#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 4.28 0.13 -1.33 1.01 -1.26 -4.51 121.20 119.52 3hkz s ILE 3 Ca 0.00 1.54 0.05 0.00 0.00 0.00 0.00 60.65 62.24 3hkz s ILE 3 Cb 0.00 -4.02 -0.04 0.00 0.01 0.00 0.00 42.46 38.41 3hkz s ILE 3 CO 0.00 -0.17 0.05 0.20 0.00 0.00 0.00 174.94 175.02 3hkz s ASN 4 N 2.03 5.20 -0.63 3.58 0.01 -1.25 -4.92 114.94 118.96 3hkz s ASN 4 Ca 0.54 -0.19 -0.26 0.00 -0.71 0.00 0.00 52.86 52.25 3hkz s ASN 4 Cb -0.21 -1.28 0.04 0.00 0.41 0.00 0.00 41.25 40.21 3hkz s ASN 4 CO 0.15 0.12 1.14 -0.76 -1.51 0.00 0.00 177.10 176.25 3hkz s LEU 5 N -2.71 3.59 0.00 0.60 1.43 -1.26 -2.95 118.68 117.38 3hkz s LEU 5 Ca 0.28 -0.28 0.27 0.00 -1.03 0.00 0.00 54.13 53.37 3hkz s LEU 5 Cb -0.11 -2.82 0.89 0.00 0.03 0.00 0.00 46.19 44.18 3hkz s LEU 5 CO 0.21 -1.54 1.67 -0.11 0.23 0.00 0.00 176.35 176.81 3hkz n LEU 6 N 8.46 0.31 0.00 1.79 7.94 -0.79 -4.95 117.00 129.76 3hkz n LEU 6 Ca 0.04 0.19 0.00 0.00 -1.11 0.00 0.00 56.01 55.13 3hkz n LEU 6 Cb 0.48 -0.34 0.00 0.00 0.53 0.00 0.00 43.42 44.10 3hkz n LEU 6 CO 0.69 0.07 0.00 1.57 -1.11 0.00 0.00 177.39 178.61 3hkz n HIS 7 N -1.42 0.00 0.00 1.96 -0.00 -1.25 -4.87 115.22 109.65 3hkz n HIS 7 Ca 0.07 0.00 0.00 0.00 0.46 0.00 0.00 57.72 58.25 3hkz n HIS 7 Cb 0.33 0.00 0.00 0.00 -0.12 0.00 0.00 29.99 30.20 3hkz n HIS 7 CO 0.00 0.00 0.00 1.17 0.46 0.00 0.00 176.34 177.97 3hkz n LYS 8 N -0.54 0.00 0.00 1.57 3.00 -1.24 -2.52 118.16 118.43 3hkz n LYS 8 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.31 3hkz n LYS 8 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.03 3hkz n LYS 8 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.40 177.00 3hkz n ASP 9 N 0.00 0.00 0.13 3.14 5.75 -0.94 -5.00 116.55 119.63 3hkz n ASP 9 Ca 0.00 0.00 0.06 0.00 -0.01 0.00 0.00 54.79 54.84 3hkz n ASP 9 Cb 0.00 0.00 0.04 0.00 -1.03 0.00 0.00 41.12 40.13 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 -2.03 -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 0.30 0.00 0.35 -1.61 0.00 0.00 179.24 178.28 3hkz n THR 11 N -3.03 0.32 -1.94 2.25 -2.24 -1.26 -4.46 114.28 103.92 3hkz n THR 11 Ca -0.00 0.10 -0.43 0.00 -2.27 0.00 0.00 64.05 61.46 3hkz n THR 11 Cb 0.67 -0.74 -0.03 0.00 -2.10 0.00 0.00 70.33 68.14 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 -1.72 3.71 -0.08 -0.78 3.52 -1.26 -4.11 118.95 118.23 3hkz s ARG 12 Ca 0.00 1.88 0.05 0.00 -0.13 0.00 0.00 55.73 57.53 3hkz s ARG 12 Cb 0.00 -4.13 -0.01 0.00 -1.56 0.00 0.00 34.95 29.25 3hkz s ARG 12 CO 0.00 -1.42 -0.23 0.42 -0.81 0.00 0.00 175.30 173.26 3hkz s ILE 13 N 5.75 2.21 -0.07 4.11 1.01 -0.07 -2.22 121.20 131.91 3hkz s ILE 13 Ca 0.80 -0.99 0.02 0.00 0.00 0.00 0.00 60.65 60.47 3hkz s ILE 13 Cb -0.29 -1.83 -0.03 0.00 0.01 0.00 0.00 42.46 40.32 3hkz s ILE 13 CO 0.33 0.56 -0.11 -1.81 0.00 0.00 0.00 174.94 173.91 3hkz s ASP 14 N 0.00 4.32 0.22 3.58 1.01 -1.05 -1.54 116.67 123.22 3hkz s ASP 14 Ca -0.08 -0.13 0.07 0.00 0.71 0.00 0.00 52.55 53.11 3hkz s ASP 14 Cb -0.15 -1.11 -0.05 0.00 1.01 0.00 0.00 42.92 42.62 3hkz s ASP 14 CO 0.05 0.32 -0.11 -0.76 0.21 0.00 0.00 175.17 174.89 3hkz s LEU 15 N -0.59 2.51 -0.46 1.23 1.43 -0.96 -1.89 118.68 119.95 3hkz s LEU 15 Ca 0.09 -1.08 0.02 0.00 -1.03 0.00 0.00 54.13 52.13 3hkz s LEU 15 Cb -0.12 -0.60 0.14 0.00 0.03 0.00 0.00 46.19 45.64 3hkz s LEU 15 CO 0.02 -0.26 0.26 -0.69 0.23 0.00 0.00 176.35 175.91 3hkz s VAL 16 N -3.05 1.48 -0.75 -1.59 1.01 -1.15 -1.57 120.40 114.78 3hkz s VAL 16 Ca 0.24 -2.71 -0.26 0.00 0.00 0.00 0.00 61.98 59.25 3hkz s VAL 16 Cb 0.01 -2.03 0.03 0.00 0.00 0.00 0.00 36.38 34.39 3hkz s VAL 16 CO 0.08 -0.92 1.27 -0.36 0.00 0.00 0.00 175.10 175.17 3hkz s PHE 17 N 0.19 2.32 -0.06 5.22 0.40 0.40 -3.75 117.98 122.71 3hkz s PHE 17 Ca 0.19 -0.14 -0.15 0.00 -0.60 0.00 0.00 56.93 56.24 3hkz s PHE 17 Cb -0.21 -4.61 -0.05 0.00 0.51 0.00 0.00 43.02 38.65 3hkz s PHE 17 CO -0.02 -2.04 0.38 -2.00 0.70 0.00 0.00 175.22 172.24 3hkz s GLU 18 N 5.58 4.02 0.00 0.44 2.12 -1.26 -1.33 118.70 128.27 3hkz s GLU 18 Ca 0.35 0.33 0.00 0.00 0.36 0.00 0.00 54.97 56.01 3hkz s GLU 18 Cb -0.08 -3.29 0.00 0.00 0.26 0.00 0.00 34.13 31.02 3hkz s GLU 18 CO 0.13 0.52 0.00 0.41 -0.54 0.00 0.00 175.26 175.78 3hkz n GLY 19 N 2.37 1.86 3.37 -1.50 0.00 0.12 -4.46 105.19 106.95 3hkz n GLY 19 Ca -0.13 -0.19 -0.40 0.00 0.00 0.00 0.00 46.02 45.30 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 -2.47 1.61 4.02 -1.26 -4.89 117.16 112.62 3hkz n TYR 20 Ca 0.00 0.51 -0.41 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 37.43 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 -1.47 4.60 0.19 -0.72 0.04 -1.26 -4.83 135.00 131.55 3hkz s PRO 21 Ca 0.62 1.79 -0.10 0.00 0.04 0.00 0.00 61.00 63.35 3hkz s PRO 21 Cb -0.52 -3.23 0.10 0.00 0.04 0.00 0.00 34.50 30.89 3hkz s PRO 21 CO 0.60 0.11 1.74 1.25 0.04 0.00 0.00 177.00 180.74 3hkz h LEU 22 N 4.52 0.93 0.00 -3.56 5.85 -1.95 -0.16 115.31 120.95 3hkz h LEU 22 Ca -0.45 -0.18 0.00 0.00 0.84 0.00 0.00 57.88 58.09 3hkz h LEU 22 Cb 1.21 -0.24 0.00 0.00 0.37 0.00 0.00 40.66 42.00 3hkz h LEU 22 CO 0.70 0.85 0.00 -1.84 -0.34 0.00 0.00 178.44 177.81 3hkz n GLU 23 N -4.39 0.00 -0.01 1.25 0.00 -1.26 -1.63 120.64 114.60 3hkz n GLU 23 Ca 0.05 0.00 -0.04 0.00 0.00 0.00 0.00 57.16 57.16 3hkz n GLU 23 Cb 0.18 -1.25 -0.01 0.00 0.00 0.00 0.00 31.44 30.35 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 -0.72 0.00 -0.31 -1.84 7.35 -0.14 -4.29 117.46 117.52 3hkz n PHE 24 Ca 0.00 0.00 0.14 0.00 -0.76 0.00 0.00 57.45 56.83 3hkz n PHE 24 Cb 0.00 -0.17 0.32 0.00 0.35 0.00 0.00 39.48 39.98 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 -0.24 0.39 -0.32 -2.13 2.07 -0.85 0.23 116.25 115.40 3hkz h VAL 25 Ca -0.08 -0.11 -0.17 0.00 0.82 0.00 0.00 66.70 67.17 3hkz h VAL 25 Cb 0.66 0.05 -0.00 0.00 -1.52 0.00 0.00 31.29 30.47 3hkz h VAL 25 CO -0.05 0.06 -0.45 -1.13 0.02 0.00 0.00 177.57 176.03 3hkz h ASN 26 N 0.32 0.95 0.68 0.57 -1.24 -1.59 -1.84 115.58 113.43 3hkz h ASN 26 Ca 0.58 -0.50 0.00 0.00 0.71 0.00 0.00 56.30 57.09 3hkz h ASN 26 Cb 1.16 -0.27 0.00 0.00 0.73 0.00 0.00 38.32 39.94 3hkz h ASN 26 CO -0.58 1.27 0.00 0.00 -1.29 0.00 0.00 177.43 176.82 3hkz n ALA 27 N -2.55 2.07 -0.08 1.57 0.00 0.51 0.23 120.51 122.26 3hkz n ALA 27 Ca -0.04 -0.09 -0.15 0.00 0.00 0.00 0.00 53.44 53.17 3hkz n ALA 27 Cb 0.57 -1.37 -0.10 0.00 0.00 0.00 0.00 19.45 18.56 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 1.09 -0.53 0.00 1.08 -0.59 -2.74 117.51 115.82 3hkz h ILE 28 Ca 0.00 -2.01 0.10 0.00 -0.39 0.00 0.00 64.86 62.56 3hkz h ILE 28 Cb 0.34 2.25 -0.11 0.00 -3.07 0.00 0.00 36.82 36.23 3hkz h ILE 28 CO 0.00 0.37 -0.28 -0.09 -0.69 0.00 0.00 178.15 177.45 3hkz h ARG 29 N -1.00 -0.15 -0.40 2.37 2.43 -0.98 0.16 114.38 116.81 3hkz h ARG 29 Ca -0.14 0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.04 3hkz h ARG 29 Cb 0.97 0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 30.54 3hkz h ARG 29 CO -0.08 -0.10 0.25 0.00 -1.51 0.00 0.00 179.97 178.53 3hkz h ARG 30 N -0.15 0.53 -0.90 0.20 3.08 -0.39 -2.12 114.38 114.63 3hkz h ARG 30 Ca 0.23 -0.04 0.13 0.00 0.07 0.00 0.00 59.98 60.37 3hkz h ARG 30 Cb 0.52 -0.12 -0.09 0.00 0.08 0.00 0.00 29.97 30.37 3hkz h ARG 30 CO -0.62 0.38 0.52 0.00 -1.07 0.00 0.00 179.97 179.18 3hkz h ALA 31 N 1.12 1.37 -0.48 0.04 0.00 -1.06 0.30 119.26 120.55 3hkz h ALA 31 Ca 0.14 0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.11 3hkz h ALA 31 Cb -0.03 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.66 3hkz h ALA 31 CO -0.03 0.05 0.00 0.43 0.00 0.00 0.00 179.25 179.70 3hkz n SER 32 N -4.76 0.00 -0.48 0.00 7.64 0.51 -1.28 113.62 115.24 3hkz n SER 32 Ca 0.18 0.92 0.40 0.00 1.01 0.00 0.00 58.87 61.37 3hkz n SER 32 Cb 0.39 -0.42 0.69 0.00 -1.01 0.00 0.00 64.21 63.87 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 0.07 0.00 1.43 2.07 -1.19 -3.37 114.93 113.95 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 -0.02 0.00 0.00 -1.87 0.00 0.00 31.60 29.71 3hkz h MET 33 CO 0.00 0.05 0.00 1.28 1.07 0.00 0.00 176.91 179.31 3hkz n LEU 34 N -4.46 0.00 0.00 1.22 4.77 0.10 -4.37 117.00 114.26 3hkz n LEU 34 Ca 0.37 0.00 0.02 0.00 -0.03 0.00 0.00 56.01 56.37 3hkz n LEU 34 Cb 1.51 0.00 0.12 0.00 -2.33 0.00 0.00 43.42 42.72 3hkz n LEU 34 CO 0.29 0.00 0.35 -1.22 -1.33 