66.02 62.09 3hkz s SER 232 CO -0.32 -2.47 1.65 -0.37 1.20 0.00 0.00 173.24 172.93 3hkz h VAL 233 N -0.63 0.00 0.00 4.45 -1.51 -1.86 -3.43 116.25 113.27 3hkz h VAL 233 Ca -0.47 -0.76 0.00 0.00 -1.23 0.00 0.00 66.70 64.24 3hkz h VAL 233 Cb 1.30 1.73 0.00 0.00 -2.13 0.00 0.00 31.29 32.19 3hkz h VAL 233 CO 0.48 0.00 0.00 0.61 -1.23 0.00 0.00 177.57 177.43 3hkz n GLY 234 N 1.20 1.61 0.22 5.19 0.00 -1.26 -5.03 105.19 107.12 3hkz n GLY 234 Ca 0.05 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.91 3hkz n GLY 234 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 3hkz h SER 235 N 0.00 -0.41 -2.37 1.61 0.02 -1.82 -3.43 113.55 107.16 3hkz h SER 235 Ca 0.00 0.00 -0.56 0.00 -0.84 0.00 0.00 61.79 60.39 3hkz h SER 235 Cb 0.00 0.11 -0.10 0.00 0.14 0.00 0.00 62.40 62.55 3hkz h SER 235 CO 0.00 -0.28 -0.64 -0.76 -1.14 0.00 0.00 176.83 174.01 3hkz s LEU 236 N -10.09 3.27 0.29 5.07 1.02 -1.26 -2.91 118.68 114.07 3hkz s LEU 236 Ca -0.15 -0.55 -0.29 0.00 0.02 0.00 0.00 54.13 53.16 3hkz s LEU 236 Cb 0.04 -1.82 -0.09 0.00 0.02 0.00 0.00 46.19 44.34 3hkz s LEU 236 CO 0.64 0.02 1.06 -0.54 0.02 0.00 0.00 176.35 177.55 3hkz s LYS 237 N -3.51 4.60 0.07 1.70 1.02 -1.26 -4.84 119.74 117.51 3hkz s LYS 237 Ca 0.30 1.70 -0.14 0.00 0.02 0.00 0.00 55.97 57.85 3hkz s LYS 237 Cb -0.07 -3.09 -0.03 0.00 -0.52 0.00 0.00 37.83 34.11 3hkz s LYS 237 CO 0.20 0.20 1.23 -0.35 -0.92 0.00 0.00 175.35 175.71 3hkz n PRO 238 N 1.02 -0.20 0.16 -1.68 -0.04 -1.26 -1.68 135.00 131.31 3hkz n PRO 238 Ca -0.00 1.21 0.06 0.00 -0.04 0.00 0.00 63.50 64.73 3hkz n PRO 238 Cb 0.46 -1.80 0.55 0.00 -0.04 0.00 0.00 33.50 32.67 3hkz n PRO 238 CO 0.00 0.00 0.00 1.05 -0.04 0.00 0.00 175.50 176.51 3hkz h GLU 239 N 0.00 0.22 -1.00 0.54 9.09 -1.94 -1.22 114.58 120.27 3hkz h GLU 239 Ca 0.07 -0.01 0.11 0.00 0.05 0.00 0.00 59.36 59.58 3hkz h GLU 239 Cb 0.19 -0.05 -0.08 0.00 -1.65 0.00 0.00 28.75 27.16 3hkz h GLU 239 CO -0.43 0.15 0.64 -0.09 0.05 0.00 0.00 179.01 179.32 3hkz h ARG 240 N 0.22 1.01 0.27 1.06 9.65 -1.72 0.12 114.38 125.00 3hkz h ARG 240 Ca 0.06 -0.06 -0.01 0.00 -1.10 0.00 0.00 59.98 58.87 3hkz h ARG 240 Cb -0.02 -0.23 0.00 0.00 -1.39 0.00 0.00 29.97 28.33 3hkz h ARG 240 CO -0.01 0.67 -0.13 0.82 2.80 0.00 0.00 179.97 184.12 3hkz h ILE 241 N 1.04 0.76 -0.82 1.20 2.04 -1.18 0.21 117.51 120.76 3hkz h ILE 241 Ca 0.48 -0.25 0.12 0.00 1.00 0.00 0.00 64.86 66.21 3hkz h ILE 241 Cb 0.40 0.91 -0.08 0.00 -0.74 0.00 0.00 36.82 37.30 3hkz h ILE 241 CO -0.24 0.06 0.44 -0.07 0.00 0.00 0.00 178.15 178.33 3hkz h LEU 242 N -0.50 0.57 -0.72 1.44 3.38 -1.35 0.56 115.31 118.69 3hkz h LEU 242 Ca -0.04 0.07 -0.07 0.00 0.09 0.00 0.00 57.88 57.93 3hkz h LEU 242 Cb 0.37 -0.03 -0.03 0.00 0.09 0.00 0.00 40.66 41.07 3hkz h LEU 242 CO 0.06 0.29 0.16 0.25 0.09 0.00 0.00 178.44 179.28 3hkz h LEU 243 N 0.68 1.07 0.01 1.67 5.85 -0.56 -1.40 115.31 122.64 3hkz h LEU 243 Ca 0.43 -0.24 -0.00 0.00 0.84 0.00 0.00 57.88 58.91 3hkz h LEU 243 Cb 0.52 -0.28 0.00 0.00 0.37 0.00 0.00 40.66 41.26 3hkz h LEU 243 CO -0.31 1.04 -0.01 -0.33 -0.34 0.00 0.00 178.44 178.49 3hkz h GLU 244 N 1.07 -0.02 -0.84 1.25 4.39 0.56 -2.80 114.58 118.19 3hkz h GLU 244 Ca 0.22 0.00 0.15 0.00 0.34 0.00 0.00 59.36 60.07 3hkz h GLU 244 Cb 0.39 0.00 -0.15 0.00 -0.10 0.00 0.00 28.75 28.89 3hkz h GLU 244 CO 0.01 0.61 -0.30 0.00 -1.16 0.00 0.00 179.01 178.16 3hkz h ALA 245 N 0.30 0.28 -0.32 3.43 0.00 0.03 0.15 119.26 123.12 3hkz h ALA 245 Ca -0.00 0.27 0.07 0.00 0.00 0.00 0.00 54.91 55.25 3hkz h ALA 245 Cb 0.64 0.81 -0.08 0.00 0.00 0.00 0.00 17.79 19.15 3hkz h ALA 245 CO 0.00 -0.54 -0.29 0.78 0.00 0.00 0.00 179.25 179.21 3hkz h GLY 246 N -0.04 -0.20 2.00 0.00 0.00 -1.23 -2.97 103.07 100.62 3hkz h GLY 246 Ca 0.35 0.36 0.00 0.00 0.00 0.00 0.00 47.33 48.04 3hkz h GLY 246 CO -0.87 -0.21 0.00 0.50 0.00 0.00 0.00 176.54 175.96 3hkz h LYS 247 N -0.25 0.00 -0.45 4.80 1.57 -0.53 -2.79 116.57 118.92 3hkz h LYS 247 Ca 0.16 0.00 -0.05 0.00 -1.87 0.00 0.00 60.65 58.89 3hkz h LYS 247 Cb 0.51 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.79 3hkz h LYS 247 CO -0.47 0.00 0.09 0.66 -0.57 0.00 0.00 179.45 179.16 3hkz h SER 248 N 0.00 0.63 0.76 0.86 4.64 -0.85 -1.92 113.55 117.68 3hkz h SER 248 Ca 0.00 -0.11 -0.03 0.00 -0.47 0.00 0.00 61.79 61.18 3hkz h SER 248 Cb 0.77 -0.16 0.00 0.00 -0.31 0.00 0.00 62.40 62.69 3hkz h SER 248 CO 0.00 0.65 -0.42 0.40 -0.87 0.00 0.00 176.83 176.58 3hkz h ILE 249 N 0.66 