0.00 0.00 177.39 175.48 3hkz n TYR 35 N 0.00 0.00 -2.81 -1.77 4.01 -0.41 0.20 117.16 116.38 3hkz n TYR 35 Ca 0.00 0.00 -0.42 0.00 -0.16 0.00 0.00 57.90 57.32 3hkz n TYR 35 Cb 0.00 0.00 -0.03 0.00 -0.31 0.00 0.00 39.34 39.00 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 -2.00 4.80 0.65 -0.72 1.01 -1.18 -4.73 120.40 118.24 3hkz s VAL 36 Ca 0.06 1.76 -0.08 0.00 0.00 0.00 0.00 61.98 63.72 3hkz s VAL 36 Cb 0.03 -4.20 0.02 0.00 0.00 0.00 0.00 36.38 32.23 3hkz s VAL 36 CO 0.05 -0.06 0.99 -2.16 0.00 0.00 0.00 175.10 173.92 3hkz s PRO 37 N 2.63 2.82 0.12 2.72 0.04 -1.26 -3.71 135.00 138.36 3hkz s PRO 37 Ca 0.40 0.16 -0.01 0.00 0.04 0.00 0.00 61.00 61.59 3hkz s PRO 37 Cb -0.16 -2.16 -0.04 0.00 0.04 0.00 0.00 34.50 32.18 3hkz s PRO 37 CO 0.10 -0.89 0.03 0.96 0.04 0.00 0.00 177.00 177.24 3hkz s ILE 38 N -3.17 0.21 0.04 0.56 -4.36 -0.92 -4.92 121.20 108.64 3hkz s ILE 38 Ca 0.56 -1.90 -0.29 0.00 -0.26 0.00 0.00 60.65 58.76 3hkz s ILE 38 Cb -0.11 -1.94 -0.04 0.00 1.25 0.00 0.00 42.46 41.62 3hkz s ILE 38 CO 0.48 -0.58 0.94 -0.32 0.24 0.00 0.00 174.94 175.69 3hkz s MET 39 N -4.00 4.59 0.36 0.37 -2.45 -1.26 -1.92 119.30 115.00 3hkz s MET 39 Ca 0.20 1.37 -0.12 0.00 -1.25 0.00 0.00 55.69 55.89 3hkz s MET 39 Cb 0.07 -3.42 0.04 0.00 1.25 0.00 0.00 34.83 32.77 3hkz s MET 39 CO -0.01 0.07 0.68 0.00 1.05 0.00 0.00 175.02 176.82 3hkz s ALA 40 N 0.57 -0.28 0.17 4.11 0.00 -0.79 -4.35 121.76 121.20 3hkz s ALA 40 Ca 0.48 -0.97 -0.28 0.00 0.00 0.00 0.00 51.96 51.19 3hkz s ALA 40 Cb -0.22 0.85 -0.08 0.00 0.00 0.00 0.00 23.12 23.67 3hkz s ALA 40 CO 0.28 -0.92 0.86 0.08 0.00 0.00 0.00 175.76 176.06 3hkz s VAL 41 N -2.67 4.32 0.00 0.00 1.01 -1.26 -1.69 120.40 120.11 3hkz s VAL 41 Ca 0.20 1.90 0.00 0.00 0.00 0.00 0.00 61.98 64.08 3hkz s VAL 41 Cb -0.04 -4.24 0.00 0.00 0.00 0.00 0.00 36.38 32.11 3hkz s VAL 41 CO 0.14 0.46 0.00 -0.67 0.00 0.00 0.00 175.10 175.03 3hkz n ASP 42 N 1.88 0.00 -4.69 3.32 -0.08 -0.85 -4.87 116.55 111.27 3hkz n ASP 42 Ca -0.03 0.00 -0.32 0.00 -1.51 0.00 0.00 54.79 52.93 3hkz n ASP 42 Cb 0.48 -0.35 -0.09 0.00 2.34 0.00 0.00 41.12 43.50 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 -4.18 5.13 -0.15 1.67 1.01 -1.26 -5.00 116.67 113.89 3hkz s ASP 43 Ca 0.00 -0.03 0.01 0.00 0.71 0.00 0.00 52.55 53.24 3hkz s ASP 43 Cb 0.00 -1.33 0.02 0.00 1.01 0.00 0.00 42.92 42.62 3hkz s ASP 43 CO 0.00 0.26 -0.16 -0.69 0.21 0.00 0.00 175.17 174.79 3hkz s VAL 44 N -1.13 1.72 -0.59 -1.27 1.01 -1.26 -0.27 120.40 118.61 3hkz s VAL 44 Ca 0.21 -0.74 -0.21 0.00 0.00 0.00 0.00 61.98 61.24 3hkz s VAL 44 Cb -0.12 -1.58 0.07 0.00 0.00 0.00 0.00 36.38 34.76 3hkz s VAL 44 CO 0.12 0.48 0.81 -0.31 0.00 0.00 0.00 175.10 176.20 3hkz s TYR 45 N 1.32 2.87 -0.08 5.22 2.02 0.16 -4.90 117.35 123.96 3hkz s TYR 45 Ca 0.03 -0.61 -0.23 0.00 -0.37 0.00 0.00 57.07 55.88 3hkz s TYR 45 Cb -0.13 -4.02 -0.04 0.00 -0.40 0.00 0.00 41.96 37.37 3hkz s TYR 45 CO -0.09 -1.37 0.69 -0.06 -1.57 0.00 0.00 175.55 173.14 3hkz s PHE 46 N 3.31 3.56 -0.14 2.71 0.40 -1.26 -1.41 117.98 125.14 3hkz s PHE 46 Ca 0.18 1.21 -0.02 0.00 -0.60 0.00 0.00 56.93 57.70 3hkz s PHE 46 Cb -0.19 -2.79 -0.08 0.00 0.51 0.00 0.00 43.02 40.47 3hkz s PHE 46 CO 0.10 0.07 -0.15 -0.89 0.70 0.00 0.00 175.22 175.05 3hkz n ILE 47 N 3.83 0.81 -3.57 0.64 5.41 -0.52 -5.03 119.36 120.94 3hkz n ILE 47 Ca -0.01 -0.27 -0.01 0.00 1.00 0.00 0.00 62.75 63.46 3hkz n ILE 47 Cb 0.51 -1.29 -0.05 0.00 -0.71 0.00 0.00 39.64 38.11 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 -2.28 0.49 -0.32 0.38 2.12 -1.07 -4.99 118.70 113.02 3hkz s GLU 48 Ca -0.20 1.14 0.04 0.00 0.36 0.00 0.00 54.97 56.31 3hkz s GLU 48 Cb 0.06 0.60 0.17 0.00 0.26 0.00 0.00 34.13 35.22 3hkz s GLU 48 CO 0.30 -0.15 0.47 1.21 -0.54 0.00 0.00 175.26 176.54 3hkz s ASN 49 N 2.51 -0.12 -0.46 -1.70 2.47 -1.25 -0.42 114.94 115.96 3hkz s ASN 49 Ca -0.06 -0.56 0.04 0.00 0.42 0.00 0.00 52.86 52.71 3hkz s ASN 49 Cb -0.09 1.30 0.42 0.00 -1.45 0.00 0.00 41.25 41.44 3hkz s ASN 49 CO -0.18 -0.30 1.27 -0.46 -3.72 0.00 0.00 177.10 173.71 3hkz n ASN 50 N 5.03 5.20 -2.86 -4.21 6.94 -1.22 -4.77 115.26 119.37 3hkz n ASN 50 Ca 0.05 -3.74 -0.11 0.00 -0.02 0.00 0.00 54.58 50.76 3hkz n ASN 50 Cb 0.51 -0.52 0.07 0.00 -2.36 0.00 0.00 39.78 37.47 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 -0.56 0.24 0.00 0.53 3.41 -1.26 -4.70 113.62 111.29 3hkz n SER 51 Ca 0.43 -1.30 0.01 0.00 -0.26 0.00 0.00 58.87 57.75 3hkz n SER 51 Cb 0.68 -0.35 0.08 0.00 -0.26 0.00 0.00 64.21 64.37 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 -1.97 0.98 -3.59 4.33 -0.04 -1.26 -4.42 135.00 129.02 3hkz n PRO 52 Ca 0.07 0.00 -0.28 0.00 -0.04 0.00 0.00 63.50 63.25 3hkz n PRO 52 Cb 0.23 -1.04 -0.11 0.00 -0.04 0.00 0.00 33.50 32.54 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 -1.09 2.45 0.71 1.53 1.43 -1.26 -5.08 118.68 117.38 3hkz s LEU 53 Ca 0.04 -3.06 -0.17 0.00 -1.03 0.00 0.00 54.13 49.91 3hkz s LEU 53 Cb 0.02 -0.85 -0.09 0.00 0.03 0.00 0.00 46.19 45.30 3hkz s LEU 53 CO 0.03 -0.19 0.06 0.00 0.23 0.00 0.00 176.35 176.49 3hkz n TYR 54 N 2.92 -2.32 -0.18 0.29 0.18 -1.26 -4.20 117.16 112.58 3hkz n TYR 54 Ca 0.21 0.30 -0.05 0.00 1.88 0.00 0.00 57.90 60.25 3hkz n TYR 54 Cb 0.41 -1.75 -0.04 0.00 -0.38 0.00 0.00 39.34 37.58 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 1.28 -0.45 -0.04 9.48 9.92 -1.26 -1.48 116.55 134.00 3hkz n ASP 55 Ca 0.07 0.78 -0.11 0.00 -0.53 0.00 0.00 54.79 54.99 3hkz n ASP 55 Cb 0.50 -0.11 -0.05 0.00 -0.64 0.00 0.00 41.12 40.82 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 -0.41 0.00 -1.24 3.07 -1.99 0.14 114.58 114.15 3hkz h GLU 56 Ca 0.08 0.03 -0.16 0.00 -0.50 0.00 0.00 59.36 58.80 3hkz h GLU 56 Cb 0.18 0.09 -0.02 0.00 -0.84 0.00 0.00 28.75 28.16 3hkz h GLU 56 CO -0.41 -0.27 -0.78 0.97 -1.40 0.00 0.00 179.01 177.11 3hkz h ILE 57 N -0.42 1.44 0.00 3.13 -0.00 -1.56 -2.67 117.51 117.43 3hkz h ILE 57 Ca 0.10 -2.79 -0.01 0.00 -0.00 0.00 0.00 64.86 62.15 3hkz h ILE 57 Cb 0.60 2.56 0.00 0.00 -0.00 0.00 0.00 36.82 39.98 3hkz h ILE 57 CO -0.45 0.77 -0.06 0.25 -0.00 0.00 0.00 178.15 178.65 3hkz h LEU 58 N 0.00 0.05 -0.95 2.19 6.46 -1.35 -3.04 115.31 118.67 3hkz h LEU 58 Ca -0.01 -0.86 0.29 0.00 -0.12 0.00 0.00 57.88 57.18 3hkz h LEU 58 Cb 1.49 -0.01 -0.16 0.00 -0.73 0.00 0.00 40.66 41.25 3hkz h LEU 58 CO 0.10 0.91 0.28 0.00 -0.62 0.00 0.00 178.44 179.10 3hkz h ALA 59 N 0.14 1.50 -0.19 1.25 0.00 -0.76 -1.59 119.26 119.62 3hkz h ALA 59 Ca -0.01 0.26 -0.00 0.00 0.00 0.00 0.00 54.91 55.16 3hkz h ALA 59 Cb 0.92 0.38 -0.01 0.00 0.00 0.00 0.00 17.79 19.08 3hkz h ALA 59 CO 0.01 -0.61 0.10 1.25 0.00 0.00 0.00 179.25 180.01 3hkz h HIS 60 N 0.12 0.25 -0.87 0.00 -0.00 -1.42 -1.92 115.15 111.32 3hkz h HIS 60 Ca 0.65 -0.01 0.13 0.00 -0.00 0.00 0.00 60.37 61.14 3hkz h HIS 60 Cb 1.44 -0.08 -0.07 0.00 -0.00 0.00 0.00 27.41 28.70 3hkz h HIS 60 CO -0.25 0.23 0.56 0.00 -0.00 0.00 0.00 177.93 178.48 3hkz h ARG 61 N 0.20 0.70 -0.66 5.26 3.08 -1.19 -2.32 114.38 119.45 3hkz h ARG 61 Ca 0.07 -0.04 -0.04 0.00 0.07 0.00 0.00 59.98 60.03 3hkz h ARG 61 Cb 0.06 -0.16 -0.03 0.00 0.08 0.00 0.00 29.97 29.92 3hkz h ARG 61 CO -0.01 0.46 0.24 -0.07 -1.07 0.00 0.00 179.97 179.52 3hkz h LEU 62 N 0.72 0.90 -0.73 3.04 3.38 -0.95 -2.39 115.31 119.29 3hkz h LEU 62 Ca 0.43 -0.14 -0.08 0.00 0.09 0.00 0.00 57.88 58.19 3hkz h LEU 62 Cb 0.63 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 41.12 3hkz h LEU 62 CO -0.19 0.82 0.12 0.00 0.09 0.00 0.00 178.44 179.28 3hkz h ALA 63 N 1.31 0.95 0.00 1.53 0.00 -1.13 -2.98 119.26 118.93 3hkz h ALA 63 Ca 0.22 -0.27 0.00 0.00 0.00 0.00 0.00 54.91 54.87 3hkz h ALA 63 Cb 0.22 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 17.75 3hkz h ALA 63 CO -0.02 0.66 0.00 1.28 0.00 0.00 0.00 179.25 181.17 3hkz n LEU 64 N -4.22 0.00 -4.70 0.00 4.77 -0.90 -4.44 117.00 107.51 3hkz n LEU 64 Ca 0.04 0.00 -0.42 0.00 -0.03 0.00 0.00 56.01 55.60 3hkz n LEU 64 Cb 0.28 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.35 3hkz n LEU 64 CO 0.43 0.00 0.85 -0.63 -1.33 0.00 0.00 177.39 176.71 3hkz s ILE 65 N -2.00 4.35 0.25 -0.08 1.01 -1.13 -4.98 121.20 118.62 3hkz s ILE 65 Ca 0.25 1.68 -0.30 0.00 0.00 0.00 0.00 60.65 62.29 3hkz s ILE 65 Cb 0.12 -4.08 -0.09 0.00 0.01 0.00 0.00 42.46 