0.00 -0.97 0.95 2.04 -1.57 0.15 117.51 118.77 3hkz h ILE 249 Ca 0.15 0.00 0.13 0.00 1.00 0.00 0.00 64.86 66.14 3hkz h ILE 249 Cb 0.28 0.00 -0.09 0.00 -0.74 0.00 0.00 36.82 36.27 3hkz h ILE 249 CO 0.00 0.00 0.59 0.40 0.00 0.00 0.00 178.15 179.15 3hkz h ILE 250 N -1.09 0.87 -0.60 -0.67 2.04 -1.63 1.90 117.51 118.32 3hkz h ILE 250 Ca -0.10 -0.31 -0.05 0.00 1.00 0.00 0.00 64.86 65.40 3hkz h ILE 250 Cb 0.86 -0.12 -0.03 0.00 -0.74 0.00 0.00 36.82 36.80 3hkz h ILE 250 CO 0.13 0.17 0.17 -0.09 0.00 0.00 0.00 178.15 178.52 3hkz h ARG 251 N 0.91 0.91 0.04 2.37 2.43 -1.28 -2.24 114.38 117.52 3hkz h ARG 251 Ca 0.50 -0.18 -0.08 0.00 -0.81 0.00 0.00 59.98 59.40 3hkz h ARG 251 Cb 0.55 -0.14 0.01 0.00 -0.42 0.00 0.00 29.97 29.97 3hkz h ARG 251 CO -0.29 0.80 -0.34 0.87 -1.51 0.00 0.00 179.97 179.50 3hkz h LYS 252 N 0.88 0.16 0.25 0.20 1.57 0.18 -3.13 116.57 116.69 3hkz h LYS 252 Ca 0.20 -0.23 -0.01 0.00 -1.87 0.00 0.00 60.65 58.74 3hkz h LYS 252 Cb 0.28 0.08 0.00 0.00 0.08 0.00 0.00 32.23 32.67 3hkz h LYS 252 CO -0.01 1.04 -0.12 0.97 -0.57 0.00 0.00 179.45 180.76 3hkz h ILE 253 N -0.61 0.75 0.00 1.86 6.09 0.28 0.73 117.51 126.61 3hkz h ILE 253 Ca -0.05 0.00 -0.04 0.00 -1.37 0.00 0.00 64.86 63.40 3hkz h ILE 253 Cb 1.19 0.75 -0.01 0.00 0.47 0.00 0.00 36.82 39.22 3hkz h ILE 253 CO 0.06 0.00 -0.17 -0.33 -3.07 0.00 0.00 178.15 174.64 3hkz h GLU 254 N -0.34 0.00 -0.05 2.19 5.08 -1.59 -0.27 114.58 119.60 3hkz h GLU 254 Ca -0.03 0.00 -0.25 0.00 -1.00 0.00 0.00 59.36 58.08 3hkz h GLU 254 Cb 0.26 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.53 3hkz h GLU 254 CO 0.06 0.17 -0.94 1.49 -1.00 0.00 0.00 179.01 178.79 3hkz h GLU 255 N 0.00 0.68 0.00 2.33 4.81 -1.21 -2.25 114.58 118.93 3hkz h GLU 255 Ca -0.00 -0.66 0.00 0.00 -0.13 0.00 0.00 59.36 58.56 3hkz h GLU 255 Cb 0.43 0.17 0.00 0.00 0.63 0.00 0.00 28.75 29.98 3hkz h GLU 255 CO 0.02 1.26 0.00 -0.11 -0.73 0.00 0.00 179.01 179.45 3hkz n LEU 256 N -3.86 0.00 -0.00 1.64 7.94 0.24 -1.61 117.00 121.35 3hkz n LEU 256 Ca -0.09 0.96 -0.00 0.00 -1.11 0.00 0.00 56.01 55.77 3hkz n LEU 256 Cb 0.83 -0.46 -0.00 0.00 0.53 0.00 0.00 43.42 44.32 3hkz n LEU 256 CO 0.54 -0.46 0.23 1.21 -1.11 0.00 0.00 177.39 177.80 3hkz n GLU 257 N -2.05 -0.00 -0.02 1.96 2.13 -0.20 0.08 120.64 122.53 3hkz n GLU 257 Ca 0.00 0.47 -0.13 0.00 0.66 0.00 0.00 57.16 58.17 3hkz n GLU 257 Cb 0.00 -0.71 -0.07 0.00 0.27 0.00 0.00 31.44 30.93 3hkz n GLU 257 CO 0.00 0.00 0.00 -0.22 -0.41 0.00 0.00 177.13 176.50 3hkz h LYS 258 N 0.00 -0.47 0.00 5.31 3.11 -1.47 0.16 116.57 123.20 3hkz h LYS 258 Ca 0.00 0.03 0.00 0.00 -2.81 0.00 0.00 60.65 57.87 3hkz h LYS 258 Cb 0.00 0.11 0.00 0.00 -1.00 0.00 0.00 32.23 31.34 3hkz h LYS 258 CO -0.01 -0.32 0.00 1.63 -2.81 0.00 0.00 179.45 177.94 3hkz n LYS 259 N -5.43 0.14 -0.07 1.90 5.02 0.18 -1.61 118.16 118.30 3hkz n LYS 259 Ca -0.04 0.60 -0.19 0.00 -2.02 0.00 0.00 58.31 56.66 3hkz n LYS 259 Cb 0.37 -1.93 -0.13 0.00 -0.02 0.00 0.00 35.03 33.32 3hkz n LYS 259 CO 0.00 0.00 0.00 1.25 -0.52 0.00 0.00 177.40 178.13 3hkz h LEU 260 N 0.00 0.08 0.00 -0.35 6.46 0.24 -3.22 115.31 118.52 3hkz h LEU 260 Ca 0.00 -0.77 0.00 0.00 -0.12 0.00 0.00 57.88 56.99 3hkz h LEU 260 Cb 0.06 -0.03 0.00 0.00 -0.73 0.00 0.00 40.66 39.96 3hkz h LEU 260 CO 0.00 1.32 0.00 1.33 -0.62 0.00 0.00 178.44 180.47 3hkz n VAL 261 N -4.41 0.25 0.03 1.05 0.24 -0.19 0.28 118.33 115.59 3hkz n VAL 261 Ca -0.22 0.06 0.11 0.00 -2.04 0.00 0.00 64.34 62.26 3hkz n VAL 261 Cb 0.64 -0.77 -0.14 0.00 -1.47 0.00 0.00 33.84 32.11 3hkz n VAL 261 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 3hkz n GLU 262 N -1.15 0.64 -0.12 7.34 1.02 -1.11 -4.70 120.64 122.55 3hkz n GLU 262 Ca 0.11 -0.14 -0.16 0.00 -0.02 0.00 0.00 57.16 56.95 3hkz n GLU 262 Cb 0.11 -1.57 -0.13 0.00 -0.02 0.00 0.00 31.44 29.83 3hkz n GLU 262 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 3hkz n VAL 263 N -2.31 1.46 -3.03 2.62 0.31 0.14 -4.96 118.33 112.57 3hkz n VAL 263 Ca -0.03 -0.66 -0.39 0.00 -0.01 0.00 0.00 64.34 63.25 3hkz n VAL 263 Cb 0.56 -1.14 -0.06 0.00 -0.91 0.00 0.00 33.84 32.30 3hkz n VAL 263 CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 3hkz s VAL 264 N -2.51 4.55 -0.53 2.52 1.01 0.67 -5.09 120.40 121.03 3hkz s VAL 264 Ca -0.28 1.60 0.04 0.00 0.00 0.00 0.00 61.98 63.34 3hkz s VAL 264 Cb 0.08 -4.09 0.03 0.00 0.00 0.00 0.00 36.38 32.40 3hkz s VAL 264 CO 0.67 0.47 0.63 0.29 0.00 0.00 0.00 175.10 177.17