38.41 3hkz s ILE 65 CO 0.20 0.08 1.30 -2.84 0.00 0.00 0.00 174.94 173.68 3hkz s PRO 66 N 1.46 4.39 0.15 2.79 0.02 -1.26 -4.93 135.00 137.61 3hkz s PRO 66 Ca 0.55 2.10 0.10 0.00 0.02 0.00 0.00 61.00 63.78 3hkz s PRO 66 Cb -0.25 -3.15 -0.04 0.00 0.02 0.00 0.00 34.50 31.08 3hkz s PRO 66 CO 0.26 -0.21 -0.24 -0.06 -0.33 0.00 0.00 177.00 176.42 3hkz s PHE 67 N -0.35 2.13 -0.98 6.54 0.40 -1.26 -3.16 117.98 121.31 3hkz s PHE 67 Ca 0.54 -0.39 -0.22 0.00 -0.60 0.00 0.00 56.93 56.26 3hkz s PHE 67 Cb -0.37 -1.11 0.08 0.00 0.51 0.00 0.00 43.02 42.12 3hkz s PHE 67 CO 0.43 0.36 1.33 -1.64 0.70 0.00 0.00 175.22 176.40 3hkz s MET 68 N -2.31 3.57 0.00 0.44 -1.94 -1.13 -4.26 119.30 113.67 3hkz s MET 68 Ca 0.15 -1.30 0.25 0.00 -1.71 0.00 0.00 55.69 53.08 3hkz s MET 68 Cb -0.09 -5.17 0.50 0.00 2.01 0.00 0.00 34.83 32.08 3hkz s MET 68 CO 0.07 -2.06 1.41 0.43 -0.01 0.00 0.00 175.02 174.86 3hkz n SER 69 N 8.12 1.73 0.00 3.03 7.64 -1.10 -4.26 113.62 128.79 3hkz n SER 69 Ca 0.29 -1.37 0.00 0.00 1.01 0.00 0.00 58.87 58.80 3hkz n SER 69 Cb 0.50 0.19 0.00 0.00 -1.01 0.00 0.00 64.21 63.89 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 0.01 0.00 0.20 1.43 4.07 -1.14 -0.36 120.64 124.85 3hkz n GLU 70 Ca 0.13 0.19 -0.15 0.00 -0.06 0.00 0.00 57.16 57.28 3hkz n GLU 70 Cb 0.43 -0.30 -0.08 0.00 -0.06 0.00 0.00 31.44 31.42 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 -0.45 -1.41 5.31 5.08 -1.84 -3.39 114.58 117.88 3hkz h GLU 71 Ca 0.00 0.03 0.42 0.00 -1.00 0.00 0.00 59.36 58.81 3hkz h GLU 71 Cb 0.00 0.10 -0.08 0.00 0.50 0.00 0.00 28.75 29.27 3hkz h GLU 71 CO 0.00 -0.21 0.98 0.00 -1.00 0.00 0.00 179.01 178.78 3hkz h ALA 72 N -0.01 3.11 -0.00 3.43 0.00 -0.90 -0.63 119.26 124.25 3hkz h ALA 72 Ca -0.05 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.87 3hkz h ALA 72 Cb 0.44 0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.36 3hkz h ALA 72 CO 0.08 -1.59 0.00 -0.07 0.00 0.00 0.00 179.25 177.67 3hkz h LEU 73 N 0.07 0.00 0.00 0.00 3.38 -1.63 -2.53 115.31 114.60 3hkz h LEU 73 Ca 0.73 0.00 -0.34 0.00 0.09 0.00 0.00 57.88 58.36 3hkz h LEU 73 Cb 2.64 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 43.33 3hkz h LEU 73 CO -0.15 0.00 -2.28 0.47 0.09 0.00 0.00 178.44 176.57 3hkz n ASP 74 N -3.12 0.47 0.02 -0.43 8.00 -0.24 -4.51 116.55 116.73 3hkz n ASP 74 Ca -0.03 -0.00 0.13 0.00 0.71 0.00 0.00 54.79 55.59 3hkz n ASP 74 Cb 0.07 0.92 0.34 0.00 -0.02 0.00 0.00 41.12 42.44 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 -2.70 0.09 -4.26 -3.53 -2.24 -1.05 -4.94 114.28 95.65 3hkz n THR 75 Ca -0.31 -0.06 -0.18 0.00 -2.27 0.00 0.00 64.05 61.23 3hkz n THR 75 Cb 1.10 -0.06 -0.11 0.00 -2.10 0.00 0.00 70.33 69.16 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 -3.03 1.48 0.34 4.78 1.51 -0.98 -4.96 117.35 116.49 3hkz s TYR 76 Ca 0.11 -0.55 -0.26 0.00 -1.01 0.00 0.00 57.07 55.36 3hkz s TYR 76 Cb 0.17 -0.76 -0.09 0.00 -0.11 0.00 0.00 41.96 41.16 3hkz s TYR 76 CO 0.65 0.18 1.02 1.03 -1.11 0.00 0.00 175.55 177.32 3hkz s ARG 77 N -2.80 4.42 0.08 -0.62 0.52 0.58 -4.87 118.95 116.27 3hkz s ARG 77 Ca 0.11 1.50 -0.21 0.00 -0.52 0.00 0.00 55.73 56.61 3hkz s ARG 77 Cb -0.04 -2.78 -0.07 0.00 0.52 0.00 0.00 34.95 32.58 3hkz s ARG 77 CO 0.04 0.09 0.64 -1.58 0.02 0.00 0.00 175.30 174.51 3hkz s TRP 78 N -1.53 3.81 0.57 -0.53 0.52 -1.26 -4.68 118.94 115.83 3hkz s TRP 78 Ca 0.52 1.36 0.08 0.00 0.02 0.00 0.00 56.10 58.09 3hkz s TRP 78 Cb -0.23 -2.60 0.29 0.00 -1.15 0.00 0.00 33.47 29.78 3hkz s TRP 78 CO 0.29 0.51 0.98 -2.30 0.02 0.00 0.00 176.95 176.45 3hkz n PRO 79 N 1.92 0.02 -0.13 4.98 -0.02 -1.26 -0.83 135.00 139.67 3hkz n PRO 79 Ca -0.08 0.86 -0.10 0.00 -2.02 0.00 0.00 63.50 62.16 3hkz n PRO 79 Cb 0.50 -2.26 -0.02 0.00 -0.02 0.00 0.00 33.50 31.70 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 0.63 0.00 -0.52 3.07 -1.95 0.04 114.58 115.85 3hkz h GLU 80 Ca 0.16 -0.18 0.00 0.00 -0.50 0.00 0.00 59.36 58.84 3hkz h GLU 80 Cb 2.07 -0.07 0.00 0.00 -0.84 0.00 0.00 28.75 29.91 3hkz h GLU 80 CO -0.00 0.70 0.00 0.93 -1.40 0.00 0.00 179.01 179.24 3hkz h GLU 81 N 0.47 0.00 -0.02 2.33 3.07 -1.35 -2.64 114.58 116.43 3hkz h GLU 81 Ca 0.11 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.97 3hkz h GLU 81 Cb 0.39 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.30 3hkz h GLU 81 CO 0.01 0.00 -0.28 0.00 -1.40 0.00 0.00 179.01 177.34 3hkz s ILE 83 N -2.28 2.71 -1.69 0.00 1.01 -0.02 -3.29 121.20 117.65 3hkz s ILE 83 Ca 0.22 0.52 0.00 0.00 0.00 0.00 0.00 60.65 61.39 3hkz s ILE 83 Cb 0.19 -3.33 0.00 0.00 0.01 0.00 0.00 42.46 39.33 3hkz s ILE 83 CO 0.46 0.04 0.00 -0.62 0.00 0.00 0.00 174.94 174.82 3hkz n GLU 84 N 3.85 -1.72 -3.66 2.79 -0.58 -1.26 -4.94 120.64 115.11 3hkz n GLU 84 Ca 0.13 0.95 -0.38 0.00 -0.42 0.00 0.00 57.16 57.44 3hkz n GLU 84 Cb 0.39 -5.52 -0.09 0.00 -0.57 0.00 0.00 31.44 25.65 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 0.63 5.02 0.08 0.00 2.01 -1.26 -4.84 115.64 117.27 3hkz s THR 86 Ca 0.12 -1.42 0.00 0.00 0.31 0.00 0.00 61.69 60.70 3hkz s THR 86 Cb -0.22 -4.50 0.00 0.00 0.01 0.00 0.00 72.50 67.80 3hkz s THR 86 CO -0.03 -1.11 0.00 1.21 -0.69 0.00 0.00 174.62 173.99 3hkz n GLU 87 N 5.75 -0.51 -1.26 4.92 2.13 -1.26 -4.96 120.64 125.46 3hkz n GLU 87 Ca -0.02 0.40 -0.04 0.00 0.66 0.00 0.00 57.16 58.16 3hkz n GLU 87 Cb 0.44 -0.51 -0.01 0.00 0.27 0.00 0.00 31.44 31.62 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 -1.77 -3.21 -3.14 4.31 3.02 -1.26 -4.96 115.26 108.24 3hkz n ASN 88 Ca -0.00 0.08 -0.34 0.00 -0.03 0.00 0.00 54.58 54.28 3hkz n ASN 88 Cb 0.07 -1.30 0.00 0.00 -0.61 0.00 0.00 39.78 37.94 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 3.39 0.00 0.00 0.00 5.08 -1.93 -0.38 114.58 120.75 3hkz h GLU 90 Ca 0.38 -0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.74 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 1.06 0.52 0.00 1.63 -1.00 0.00 0.00 179.01 181.22 3hkz n LYS 91 N -3.93 0.61 -0.04 2.33 5.02 -1.26 -3.36 118.16 117.53 3hkz n LYS 91 Ca -0.01 0.00 -0.06 0.00 -2.02 0.00 0.00 58.31 56.21 3hkz n LYS 91 Cb 0.53 -1.14 -0.04 0.00 -0.02 0.00 0.00 35.03 34.36 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 3.16 0.00 0.00 4.12 -1.01 -4.24 117.35 117.21 3hkz s TYR 93 Ca -0.11 -1.17 0.00 0.00 0.02 0.00 0.00 57.07 55.80 3hkz s TYR 93 Cb 0.03 -2.22 0.00 0.00 -1.52 0.00 0.00 41.96 38.25 3hkz s TYR 93 CO 0.19 -0.63 0.00 -2.37 0.02 0.00 0.00 175.55 172.75 3hkz n THR 94 N 4.82 0.00 -3.31 -0.71 5.66 -1.13 -4.87 114.28 114.73 3hkz n THR 94 Ca -0.14 0.00 0.02 0.00 -3.05 0.00 0.00 64.05 60.88 3hkz n THR 94 Cb 0.47 0.00 -0.04 0.00 -1.55 0.00 0.00 70.33 69.21 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 0.12 0.17 0.18 1.09 1.02 -1.26 -4.50 119.74 116.56 3hkz s LYS 95 Ca 0.00 0.41 0.06 0.00 0.02 0.00 0.00 55.97 56.46 3hkz s LYS 95 Cb 0.00 0.24 -0.04 0.00 -0.52 0.00 0.00 37.83 37.51 3hkz s LYS 95 CO 0.00 -0.06 0.09 0.96 -0.92 0.00 0.00 175.35 175.43 3hkz s ILE 96 N 2.19 4.18 0.02 2.17 -4.36 -1.26 -4.24 121.20 119.91 3hkz s ILE 96 Ca -0.01 -1.28 0.05 0.00 -0.26 0.00 0.00 60.65 59.15 3hkz s ILE 96 Cb -0.03 -3.15 -0.02 0.00 1.25 0.00 0.00 42.46 40.51 3hkz s ILE 96 CO -0.17 -0.16 -0.15 -0.31 0.24 0.00 0.00 174.94 174.40 3hkz s TYR 97 N -1.83 1.30 -0.11 1.37 1.51 -1.26 -0.58 117.35 117.75 3hkz s TYR 97 Ca 0.30 -0.31 -0.03 0.00 -1.01 0.00 0.00 57.07 56.02 3hkz s TYR 97 Cb -0.09 -0.80 0.05 0.00 -0.11 0.00 0.00 41.96 41.01 3hkz s TYR 97 CO 0.22 0.02 0.13 0.42 -1.11 0.00 0.00 175.55 175.22 3hkz s ILE 98 N -0.64 -0.19 -0.41 2.71 1.09 -1.02 -1.33 121.20 121.42 3hkz s ILE 98 Ca 0.04 0.20 0.08 0.00 -1.10 0.00 0.00 60.65 59.86 3hkz s ILE 98 Cb -0.07 -0.37 0.25 0.00 -1.06 0.00 0.00 42.46 41.21 3hkz s ILE 98 CO 0.01 0.01 0.53 -0.62 -0.10 0.00 0.00 174.94 174.77 3hkz n GLU 99 N 5.31 0.80 -3.77 2.79 1.02 -1.26 -2.08 120.64 123.45 3hkz n GLU 99 Ca -0.05 -3.30 -0.21 0.00 -0.02 0.00 0.00 57.16 53.58 3hkz n GLU 99 Cb 0.50 -1.28 -0.04 0.00 -0.02 0.00 0.00 31.44 30.60 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 -1.22 3.87 0.07 0.62 0.00 -1.11 -4.96 121.76 119.03 3hkz s ALA 100 Ca 0.35 -1.73 -0.05 0.00 0.00 0.00 0.00 51.96 50.54 3hkz s ALA 100 Cb 0.17 -1.10 -0.02 0.00 0.00 0.00 0.00 23.12 22.17 3hkz s ALA 100 CO -0.11 -0.05 0.08 -2.00 0.00 0.00 0.00 175.76 173.68 3hkz s GLU 101 N -4.02 0.72 -0.32 0.00 2.12 -1.26 -2.07 118.70 113.87 3hkz s GLU 101 Ca 0.43 -1.09 -0.11 0.00 0.36 0.00 0.00 54.97 54.55 3hkz s GLU 101 Cb -0.05 0.27 -0.01 0.00 0.26 0.00 0.00 34.13 34.60 3hkz s GLU 101 CO 0.27 -0.19 0.19 0.00 -0.54 0.00 0.00 175.26 174.99 3hkz s ALA 102 N -3.89 3.37 0.00 6.30 0.00 -0.83 -5.02 121.76 121.70 3hkz s ALA 102 Ca 0.06 -1.38 0.00 0.00 0.00 0.00 0.00 51.96 50.64 3hkz s ALA 102 Cb 0.06 -2.50 0.00 0.00 0.00 0.00 0.00 23.12 20.69 3hkz s ALA 102 CO -0.10 -0.92 0.35 -0.35 0.00 0.00 0.00 175.76 174.73 3hkz n PRO 103 N 5.03 0.00 -2.63 0.00 -0.04 -1.26 -3.31 135.00 132.79 3hkz n PRO 103 Ca -0.13 0.27 -0.01 0.00 -0.04 0.00 0.00 63.50 63.59 3hkz n PRO 103 Cb 0.49 -1.00 0.08 0.00 -0.04 0.00 0.00 33.50 33.04 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 -1.30 0.13 -3.51 3.54 2.85 -1.26 -4.52 115.26 111.18 3hkz n ASN 104 Ca 0.00 -2.10 -0.17 0.00 -0.11 0.00 0.00 54.58 52.20 3hkz n ASN 104 Cb 0.00 0.06 -0.05 0.00 1.24 0.00 0.00 39.78 41.03 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 -1.79 1.08 0.46 1.20 -1.05 -1.26 -4.98 118.70 112.36 3hkz s GLU 105 Ca 0.18 0.09 -0.21 0.00 -0.15 0.00 0.00 54.97 54.88 3hkz s GLU 105 Cb 0.37 0.51 -0.09 0.00 -0.44 0.00 0.00 34.13 34.48 3hkz s GLU 105 CO -0.08 -0.37 1.04 -2.14 0.95 0.00 0.00 175.26 174.66 3hkz s PRO 106 N -1.71 3.92 -0.17 -4.83 0.02 -1.26 -1.24 135.00 129.72 3hkz s PRO 106 Ca -0.09 1.39 -0.11 0.00 0.02 0.00 0.00 61.00 62.21 3hkz s PRO 106 Cb -0.00 -2.21 0.06 0.00 0.02 0.00 0.00 34.50 32.36 3hkz s PRO 106 CO 0.05 -0.33 0.43 0.50 -0.33 0.00 0.00 177.00 177.32 3hkz s ARG 107 N -3.04 0.43 -0.28 5.54 3.52 0.47 -4.86 118.95 120.73 3hkz s ARG 107 Ca 0.65 0.77 -0.14 0.00 -0.13 0.00 0.00 55.73 56.88 3hkz s ARG 107 Cb -0.17 0.04 -0.04 0.00 -1.56 0.00 0.00 34.95 33.22 3hkz s ARG 107 CO 0.21 -0.14 0.33 1.41 -0.81 0.00 0.00 175.30 176.30 3hkz s MET 108 N 1.18 3.97 0.57 5.12 -2.45 -1.26 0.20 119.30 126.63 3hkz s MET 108 Ca -0.08 -0.08 -0.17 0.00 -1.25 0.00 0.00 55.69 54.11 3hkz s MET 108 Cb -0.07 -3.67 -0.05 0.00 1.25 0.00 0.00 34.83 32.30 3hkz s MET 108 CO -0.10 -0.27 1.07 0.42 1.05 0.00 0.00 175.02 177.19 3hkz s ILE 109 N 1.99 3.63 0.34 10.11 -1.09 0.15 -4.95 121.20 131.37 3hkz s ILE 109 Ca 0.13 0.86 0.04 0.00 -2.23 0.00 0.00 60.65 59.44 3hkz s ILE 109 Cb -0.16 -3.34 -0.04 0.00 -1.58 0.00 0.00 42.46 37.34 3hkz s ILE 109 CO 0.10 -0.37 0.14 -0.31 -1.23 0.00 0.00 174.94 173.27 3hkz s TYR 110 N -2.23 1.72 -0.03 3.97 1.51 -1.26 -1.37 117.35 119.66 3hkz s TYR 110 Ca 0.66 -1.29 0.31 0.00 -1.01 0.00 0.00 57.07 55.74 3hkz s TYR 110 Cb -0.18 -1.02 1.20 0.00 -0.11 0.00 0.00 41.96 41.86 3hkz s TYR 110 CO 0.32 -0.38 1.91 0.66 -1.11 0.00 0.00 175.55 176.95 3hkz h SER 111 N 2.05 0.00 -0.42 2.29 4.64 -1.58 -2.44 113.55 118.09 3hkz h SER 111 Ca -0.35 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 60.94 3hkz h SER 111 Cb 1.26 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.32 3hkz h SER 111 CO 0.56 0.00 0.16 0.07 -0.87 0.00 0.00 176.83 176.75 3hkz h LYS 112 N 0.00 0.70 -0.69 4.77 2.10 -1.83 -2.84 116.57 118.78 3hkz h LYS 112 Ca 0.00 -0.11 0.00 0.00 -2.00 0.00 0.00 60.65 58.54 3hkz h LYS 112 Cb 0.56 -0.12 0.00 0.00 -0.90 0.00 0.00 32.23 31.77 3hkz h LYS 112 CO 0.00 0.60 0.00 -0.25 -2.00 0.00 0.00 179.45 177.80 3hkz n ASP 113 N -4.33 0.69 -4.64 7.07 8.00 -0.92 -4.72 116.55 117.70 3hkz n ASP 113 Ca 0.04 -1.63 -0.38 0.00 0.71 0.00 0.00 54.79 53.53 3hkz n ASP 113 Cb 0.18 -0.34 -0.09 0.00 -0.02 0.00 0.00 41.12 40.84 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 -1.16 5.28 -0.02 0.53 1.09 -1.07 -4.56 121.20 121.29 3hkz s ILE 114 Ca 0.00 0.36 -0.23 0.00 -1.10 0.00 0.00 60.65 59.68 3hkz s ILE 114 Cb 0.00 -3.59 -0.21 0.00 -1.06 0.00 0.00 42.46 37.60 3hkz s ILE 114 CO 0.00 0.27 1.13 0.11 -0.10 0.00 0.00 174.94 176.35 3hkz h LYS 115 N 7.75 0.23 0.00 2.79 1.57 -1.49 -3.47 116.57 123.95 3hkz h LYS 115 Ca -0.36 -0.20 0.00 0.00 -1.87 0.00 0.00 60.65 58.22 3hkz h LYS 115 Cb 1.17 0.05 0.00 0.00 0.08 0.00 0.00 32.23 33.53 3hkz h LYS 115 CO 0.65 0.87 0.00 0.45 -0.57 0.00 0.00 179.45 180.85 3hkz n SER 116 N -4.51 0.00 0.00 0.86 2.88 -1.26 -4.77 113.62 106.82 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 0.47 -0.03 0.00 0.00 -0.75 0.00 0.00 64.21 63.90 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 -0.80 0.00 -2.41 -1.46 2.13 -1.26 -4.54 120.64 112.30 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 6.09 0.00 4.31 3.68 -1.26 -4.89 116.67 124.60 3hkz s ASP 118 Ca 0.00 0.15 0.07 0.00 2.13 0.00 0.00 52.55 54.90 3hkz s ASP 118 Cb 0.00 -2.55 0.40 0.00 -1.45 0.00 0.00 42.92 39.32 3hkz s ASP 118 CO 0.00 -1.76 0.89 -0.81 0.13 0.00 0.00 175.17 173.62 3hkz n PRO 119 N 8.81 0.20 0.00 4.34 -0.04 -1.26 -1.43 135.00 145.61 3hkz n PRO 119 Ca 0.11 0.03 0.13 0.00 -0.04 0.00 0.00 63.50 63.73 3hkz n PRO 119 Cb 0.49 -1.50 0.45 0.00 -0.04 0.00 0.00 33.50 32.90 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 -1.04 0.33 -3.64 3.54 3.41 -1.26 -4.64 113.62 110.32 3hkz n SER 120 Ca 0.05 -0.04 -0.29 0.00 -0.26 0.00 0.00 58.87 58.33 3hkz n SER 120 Cb 0.03 -0.08 -0.12 0.00 -0.26 0.00 0.00 64.21 63.77 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 -2.90 1.25 0.20 -3.33 1.01 -0.51 -4.69 120.40 111.43 3hkz s VAL 121 Ca 0.15 -2.73 0.09 0.00 0.00 0.00 0.00 61.98 59.49 3hkz s VAL 121 Cb 0.19 -1.86 -0.04 0.00 0.00 0.00 0.00 36.38 34.66 3hkz s VAL 121 CO 0.60 -1.00 -0.18 0.68 0.00 0.00 0.00 175.10 175.20 3hkz s VAL 122 N 0.10 2.01 0.52 2.92 -7.23 -1.26 -4.84 120.40 112.62 3hkz s VAL 122 Ca 0.22 -2.11 -0.20 0.00 -1.81 0.00 0.00 61.98 58.09 3hkz s VAL 122 Cb -0.15 -2.02 -0.10 0.00 0.56 0.00 0.00 36.38 34.67 3hkz s VAL 122 CO -0.06 -0.38 0.57 -2.65 -0.31 0.00 0.00 175.10 172.27 3hkz n PRO 123 N -0.07 0.60 0.00 4.82 -0.02 -1.26 -2.84 135.00 136.23 3hkz n PRO 123 Ca -0.10 0.23 0.15 0.00 -2.02 0.00 0.00 63.50 61.76 3hkz n PRO 123 Cb 0.58 -1.68 0.77 0.00 -0.02 0.00 0.00 33.50 33.15 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 -1.39 0.01 -3.16 4.25 -6.64 -1.19 -4.49 119.36 106.75 3hkz n ILE 124 Ca 0.11 0.00 0.03 0.00 -1.77 0.00 0.00 62.75 61.13 3hkz n ILE 124 Cb 0.45 -0.51 -0.01 0.00 -1.44 0.00 0.00 39.64 38.14 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 -2.53 -1.47 -0.68 7.28 0.15 -1.26 -5.05 113.70 110.14 3hkz s SER 125 Ca 0.30 0.41 -0.07 0.00 0.70 0.00 0.00 55.95 57.29 3hkz s SER 125 Cb 0.20 2.04 -0.06 0.00 -1.71 0.00 0.00 66.02 66.50 3hkz s SER 125 CO 0.45 -0.29 1.84 0.61 1.20 0.00 0.00 173.24 177.05 3hkz n GLY 126 N 5.42 2.67 0.00 9.45 0.00 -1.26 -3.03 105.19 118.44 3hkz n GLY 126 Ca 0.03 -0.72 0.00 0.00 0.00 0.00 0.00 46.02 45.33 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 4.88 0.00 -4.70 1.61 2.03 -1.26 -3.76 116.55 115.35 3hkz n ASP 127 Ca 0.36 -0.83 -0.35 0.00 0.52 0.00 0.00 54.79 54.49 3hkz n ASP 127 Cb 0.14 0.00 -0.09 0.00 -0.72 0.00 0.00 41.12 40.46 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 5.20 -0.34 5.18 1.01 -1.17 -4.91 121.20 126.16 3hkz s ILE 128 Ca 0.00 0.11 -0.29 0.00 0.00 0.00 0.00 60.65 60.48 3hkz s ILE 128 Cb 0.00 -3.36 -0.01 0.00 0.01 0.00 0.00 42.46 39.10 3hkz s ILE 128 CO 0.00 0.44 1.60 -2.16 0.00 0.00 0.00 174.94 174.82 3hkz s PRO 129 N 0.38 3.53 -0.04 2.79 0.04 -1.26 -1.63 135.00 138.80 3hkz s PRO 129 Ca 0.06 1.27 -0.09 0.00 0.04 0.00 0.00 61.00 62.29 3hkz s PRO 129 Cb -0.12 -4.09 -0.05 0.00 0.04 0.00 0.00 34.50 30.29 3hkz s PRO 129 CO -0.01 -1.62 0.43 0.82 0.04 0.00 0.00 177.00 176.66 3hkz h ILE 130 N 6.53 0.00 -3.18 0.56 1.08 -1.51 -3.49 117.51 117.50 3hkz h ILE 130 Ca -0.31 -0.57 -0.03 0.00 -0.39 0.00 0.00 64.86 63.56 3hkz h ILE 130 Cb 1.14 0.00 -0.03 0.00 -3.07 0.00 0.00 36.82 34.86 3hkz h ILE 130 CO 1.05 0.00 0.18 0.54 -0.69 0.00 0.00 178.15 179.23 3hkz s VAL 131 N -2.61 0.00 -0.18 1.67 0.11 -1.23 -5.01 120.40 113.16 3hkz s VAL 131 Ca -0.05 -1.10 -0.05 0.00 -2.93 0.00 0.00 61.98 57.86 3hkz s VAL 131 Cb 0.00 -2.61 -0.03 0.00 -1.53 0.00 0.00 36.38 32.22 3hkz s VAL 131 CO 0.14 0.00 -0.01 -0.22 -3.33 0.00 0.00 175.10 171.68 3hkz s LEU 132 N -3.05 3.32 -0.31 2.54 1.98 -1.26 -0.68 118.68 121.21 3hkz s LEU 132 Ca 0.17 -0.13 -0.05 0.00 -2.89 0.00 0.00 54.13 51.22 3hkz s LEU 132 Cb -0.04 -1.82 0.03 0.00 0.66 0.00 0.00 46.19 45.02 3hkz s LEU 132 CO 0.11 0.13 0.07 -0.76 -1.89 0.00 0.00 176.35 174.01 3hkz s LEU 133 N 0.61 3.99 -0.24 -0.68 1.43 0.54 -4.34 118.68 119.99 3hkz s LEU 133 Ca -0.01 -0.99 -0.12 0.00 -1.03 0.00 0.00 54.13 51.98 3hkz s LEU 133 Cb -0.14 -1.83 -0.05 0.00 0.03 0.00 0.00 46.19 44.20 3hkz s LEU 133 CO 0.02 -0.25 0.25 -0.83 0.23 0.00 0.00 176.35 175.77 3hkz s GLY 134 N 1.41 1.99 0.00 -3.19 0.00 -1.26 0.18 107.32 106.44 3hkz s GLY 134 Ca -0.01 -0.82 0.00 0.00 0.00 0.00 0.00 44.72 43.90 3hkz s GLY 134 CO 0.01 0.60 0.00 -1.30 0.00 0.00 0.00 173.10 172.42 3hkz n THR 135 N 4.50 0.00 -1.42 0.90 -2.24 -0.37 -2.29 114.28 113.36 3hkz n THR 135 Ca -0.12 0.00 -0.13 0.00 -2.27 0.00 0.00 64.05 61.52 3hkz n THR 135 Cb 0.52 0.00 -0.05 0.00 -2.10 0.00 0.00 70.33 68.69 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 0.58 -4.58 -4.97 3.42 4.13 -1.21 -5.00 115.26 107.62 3hkz n ASN 136 Ca 0.00 0.32 -0.21 0.00 1.68 0.00 0.00 54.58 56.37 3hkz n ASN 136 Cb 0.00 -3.28 -0.01 0.00 -1.54 0.00 0.00 39.78 34.95 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 -3.19 3.30 -0.25 3.52 -0.21 -0.97 -5.00 119.66 116.87 3hkz s GLN 137 Ca 0.00 -0.79 -0.14 0.00 0.02 0.00 0.00 55.36 54.45 3hkz s GLN 137 Cb 0.00 -2.82 0.08 0.00 1.00 0.00 0.00 33.01 31.27 3hkz s GLN 137 CO 0.00 0.22 0.60 0.21 -2.12 0.00 0.00 175.29 174.20 3hkz s LYS 138 N -4.12 0.60 -0.14 2.91 2.20 -1.26 -1.96 119.74 117.97 3hkz s LYS 138 Ca 0.40 1.10 -0.01 0.00 -0.36 0.00 0.00 55.97 57.09 3hkz s LYS 138 Cb -0.09 0.11 -0.02 0.00 -1.51 0.00 0.00 37.83 36.32 3hkz s LYS 138 CO 0.31 -0.16 -0.10 0.42 -0.36 0.00 0.00 175.35 175.46 3hkz s ILE 139 N 1.62 3.30 -0.34 5.43 1.01 -0.88 -3.40 121.20 127.93 3hkz s ILE 139 Ca -0.10 -0.57 -0.00 0.00 0.00 0.00 0.00 60.65 59.98 3hkz s ILE 139 Cb -0.06 -2.40 0.11 0.00 0.01 0.00 0.00 42.46 40.11 3hkz s ILE 139 CO -0.18 0.52 0.14 -0.55 0.00 0.00 0.00 174.94 174.87 3hkz s SER 140 N 0.34 3.80 0.05 3.58 0.15 0.44 -2.75 113.70 119.32 3hkz s SER 140 Ca -0.09 -1.86 -0.00 0.00 0.70 0.00 0.00 55.95 54.70 3hkz s SER 140 Cb -0.15 -0.80 -0.04 0.00 -1.71 0.00 0.00 66.02 63.32 3hkz s SER 140 CO 0.05 -0.38 -0.04 -1.48 1.20 0.00 0.00 173.24 172.59 3hkz s LEU 141 N 1.35 2.43 -0.17 3.45 0.05 -0.88 -1.43 118.68 123.47 3hkz s LEU 141 Ca 0.12 -0.87 -0.04 0.00 0.05 0.00 0.00 54.13 53.39 3hkz s LEU 141 Cb -0.19 0.12 0.07 0.00 -2.05 0.00 0.00 46.19 44.13 3hkz s LEU 141 CO -0.18 -0.49 0.13 -0.70 -0.55 0.00 0.00 176.35 174.55 3hkz s GLU 142 N -3.25 0.09 0.00 1.48 2.12 -0.50 -2.43 118.70 116.21 3hkz s GLU 142 Ca 0.02 0.07 0.00 0.00 0.36 0.00 0.00 54.97 55.42 3hkz s GLU 142 Cb 0.03 -1.47 0.00 0.00 0.26 0.00 0.00 34.13 32.94 3hkz s GLU 142 CO -0.07 -0.62 0.00 0.00 -0.54 0.00 0.00 175.26 174.03 3hkz n ALA 143 N 5.30 0.00 -3.50 6.30 0.00 0.25 0.39 120.51 129.24 3hkz n ALA 143 Ca -0.06 0.00 -0.12 0.00 0.00 0.00 0.00 53.44 53.26 3hkz n ALA 143 Cb 0.49 0.00 -0.04 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 0.84 0.95 0.01 0.00 3.52 0.63 -4.00 118.95 120.91 3hkz s ARG 144 Ca 0.00 -0.12 0.00 0.00 -0.13 0.00 0.00 55.73 55.48 3hkz s ARG 144 Cb 0.00 0.44 -0.01 0.00 -1.56 0.00 0.00 34.95 33.82 3hkz s ARG 144 CO 0.00 -0.37 -0.02 -0.51 -0.81 0.00 0.00 175.30 173.59 3hkz s LEU 145 N -1.98 2.13 0.27 -0.88 1.02 -1.26 -2.00 118.68 115.99 3hkz s LEU 145 Ca -0.01 -0.28 0.02 0.00 0.02 0.00 0.00 54.13 53.87 3hkz s LEU 145 Cb -0.01 0.03 -0.03 0.00 0.02 0.00 0.00 46.19 46.21 3hkz s LEU 145 CO -0.03 -0.16 0.25 0.00 0.02 0.00 0.00 176.35 176.42 3hkz s ARG 146 N -0.82 1.53 0.63 1.70 1.70 -0.68 -2.84 118.95 120.17 3hkz s ARG 146 Ca -0.09 -1.79 -0.11 0.00 -0.47 0.00 0.00 55.73 53.27 3hkz s ARG 146 Cb -0.06 0.32 -0.03 0.00 -0.57 0.00 0.00 34.95 34.61 3hkz s ARG 146 CO -0.01 -0.56 1.04 -0.51 -1.08 0.00 0.00 175.30 174.18 3hkz s LEU 147 N -3.25 3.22 0.00 -1.89 1.43 -1.26 -1.88 118.68 115.06 3hkz s LEU 147 Ca 0.38 1.47 -0.28 0.00 -1.03 0.00 0.00 54.13 54.67 3hkz s LEU 147 Cb 0.04 -4.48 0.08 0.00 0.03 0.00 0.00 46.19 41.86 3hkz s LEU 147 CO 0.20 -0.98 0.70 -0.83 0.23 0.00 0.00 176.35 175.66 3hkz s GLY 148 N -4.05 -0.55 0.44 -3.19 0.00 -0.81 -4.69 107.32 94.48 3hkz s GLY 148 Ca 0.56 1.13 -0.06 0.00 0.00 0.00 0.00 44.72 46.35 3hkz s GLY 148 CO 0.53 0.70 0.75 -0.19 0.00 0.00 0.00 173.10 174.89 3hkz s TYR 149 N -2.04 3.53 0.01 1.90 1.51 -1.26 -2.16 117.35 118.85 3hkz s TYR 149 Ca -0.06 0.83 -0.03 0.00 -1.01 0.00 0.00 57.07 56.81 3hkz s TYR 149 Cb -0.00 -2.30 -0.01 0.00 -0.11 0.00 0.00 41.96 39.54 3hkz s TYR 149 CO 0.01 -0.19 1.04 0.78 -1.11 0.00 0.00 175.55 176.09 3hkz h GLY 150 N 0.59 -1.68 0.21 0.71 0.00 0.21 -2.57 103.07 100.55 3hkz h GLY 150 Ca -0.47 0.74 0.20 0.00 0.00 0.00 0.00 47.33 47.80 3hkz h GLY 150 CO 0.62 -0.62 0.61 1.70 0.00 0.00 0.00 176.54 178.86 3hkz h LYS 151 N -0.04 0.55 0.00 4.80 1.63 -1.77 -3.07 116.57 118.67 3hkz h LYS 151 Ca 0.00 -0.03 0.00 0.00 -0.85 0.00 0.00 60.65 59.77 3hkz h LYS 151 Cb 0.05 -0.12 0.00 0.00 -0.60 0.00 0.00 32.23 31.56 3hkz h LYS 151 CO -0.04 0.36 0.00 -1.91 -3.45 0.00 0.00 179.45 174.41 3hkz n GLU 152 N -4.61 0.00 -2.21 1.90 2.13 -0.97 -4.28 120.64 112.61 3hkz n GLU 152 Ca 0.21 0.03 0.00 0.00 0.66 0.00 0.00 57.16 58.06 3hkz n GLU 152 Cb 0.65 -0.32 0.04 0.00 0.27 0.00 0.00 31.44 32.09 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 -0.08 0.84 0.00 4.31 8.25 -1.25 -5.03 115.22 122.27 3hkz n HIS 153 Ca 0.00 -1.52 0.00 0.00 -0.26 0.00 0.00 57.72 55.94 3hkz n HIS 153 Cb 0.00 -0.21 0.00 0.00 1.12 0.00 0.00 29.99 30.90 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 -0.23 0.00 0.70 -1.41 0.00 -1.16 -4.41 120.51 114.00 3hkz n ALA 154 Ca 0.10 0.00 0.12 0.00 0.00 0.00 0.00 53.44 53.66 3hkz n ALA 154 Cb 0.93 0.00 0.25 0.00 0.00 0.00 0.00 19.45 20.63 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 -0.87 0.20 0.00 0.00 -0.00 -1.26 -3.59 118.16 112.64 3hkz n LYS 155 Ca 0.00 0.08 0.14 0.00 -0.00 0.00 0.00 58.31 58.53 3hkz n LYS 155 Cb 0.00 -1.65 0.66 0.00 -0.00 0.00 0.00 35.03 34.05 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 -1.95 0.00 -1.70 5.58 0.99 -1.26 -4.90 117.46 114.22 3hkz n PHE 156 Ca 0.04 0.00 -0.44 0.00 -0.00 0.00 0.00 57.45 57.05 3hkz n PHE 156 Cb 0.41 -0.30 -0.03 0.00 -1.00 0.00 0.00 39.48 38.56 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 -1.25 0.24 0.06 4.37 5.41 -1.24 -3.89 119.36 123.07 3hkz n ILE 157 Ca 0.12 -0.06 -0.00 0.00 1.00 0.00 0.00 62.75 63.81 3hkz n ILE 157 Cb 0.28 -1.76 -0.06 0.00 -0.71 0.00 0.00 39.64 37.39 3hkz n ILE 157 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 176.55 178.10 3hkz h PRO 158 N 5.90 0.00 -4.47 0.38 0.13 -1.81 -3.49 132.00 128.65 3hkz h PRO 158 Ca -0.44 0.00 -0.40 0.00 -0.87 0.00 0.00 66.00 64.29 3hkz h PRO 158 Cb 1.23 0.00 -0.30 0.00 0.13 0.00 0.00 31.00 32.06 3hkz h PRO 158 CO 0.89 0.39 -0.78 0.54 -0.23 0.00 0.00 178.00 178.81 3hkz s VAL 159 N -2.91 0.65 -0.43 1.56 0.11 -1.26 -2.81 120.40 115.31 3hkz s VAL 159 Ca -0.01 -0.30 0.05 0.00 -2.93 0.00 0.00 61.98 58.79 3hkz s VAL 159 Cb 0.08 -0.59 0.67 0.00 -1.53 0.00 0.00 36.38 35.01 3hkz s VAL 159 CO 0.79 0.21 1.89 -1.54 -3.33 0.00 0.00 175.10 173.13 3hkz n SER 160 N 3.27 3.85 -3.59 3.54 3.41 -0.93 -4.84 113.62 118.34 3hkz n SER 160 Ca -0.18 -3.54 -0.08 0.00 -0.26 0.00 0.00 58.87 54.82 3hkz n SER 160 Cb 0.55 -0.83 -0.04 0.00 -0.26 0.00 0.00 64.21 63.63 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 -3.21 -0.26 0.00 1.04 2.96 -1.25 -4.87 118.68 113.09 3hkz s LEU 161 Ca 0.56 0.23 0.00 0.00 -0.22 0.00 0.00 54.13 54.70 3hkz s LEU 161 Cb 0.47 1.63 0.00 0.00 0.50 0.00 0.00 46.19 48.79 3hkz s LEU 161 CO 0.11 -0.28 0.53 -1.20 -1.32 0.00 0.00 176.35 174.19 3hkz n SER 162 N 0.50 -0.43 -4.61 3.68 7.64 -1.22 -4.03 113.62 115.15 3hkz n SER 162 Ca -0.06 -1.07 -0.50 0.00 1.01 0.00 0.00 58.87 58.25 3hkz n SER 162 Cb 0.58 0.13 -0.05 0.00 -1.01 0.00 0.00 64.21 63.87 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 0.30 -4.04 0.44 0.31 -1.24 -4.74 118.33 109.36 3hkz n VAL 163 Ca -0.12 -0.07 -0.33 0.00 -0.01 0.00 0.00 64.34 63.80 3hkz n VAL 163 Cb 0.47 -0.99 -0.15 0.00 -0.91 0.00 0.00 33.84 32.26 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 0.34 2.40 0.10 2.52 1.01 -1.26 -2.84 120.40 122.67 3hkz s VAL 164 Ca 0.79 -1.32 0.09 0.00 0.00 0.00 0.00 61.98 61.54 3hkz s VAL 164 Cb -0.86 -2.28 -0.03 0.00 0.00 0.00 0.00 36.38 33.20 3hkz s VAL 164 CO 0.47 0.13 -0.23 0.00 0.00 0.00 0.00 175.10 175.48 3hkz s ARG 165 N 1.21 1.25 0.41 2.72 1.04 -1.02 -4.99 118.95 119.57 3hkz s ARG 165 Ca -0.04 -1.18 -0.26 0.00 -1.04 0.00 0.00 55.73 53.21 3hkz s ARG 165 Cb -0.18 -1.56 -0.09 0.00 -2.04 0.00 0.00 34.95 31.08 3hkz s ARG 165 CO -0.06 0.37 1.38 0.71 -0.04 0.00 0.00 175.30 177.66 3hkz s TYR 166 N -1.08 2.68 0.01 5.89 2.02 -1.26 -1.92 117.35 123.69 3hkz s TYR 166 Ca 0.09 1.31 -0.30 0.00 -0.37 0.00 0.00 57.07 57.80 3hkz s TYR 166 Cb -0.10 -3.83 -0.03 0.00 -0.40 0.00 0.00 41.96 37.60 3hkz s TYR 166 CO 0.04 -2.53 1.00 -0.47 -1.57 0.00 0.00 175.55 172.02 3hkz s TYR 167 N -1.20 3.65 0.18 2.71 5.04 -0.97 -4.83 117.35 121.94 3hkz s TYR 167 Ca 0.56 1.68 0.04 0.00 -2.44 0.00 0.00 57.07 56.91 3hkz s TYR 167 Cb -0.42 -3.14 -0.03 0.00 0.35 0.00 0.00 41.96 38.72 3hkz s TYR 167 CO 0.55 -0.09 0.28 -1.25 -1.34 0.00 0.00 175.55 173.70 3hkz s PRO 168 N 0.94 3.35 -0.26 4.97 0.04 -1.26 -2.32 135.00 140.46 3hkz s PRO 168 Ca 0.52 -0.69 -0.03 0.00 0.04 0.00 0.00 61.00 60.84 3hkz s PRO 168 Cb -0.22 -2.89 0.02 0.00 0.04 0.00 0.00 34.50 31.46 3hkz s PRO 168 CO 0.28 0.49 -0.03 0.15 0.04 0.00 0.00 177.00 177.93 3hkz s LYS 169 N -3.43 2.85 -0.33 4.56 -0.14 0.19 -4.79 119.74 118.66 3hkz s LYS 169 Ca 0.34 -0.97 -0.05 0.00 -1.36 0.00 0.00 55.97 53.93 3hkz s LYS 169 Cb -0.10 -3.06 0.04 0.00 -1.68 0.00 0.00 37.83 33.03 3hkz s LYS 169 CO 0.28 -0.42 0.07 0.08 -0.76 0.00 0.00 175.35 174.59 3hkz s VAL 170 N 1.35 3.47 0.30 3.17 1.01 -1.26 -2.91 120.40 125.53 3hkz s VAL 170 Ca 0.00 -1.24 0.08 0.00 0.00 0.00 0.00 61.98 60.82 3hkz s VAL 170 Cb -0.17 -2.98 -0.04 0.00 0.00 0.00 0.00 36.38 33.19 3hkz s VAL 170 CO -0.03 -0.16 0.16 -1.61 0.00 0.00 0.00 175.10 173.46 3hkz s GLU 171 N 1.34 2.56 -0.07 2.72 2.02 -1.06 -5.03 118.70 121.19 3hkz s GLU 171 Ca -0.03 -1.35 0.04 0.00 0.02 0.00 0.00 54.97 53.66 3hkz s GLU 171 Cb -0.20 -2.33 -0.00 0.00 0.10 0.00 0.00 34.13 31.70 3hkz s GLU 171 CO 0.01 0.22 -0.21 0.42 0.02 0.00 0.00 175.26 175.73 3hkz s ILE 172 N -2.31 1.76 0.00 -1.63 1.09 -1.26 -3.54 121.20 115.32 3hkz s ILE 172 Ca 0.36 -0.88 0.00 0.00 -1.10 0.00 0.00 60.65 59.03 3hkz s ILE 172 Cb -0.05 -1.52 0.00 0.00 -1.06 0.00 0.00 42.46 39.83 3hkz s ILE 172 CO 0.23 0.50 0.20 0.18 -0.10 0.00 0.00 174.94 175.95 3hkz n LEU 173 N 3.28 0.40 -3.67 2.97 4.77 0.18 -5.00 117.00 119.94 3hkz n LEU 173 Ca -0.19 -0.63 -0.04 0.00 -0.03 0.00 0.00 56.01 55.12 3hkz n LEU 173 Cb 0.52 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.60 3hkz n LEU 173 CO 0.26 0.10 0.75 0.00 -1.33 0.00 0.00 177.39 177.17 3hkz s ALA 174 N -0.46 -1.77 -0.42 -1.18 0.00 -1.25 -5.05 121.76 111.63 3hkz s ALA 174 Ca 0.00 0.47 -0.27 0.00 0.00 0.00 0.00 51.96 52.16 3hkz s ALA 174 Cb 0.00 0.53 0.02 0.00 0.00 0.00 0.00 23.12 23.67 3hkz s ALA 174 CO 0.00 -0.93 0.98 1.21 0.00 0.00 0.00 175.76 177.02 3hkz s ASN 175 N -2.79 6.62 -0.24 0.00 2.47 -1.26 -4.97 114.94 114.76 3hkz s ASN 175 Ca 0.10 0.42 -0.02 0.00 0.42 0.00 0.00 52.86 53.79 3hkz s ASN 175 Cb -0.01 -2.48 0.02 0.00 -1.45 0.00 0.00 41.25 37.33 3hkz s ASN 175 CO -0.02 -1.02 -0.07 0.00 -3.72 0.00 0.00 177.10 172.28 3hkz n GLU 177 N 4.67 0.00 0.09 0.00 -0.58 -1.26 -3.34 120.64 120.23 3hkz n GLU 177 Ca -0.17 0.47 0.10 0.00 -0.42 0.00 0.00 57.16 57.15 3hkz n GLU 177 Cb 0.47 -1.27 0.44 0.00 -0.57 0.00 0.00 31.44 30.51 3hkz n GLU 177 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 3hkz n LYS 178 N -1.62 0.14 -0.46 3.49 5.02 -1.26 -3.77 118.16 119.69 3hkz n LYS 178 Ca 0.00 0.38 0.36 0.00 -2.02 0.00 0.00 58.31 57.02 3hkz n LYS 178 Cb 0.00 -1.77 0.56 0.00 -0.02 0.00 0.00 35.03 33.81 3hkz n LYS 178 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3hkz n ALA 179 N -1.70 1.25 -0.02 7.82 0.00 -1.21 0.54 120.51 127.20 3hkz n ALA 179 Ca 0.02 0.53 -0.16 0.00 0.00 0.00 0.00 53.44 53.83 3hkz n ALA 179 Cb 0.21 -0.81 -0.11 0.00 0.00 0.00 0.00 19.45 18.75 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 1.46 0.00 0.00 2.07 -1.82 -3.29 116.25 114.67 3hkz h VAL 180 Ca 0.67 -1.94 -0.18 0.00 0.82 0.00 0.00 66.70 66.07 3hkz h VAL 180 Cb 2.52 2.57 -0.03 0.00 -1.52 0.00 0.00 31.29 34.84 3hkz h VAL 180 CO -0.11 0.55 -0.88 0.78 0.02 0.00 0.00 177.57 177.93 3hkz h ASN 181 N -0.24 0.00 0.27 0.57 2.35 -0.20 -3.34 115.58 114.99 3hkz h ASN 181 Ca -0.05 0.00 -0.24 0.00 -0.55 0.00 0.00 56.30 55.46 3hkz h ASN 181 Cb 1.12 0.00 0.01 0.00 0.05 0.00 0.00 38.32 39.50 3hkz h ASN 181 CO 0.08 0.88 -1.00 -0.37 -1.65 0.00 0.00 177.43 175.37 3hkz h VAL 182 N 0.00 1.37 -3.28 2.81 -1.51 -1.56 -3.43 116.25 110.65 3hkz h VAL 182 Ca -0.01 -2.44 -0.59 0.00 -1.23 0.00 0.00 66.70 62.43 3hkz h VAL 182 Cb 1.57 2.46 -0.09 0.00 -2.13 0.00 0.00 31.29 33.10 3hkz h VAL 182 CO 0.11 0.73 0.48 0.00 -1.23 0.00 0.00 177.57 177.67 3hkz n PRO 184 N 6.00 4.29 0.00 0.00 -0.04 -1.26 -4.05 135.00 139.94 3hkz n PRO 184 Ca 0.06 -2.65 0.09 0.00 -0.04 0.00 0.00 63.50 60.95 3hkz n PRO 184 Cb 0.47 -2.15 0.04 0.00 -0.04 0.00 0.00 33.50 31.83 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 0.53 1.56 -3.11 0.54 -0.58 -1.26 -5.00 120.64 113.32 3hkz n GLU 185 Ca 0.23 -1.28 -0.12 0.00 -0.42 0.00 0.00 57.16 55.58 3hkz n GLU 185 Cb 1.05 -1.33 0.05 0.00 -0.57 0.00 0.00 31.44 30.64 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 1.10 -1.06 0.40 0.62 0.00 -1.26 -4.84 105.19 100.16 3hkz n GLY 186 Ca 0.09 0.52 -0.17 0.00 0.00 0.00 0.00 46.02 46.46 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 -2.88 1.16 -2.98 1.61 0.31 -1.26 -4.29 118.33 110.01 3hkz n VAL 187 Ca -0.05 -0.13 -0.42 0.00 -0.01 0.00 0.00 64.34 63.73 3hkz n VAL 187 Cb 0.59 -1.86 -0.05 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 3.20 -0.30 3.52 0.40 -1.26 -1.82 117.98 119.29 3hkz s PHE 188 Ca -0.25 0.75 -0.05 0.00 -0.60 0.00 0.00 56.93 56.78 3hkz s PHE 188 Cb 0.08 -3.18 0.02 0.00 0.51 0.00 0.00 43.02 40.45 3hkz s PHE 188 CO 0.33 -0.56 0.05 -2.00 0.70 0.00 0.00 175.22 173.74 3hkz s GLU 189 N 2.89 2.87 -0.20 0.44 2.12 -1.11 -4.74 118.70 120.98 3hkz s GLU 189 Ca 0.31 -0.99 -0.12 0.00 0.36 0.00 0.00 54.97 54.52 3hkz s GLU 189 Cb -0.14 -3.30 -0.05 0.00 0.26 0.00 0.00 34.13 30.90 3hkz s GLU 189 CO 0.13 -0.50 0.23 -0.51 -0.54 0.00 0.00 175.26 174.06 3hkz s LEU 190 N 1.42 4.19 -0.99 2.70 1.43 -1.25 -3.76 118.68 122.42 3hkz s LEU 190 Ca 0.00 0.33 -0.01 0.00 -1.03 0.00 0.00 54.13 53.43 3hkz s LEU 190 Cb -0.18 -2.25 0.33 0.00 0.03 0.00 0.00 46.19 44.12 3hkz s LEU 190 CO 0.01 0.09 1.84 0.29 0.23 0.00 0.00 176.35 178.81 3hkz n LYS 191 N 3.87 5.02 -2.72 1.70 5.02 -1.24 -4.81 118.16 125.00 3hkz n LYS 191 Ca -0.13 -4.50 -0.02 0.00 -2.02 0.00 0.00 58.31 51.64 3hkz n LYS 191 Cb 0.52 -2.44 0.00 0.00 -0.02 0.00 0.00 35.03 33.09 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 -0.14 -6.78 -0.28 4.39 2.03 -1.26 -4.44 116.55 110.08 3hkz n ASP 192 Ca 0.48 0.10 0.00 0.00 0.52 0.00 0.00 54.79 55.89 3hkz n ASP 192 Cb 0.26 -4.55 0.00 0.00 -0.72 0.00 0.00 41.12 36.11 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 -1.22 0.73 2.75 0.27 0.00 -1.26 -5.06 105.19 101.39 3hkz n GLY 193 Ca 0.03 -0.75 -0.30 0.00 0.00 0.00 0.00 46.02 45.00 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 -4.45 0.81 0.00 1.61 1.02 -1.26 -5.02 119.74 112.44 3hkz s LYS 194 Ca 0.00 -1.22 0.00 0.00 0.02 0.00 0.00 55.97 54.77 3hkz s LYS 194 Cb 0.00 -2.09 0.00 0.00 -0.52 0.00 0.00 37.83 35.22 3hkz s LYS 194 CO 0.00 -1.00 0.52 1.28 -0.92 0.00 0.00 175.35 175.23 3hkz n LEU 195 N 4.67 1.20 -4.39 3.17 4.77 -1.26 -3.60 117.00 121.55 3hkz n LEU 195 Ca -0.00 -0.60 -0.36 0.00 -0.03 0.00 0.00 56.01 55.02 3hkz n LEU 195 Cb 0.41 -0.45 0.07 0.00 -2.33 0.00 0.00 43.42 41.13 3hkz n LEU 195 CO 0.13 0.26 -0.16 -1.54 -1.33 0.00 0.00 177.39 174.76 3hkz n SER 196 N 0.14 -2.02 -4.25 -1.43 3.41 -1.25 -4.72 113.62 103.50 3hkz n SER 196 Ca 0.00 0.52 -0.43 0.00 -0.26 0.00 0.00 58.87 58.70 3hkz n SER 196 Cb 0.26 -1.14 -0.07 0.00 -0.26 0.00 0.00 64.21 63.00 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 -2.00 4.65 0.16 -3.33 1.01 -1.26 -2.74 120.40 116.88 3hkz s VAL 197 Ca 0.61 -1.69 -0.09 0.00 0.00 0.00 0.00 61.98 60.81 3hkz s VAL 197 Cb -0.32 -4.02 -0.03 0.00 0.00 0.00 0.00 36.38 32.01 3hkz s VAL 197 CO 0.63 -0.82 1.51 0.50 0.00 0.00 0.00 175.10 176.92 3hkz h LYS 198 N 8.61 0.89 -3.59 2.72 3.64 -1.69 -3.39 116.57 123.76 3hkz h LYS 198 Ca -0.24 -0.45 -0.60 0.00 -1.27 0.00 0.00 60.65 58.09 3hkz h LYS 198 Cb 1.08 0.01 -0.40 0.00 -0.41 0.00 0.00 32.23 32.51 3hkz h LYS 198 CO 0.93 1.10 -0.75 -0.80 -2.27 0.00 0.00 179.45 177.67 3hkz s ASN 199 N -6.82 4.06 0.10 4.20 0.01 -1.21 -4.94 114.94 110.34 3hkz s ASN 199 Ca -0.10 -1.95 0.01 0.00 -0.71 0.00 0.00 52.86 50.11 3hkz s ASN 199 Cb 0.12 -1.02 -0.22 0.00 0.41 0.00 0.00 41.25 40.53 3hkz s ASN 199 CO 0.87 -0.38 1.23 -0.08 -1.51 0.00 0.00 177.10 177.23 3hkz h GLU 200 N 7.70 0.14 0.00 -0.60 4.81 -1.88 -3.30 114.58 121.46 3hkz h GLU 200 Ca -0.09 -0.23 0.00 0.00 -0.13 0.00 0.00 59.36 58.90 3hkz h GLU 200 Cb 0.99 0.09 0.00 0.00 0.63 0.00 0.00 28.75 30.46 3hkz h GLU 200 CO 0.48 1.10 0.00 1.28 -0.73 0.00 0.00 179.01 181.14 3hkz n LEU 201 N -3.46 0.00 -0.10 1.64 4.77 -1.26 -3.60 117.00 114.99 3hkz n LEU 201 Ca -0.04 0.00 -0.13 0.00 -0.03 0.00 0.00 56.01 55.80 3hkz n LEU 201 Cb 0.96 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 42.01 3hkz n LEU 201 CO 0.50 0.00 -0.81 -1.20 -1.33 0.00 0.00 177.39 174.55 3hkz n SER 202 N -0.98 1.93 -4.41 -1.43 7.64 -1.24 -5.04 113.62 110.08 3hkz n SER 202 Ca 0.08 0.36 -0.39 0.00 1.01 0.00 0.00 58.87 59.93 3hkz n SER 202 Cb 0.04 -0.78 0.02 0.00 -1.01 0.00 0.00 64.21 62.48 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 -1.73 -0.83 0.00 0.00 -4.23 -1.26 -4.55 115.64 103.05 3hkz s THR 204 Ca 0.64 0.00 0.00 0.00 -1.18 0.00 0.00 61.69 61.15 3hkz s THR 204 Cb -0.50 -1.00 0.00 0.00 1.34 0.00 0.00 72.50 72.34 3hkz s THR 204 CO 0.58 0.00 0.00 -0.11 -0.54 0.00 0.00 174.62 174.55 3hkz n LEU 205 N 5.26 0.00 0.00 4.79 7.94 -1.26 -4.60 117.00 129.13 3hkz n LEU 205 Ca -0.12 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.78 3hkz n LEU 205 Cb 0.50 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.45 3hkz n LEU 205 CO -0.04 0.00 0.00 0.00 -1.11 0.00 0.00 177.39 176.24 3hkz n GLU 207 N 0.00 0.00 -0.24 0.00 1.02 -1.26 -4.95 120.64 115.21 3hkz n GLU 207 Ca 0.00 0.13 -0.05 0.00 -0.02 0.00 0.00 57.16 57.21 3hkz n GLU 207 Cb 0.00 -2.90 0.09 0.00 -0.02 0.00 0.00 31.44 28.61 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 0.96 1.08 -0.44 3.49 4.39 -1.94 -2.30 114.58 119.82 3hkz h GLU 208 Ca 0.00 -0.23 0.05 0.00 0.34 0.00 0.00 59.36 59.53 3hkz h GLU 208 Cb 0.00 -0.16 -0.05 0.00 -0.10 0.00 0.00 28.75 28.44 3hkz h GLU 208 CO 0.00 0.93 0.16 0.00 -1.16 0.00 0.00 179.01 178.94 3hkz h LEU 210 N 0.34 0.91 -1.97 0.00 3.38 -1.80 0.59 115.31 116.76 3hkz h LEU 210 Ca 0.21 0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.19 3hkz h LEU 210 Cb 0.19 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 40.76 3hkz h LEU 210 CO -0.20 0.57 0.00 -0.09 0.09 0.00 0.00 178.44 178.81 3hkz h ARG 211 N 1.03 0.00 0.00 1.13 2.43 -0.96 -3.19 114.38 114.81 3hkz h ARG 211 Ca 0.40 0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 59.56 3hkz h ARG 211 Cb 0.24 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 29.79 3hkz h ARG 211 CO -0.16 0.00 -1.16 0.66 -1.51 0.00 0.00 179.97 177.80 3hkz n TYR 212 N -2.66 0.00 -0.47 2.20 4.02 0.20 -4.77 117.16 115.68 3hkz n TYR 212 Ca -0.01 0.00 0.10 0.00 -0.01 0.00 0.00 57.90 57.97 3hkz n TYR 212 Cb 0.10 -0.09 0.31 0.00 -0.02 0.00 0.00 39.34 39.64 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 1.21 -5.41 -1.44 0.00 4.05 -1.25 -0.78 115.26 111.64 3hkz n ASN 214 Ca 0.23 0.10 -0.13 0.00 0.45 0.00 0.00 54.58 55.23 3hkz n ASN 214 Cb 0.72 -4.56 -0.01 0.00 1.23 0.00 0.00 39.78 37.15 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 -0.88 -0.06 0.09 8.20 0.00 -1.26 -4.91 105.19 106.38 3hkz n GLY 215 Ca -0.22 -0.35 0.13 0.00 0.00 0.00 0.00 46.02 45.58 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 -0.45 0.73 -4.24 1.61 7.64 0.04 -4.52 113.62 114.44 3hkz n SER 216 Ca -0.15 0.48 -0.35 0.00 1.01 0.00 0.00 58.87 59.85 3hkz n SER 216 Cb 0.60 -0.59 -0.14 0.00 -1.01 0.00 0.00 64.21 63.07 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 -3.10 3.17 -0.12 0.44 1.01 -1.26 -0.64 121.20 120.69 3hkz s ILE 217 Ca 0.10 -0.96 -0.18 0.00 0.00 0.00 0.00 60.65 59.61 3hkz s ILE 217 Cb 0.13 -2.63 -0.04 0.00 0.01 0.00 0.00 42.46 39.93 3hkz s ILE 217 CO 0.62 0.15 0.49 -0.60 0.00 0.00 0.00 174.94 175.60 3hkz s ARG 218 N 1.37 4.33 -0.43 2.79 3.52 -1.23 -4.85 118.95 124.44 3hkz s ARG 218 Ca 0.00 0.46 0.03 0.00 -0.13 0.00 0.00 55.73 56.09 3hkz s ARG 218 Cb -0.17 -3.45 0.12 0.00 -1.56 0.00 0.00 34.95 29.90 3hkz s ARG 218 CO -0.02 0.13 0.20 0.42 -0.81 0.00 0.00 175.30 175.21 3hkz s ILE 219 N 0.72 1.82 0.45 4.11 1.01 -1.26 -2.55 121.20 125.50 3hkz s ILE 219 Ca 0.26 -2.62 0.08 0.00 0.00 0.00 0.00 60.65 58.38 3hkz s ILE 219 Cb -0.15 -2.29 0.02 0.00 0.01 0.00 0.00 42.46 40.04 3hkz s ILE 219 CO 0.10 -0.80 0.55 -0.94 0.00 0.00 0.00 174.94 173.86 3hkz s SER 220 N 0.39 5.39 -0.11 3.58 1.04 -1.15 -4.93 113.70 117.91 3hkz s SER 220 Ca 0.15 -0.60 0.02 0.00 0.48 0.00 0.00 55.95 56.01 3hkz s SER 220 Cb -0.23 -0.44 -0.01 0.00 0.10 0.00 0.00 66.02 65.43 3hkz s SER 220 CO -0.04 -0.84 -0.18 -0.36 0.98 0.00 0.00 173.24 172.80 3hkz s PHE 221 N -2.45 2.69 0.06 5.02 0.40 -1.26 -0.63 117.98 121.81 3hkz s PHE 221 Ca 0.54 -0.77 -0.31 0.00 -0.60 0.00 0.00 56.93 55.79 3hkz s PHE 221 Cb -0.07 -1.77 -0.08 0.00 0.51 0.00 0.00 43.02 41.60 3hkz s PHE 221 CO 0.32 -0.27 1.69 0.08 0.70 0.00 0.00 175.22 177.75 3hkz s VAL 222 N 0.26 3.03 -0.39 -0.44 1.01 -0.98 -4.85 120.40 118.05 3hkz s VAL 222 Ca -0.12 0.43 -0.33 0.00 0.00 0.00 0.00 61.98 61.96 3hkz s VAL 222 Cb -0.16 -3.27 -0.11 0.00 0.00 0.00 0.00 36.38 32.84 3hkz s VAL 222 CO 0.07 -0.01 2.26 -0.62 0.00 0.00 0.00 175.10 176.80 3hkz n GLU 223 N 5.89 1.12 -2.38 2.72 1.02 -1.26 -2.38 120.64 125.37 3hkz n GLU 223 Ca 0.16 0.27 -0.10 0.00 -0.02 0.00 0.00 57.16 57.47 3hkz n GLU 223 Cb 0.40 -2.63 0.01 0.00 -0.02 0.00 0.00 31.44 29.20 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 10.93 -3.43 -4.28 1.62 8.00 -1.26 -4.58 116.55 123.54 3hkz n ASP 224 Ca 0.41 -0.07 -0.33 0.00 0.71 0.00 0.00 54.79 55.51 3hkz n ASP 224 Cb 0.29 -2.53 -0.15 0.00 -0.02 0.00 0.00 41.12 38.71 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 -4.76 3.23 0.08 -1.24 1.02 -1.00 0.15 119.74 117.22 3hkz s LYS 225 Ca 0.07 -0.76 0.03 0.00 0.02 0.00 0.00 55.97 55.33 3hkz s LYS 225 Cb -0.03 -2.57 -0.03 0.00 -0.52 0.00 0.00 37.83 34.67 3hkz s LYS 225 CO 0.08 0.09 -0.09 0.71 -0.92 0.00 0.00 175.35 175.22 3hkz s TYR 226 N 0.63 0.90 -0.19 3.18 1.51 -0.44 -2.29 117.35 120.66 3hkz s TYR 226 Ca -0.09 -0.63 -0.02 0.00 -1.01 0.00 0.00 57.07 55.32 3hkz s TYR 226 Cb -0.16 -0.51 -0.01 0.00 -0.11 0.00 0.00 41.96 41.17 3hkz s TYR 226 CO 0.03 -0.05 -0.08 0.42 -1.11 0.00 0.00 175.55 174.75 3hkz s ILE 227 N -2.20 3.12 0.36 2.71 1.01 -0.81 -0.45 121.20 124.94 3hkz s ILE 227 Ca 0.01 -0.59 -0.07 0.00 0.00 0.00 0.00 60.65 60.00 3hkz s ILE 227 Cb -0.04 -2.38 -0.05 0.00 0.01 0.00 0.00 42.46 39.99 3hkz s ILE 227 CO -0.01 0.46 0.66 -0.22 0.00 0.00 0.00 174.94 175.84 3hkz s LEU 228 N 1.18 3.92 -0.38 2.97 2.96 -0.60 -2.43 118.68 126.30 3hkz s LEU 228 Ca 0.02 0.88 0.04 0.00 -0.22 0.00 0.00 54.13 54.85 3hkz s LEU 228 Cb -0.14 -3.74 0.16 0.00 0.50 0.00 0.00 46.19 42.97 3hkz s LEU 228 CO -0.03 -0.32 0.44 -1.61 -1.32 0.00 0.00 176.35 173.51 3hkz s GLU 229 N -3.85 0.68 -0.05 1.98 2.02 -1.13 -2.26 118.70 116.08 3hkz s GLU 229 Ca 0.47 -0.70 -0.17 0.00 0.02 0.00 0.00 54.97 54.58 3hkz s GLU 229 Cb -0.10 -0.53 -0.05 0.00 0.10 0.00 0.00 34.13 33.55 3hkz s GLU 229 CO 0.33 -1.19 0.46 0.42 0.02 0.00 0.00 175.26 175.29 3hkz s ILE 230 N 1.55 5.08 -0.29 -1.63 -1.09 -0.59 -3.38 121.20 120.86 3hkz s ILE 230 Ca 0.17 0.93 -0.04 0.00 -2.23 0.00 0.00 60.65 59.48 3hkz s ILE 230 Cb -0.13 -3.78 0.10 0.00 -1.58 0.00 0.00 42.46 37.07 3hkz s ILE 230 CO -0.05 0.45 0.13 -0.70 -1.23 0.00 0.00 174.94 173.54 3hkz s GLU 231 N -0.20 0.21 0.74 2.79 2.12 -1.26 -0.89 118.70 122.21 3hkz s GLU 231 Ca 0.25 -0.54 -0.15 0.00 0.36 0.00 0.00 54.97 54.90 3hkz s GLU 231 Cb -0.16 -1.21 0.05 0.00 0.26 0.00 0.00 34.13 33.06 3hkz s GLU 231 CO 0.12 -1.01 1.22 0.45 -0.54 0.00 0.00 175.26 175.51 3hkz s SER 232 N 2.08 4.05 0.43 -1.70 0.15 -1.26 -2.18 113.70 115.28 3hkz s SER 232 Ca 0.09 2.41 0.25 0.00 0.70 0.00 0.00 55.95 59.39 3hkz s SER 232 Cb -0.16 -2.59 0.56 0.00 -1.71 0.00 0.00 66.02 62.12 3hkz s SER 232 CO -0.36 -2.36 1.69 -0.37 1.20 0.00 0.00 173.24 173.04 3hkz h VAL 233 N -0.36 0.00 0.00 4.45 -1.51 -1.84 -3.44 116.25 113.55 3hkz h VAL 233 Ca -0.48 -0.85 0.00 0.00 -1.23 0.00 0.00 66.70 64.14 3hkz h VAL 233 Cb 1.30 1.84 0.00 0.00 -2.13 0.00 0.00 31.29 32.31 3hkz h VAL 233 CO 0.49 0.00 0.00 0.61 -1.23 0.00 0.00 177.57 177.44 3hkz n GLY 234 N 0.93 1.55 0.05 5.19 0.00 -1.26 -5.04 105.19 106.62 3hkz n GLY 234 Ca 0.04 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.93 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 0.03 -2.67 1.61 0.02 -1.81 -3.43 113.55 107.29 3hkz h SER 235 Ca 0.00 -0.18 -0.61 0.00 -0.84 0.00 0.00 61.79 60.16 3hkz h SER 235 Cb 0.00 -0.01 -0.13 0.00 0.14 0.00 0.00 62.40 62.40 3hkz h SER 235 CO 0.00 0.20 -0.71 -0.76 -1.14 0.00 0.00 176.83 174.42 3hkz s LEU 236 N -9.82 2.93 0.29 5.07 1.02 -1.26 -2.70 118.68 114.20 3hkz s LEU 236 Ca -0.14 -0.69 -0.29 0.00 0.02 0.00 0.00 54.13 53.03 3hkz s LEU 236 Cb 0.05 -1.55 -0.10 0.00 0.02 0.00 0.00 46.19 44.61 3hkz s LEU 236 CO 0.67 0.07 1.14 -0.54 0.02 0.00 0.00 176.35 177.71 3hkz s LYS 237 N -3.16 4.58 0.05 1.70 1.02 -1.26 -4.83 119.74 117.85 3hkz s LYS 237 Ca 0.27 1.88 -0.09 0.00 0.02 0.00 0.00 55.97 58.05 3hkz s LYS 237 Cb -0.07 -3.17 -0.02 0.00 -0.52 0.00 0.00 37.83 34.05 3hkz s LYS 237 CO 0.16 0.13 1.13 -0.35 -0.92 0.00 0.00 175.35 175.50 3hkz n PRO 238 N 1.15 -0.13 0.28 -1.68 -0.04 -1.26 -1.66 135.00 131.66 3hkz n PRO 238 Ca -0.01 1.12 0.12 0.00 -0.04 0.00 0.00 63.50 64.69 3hkz n PRO 238 Cb 0.44 -1.67 0.79 0.00 -0.04 0.00 0.00 33.50 33.02 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 0.00 -0.91 0.54 9.09 -1.93 -0.23 114.58 121.14 3hkz h GLU 239 Ca 0.05 0.00 0.04 0.00 0.05 0.00 0.00 59.36 59.50 3hkz h GLU 239 Cb 0.12 0.00 -0.06 0.00 -1.65 0.00 0.00 28.75 27.17 3hkz h GLU 239 CO -0.28 0.02 0.59 -0.09 0.05 0.00 0.00 179.01 179.29 3hkz h ARG 240 N 0.00 1.09 0.36 1.06 9.65 -1.71 0.10 114.38 124.93 3hkz h ARG 240 Ca -0.00 -0.07 -0.02 0.00 -1.10 0.00 0.00 59.98 58.80 3hkz h ARG 240 Cb 0.04 -0.24 0.00 0.00 -1.39 0.00 0.00 29.97 28.38 3hkz h ARG 240 CO 0.00 0.72 -0.17 0.82 2.80 0.00 0.00 179.97 184.14 3hkz h ILE 241 N 1.12 0.66 -0.74 1.20 2.04 -0.97 0.15 117.51 120.98 3hkz h ILE 241 Ca 0.37 -0.15 0.13 0.00 1.00 0.00 0.00 64.86 66.22 3hkz h ILE 241 Cb 0.06 0.74 -0.09 0.00 -0.74 0.00 0.00 36.82 36.78 3hkz h ILE 241 CO -0.14 0.03 0.30 -0.07 0.00 0.00 0.00 178.15 178.28 3hkz h LEU 242 N -0.56 0.30 -0.72 1.44 3.38 -1.42 0.59 115.31 118.31 3hkz h LEU 242 Ca -0.05 0.10 -0.04 0.00 0.09 0.00 0.00 57.88 57.98 3hkz h LEU 242 Cb 0.42 0.07 -0.03 0.00 0.09 0.00 0.00 40.66 41.21 3hkz h LEU 242 CO 0.08 0.13 0.30 0.25 0.09 0.00 0.00 178.44 179.29 3hkz h LEU 243 N 0.46 0.99 -0.00 1.67 5.85 -0.54 -1.22 115.31 122.52 3hkz h LEU 243 Ca 0.40 -0.16 -0.00 0.00 0.84 0.00 0.00 57.88 58.95 3hkz h LEU 243 Cb 0.57 -0.26 -0.00 0.00 0.37 0.00 0.00 40.66 41.35 3hkz h LEU 243 CO -0.38 0.88 -0.00 -0.33 -0.34 0.00 0.00 178.44 178.27 3hkz h GLU 244 N 1.03 0.00 -0.73 1.25 4.39 0.08 -2.93 114.58 117.68 3hkz h GLU 244 Ca 0.24 -0.00 0.15 0.00 0.34 0.00 0.00 59.36 60.09 3hkz h GLU 244 Cb 0.19 0.00 -0.13 0.00 -0.10 0.00 0.00 28.75 28.70 3hkz h GLU 244 CO -0.02 0.55 -0.12 0.00 -1.16 0.00 0.00 179.01 178.26 3hkz h ALA 245 N 0.45 0.57 -0.18 3.43 0.00 0.17 0.19 119.26 123.89 3hkz h ALA 245 Ca 0.00 0.27 0.05 0.00 0.00 0.00 0.00 54.91 55.23 3hkz h ALA 245 Cb 0.55 0.50 -0.06 0.00 0.00 0.00 0.00 17.79 18.78 3hkz h ALA 245 CO 0.00 -0.42 -0.26 0.78 0.00 0.00 0.00 179.25 179.35 3hkz h GLY 246 N 0.03 -0.26 2.00 0.00 0.00 -1.21 -3.03 103.07 100.60 3hkz h GLY 246 Ca 0.37 0.32 0.00 0.00 0.00 0.00 0.00 47.33 48.02 3hkz h GLY 246 CO -0.71 -0.20 0.00 0.50 0.00 0.00 0.00 176.54 176.12 3hkz h LYS 247 N -0.30 0.00 -0.70 4.80 1.57 -0.53 -2.57 116.57 118.83 3hkz h LYS 247 Ca 0.11 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.90 3hkz h LYS 247 Cb 0.48 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.75 3hkz h LYS 247 CO -0.35 0.00 0.45 0.66 -0.57 0.00 0.00 179.45 179.64 3hkz h SER 248 N 0.00 0.82 0.73 0.86 4.64 -0.88 -1.65 113.55 118.07 3hkz h SER 248 Ca 0.00 -0.03 -0.04 0.00 -0.47 0.00 0.00 61.79 61.25 3hkz h SER 248 Cb 0.78 -0.21 0.01 0.00 -0.31 0.00 0.00 62.40 62.67 3hkz h SER 248 CO 0.00 0.61 -0.35 0.40 -0.87 0.00 0.00 176.83 176.62 3hkz h ILE 249 N 0.96 0.25 -0.82 0.95 2.04 -1.54 -0.20 117.51 119.15 3hkz h ILE 249 Ca 0.26 -0.07 0.09 0.00 1.00 0.00 0.00 64.86 66.13 3hkz h ILE 249 Cb -0.08 0.28 -0.07 0.00 -0.74 0.00 0.00 36.82 36.21 3hkz h ILE 249 CO -0.05 0.01 0.47 0.40 0.00 0.00 0.00 178.15 178.98 3hkz h ILE 250 N -1.03 0.94 -0.97 -0.67 2.04 -1.62 1.60 117.51 117.79 3hkz h ILE 250 Ca -0.10 -0.28 0.03 0.00 1.00 0.00 0.00 64.86 65.52 3hkz h ILE 250 Cb 0.76 0.05 -0.06 0.00 -0.74 0.00 0.00 36.82 36.84 3hkz h ILE 250 CO 0.16 0.15 0.63 -0.09 0.00 0.00 0.00 178.15 179.01 3hkz h ARG 251 N 0.81 1.20 0.14 2.37 2.43 -1.22 -2.37 114.38 117.74 3hkz h ARG 251 Ca 0.38 -0.07 -0.18 0.00 -0.81 0.00 0.00 59.98 59.30 3hkz h ARG 251 Cb 0.31 -0.27 0.02 0.00 -0.42 0.00 0.00 29.97 29.62 3hkz h ARG 251 CO -0.23 0.79 -0.80 0.87 -1.51 0.00 0.00 179.97 179.09 3hkz h LYS 252 N 1.23 0.30 0.29 0.20 1.57 0.11 -3.09 116.57 117.18 3hkz h LYS 252 Ca 0.38 -0.51 -0.01 0.00 -1.87 0.00 0.00 60.65 58.64 3hkz h LYS 252 Cb -0.01 0.19 0.00 0.00 0.08 0.00 0.00 32.23 32.49 3hkz h LYS 252 CO -0.12 1.24 -0.14 0.97 -0.57 0.00 0.00 179.45 180.83 3hkz h ILE 253 N -0.38 0.73 0.00 1.86 6.09 0.22 0.75 117.51 126.78 3hkz h ILE 253 Ca -0.14 -0.07 -0.03 0.00 -1.37 0.00 0.00 64.86 63.24 3hkz h ILE 253 Cb 1.64 0.77 -0.00 0.00 0.47 0.00 0.00 36.82 39.69 3hkz h ILE 253 CO 0.15 0.02 -0.15 -0.33 -3.07 0.00 0.00 178.15 174.77 3hkz h GLU 254 N -0.43 0.00 -0.05 2.19 5.08 -1.61 0.29 114.58 120.06 3hkz h GLU 254 Ca -0.04 0.00 -0.25 0.00 -1.00 0.00 0.00 59.36 58.07 3hkz h GLU 254 Cb 0.33 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.59 3hkz h GLU 254 CO 0.07 0.15 -0.94 1.49 -1.00 0.00 0.00 179.01 178.77 3hkz h GLU 255 N 0.00 0.68 0.40 2.33 4.81 -1.27 -2.27 114.58 119.26 3hkz h GLU 255 Ca -0.00 -0.67 -0.02 0.00 -0.13 0.00 0.00 59.36 58.54 3hkz h GLU 255 Cb 0.37 0.17 0.00 0.00 0.63 0.00 0.00 28.75 29.93 3hkz h GLU 255 CO 0.02 1.26 -0.20 1.25 -0.73 0.00 0.00 179.01 180.61 3hkz h LEU 256 N 0.41 -0.47 0.00 1.64 5.85 0.15 -1.88 115.31 121.01 3hkz h LEU 256 Ca -0.10 0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.64 3hkz h LEU 256 Cb 1.58 0.12 0.00 0.00 0.37 0.00 0.00 40.66 42.74 3hkz h LEU 256 CO 0.18 -0.33 0.00 1.21 -0.34 0.00 0.00 178.44 179.16 3hkz n GLU 257 N -3.48 0.00 -0.04 1.25 2.13 -0.01 0.40 120.64 120.89 3hkz n GLU 257 Ca -0.07 0.60 -0.14 0.00 0.66 0.00 0.00 57.16 58.22 3hkz n GLU 257 Cb 0.22 -0.91 -0.08 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 -0.50 0.00 5.31 3.11 -1.49 0.32 116.57 123.32 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 0.00 -0.33 0.01 1.63 -2.81 0.00 0.00 179.45 177.95 3hkz n LYS 259 N -5.43 0.13 -0.05 1.90 5.02 -0.30 -1.45 118.16 117.99 3hkz n LYS 259 Ca -0.05 0.63 -0.20 0.00 -2.02 0.00 0.00 58.31 56.68 3hkz n LYS 259 Cb 0.37 -1.96 -0.13 0.00 -0.02 0.00 0.00 35.03 33.29 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 0.16 0.00 -0.35 6.46 0.36 -3.24 115.31 118.70 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 0.03 -0.05 0.00 0.00 -0.73 0.00 0.00 40.66 39.90 3hkz h LEU 260 CO 0.00 1.43 0.00 1.33 -0.62 0.00 0.00 178.44 180.58 3hkz n VAL 261 N -4.26 0.27 0.01 1.05 0.24 -0.05 0.08 118.33 115.66 3hkz n VAL 261 Ca -0.24 0.07 0.08 0.00 -2.04 0.00 0.00 64.34 62.21 3hkz n VAL 261 Cb 0.73 -0.80 -0.12 0.00 -1.47 0.00 0.00 33.84 32.18 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 -1.14 0.65 -0.10 7.34 1.02 -1.11 -4.68 120.64 122.61 3hkz n GLU 262 Ca 0.10 -0.07 -0.12 0.00 -0.02 0.00 0.00 57.16 57.05 3hkz n GLU 262 Cb 0.09 -1.61 -0.13 0.00 -0.02 0.00 0.00 31.44 29.77 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 -2.45 1.29 -3.11 2.62 0.31 0.11 -4.94 118.33 112.16 3hkz n VAL 263 Ca -0.06 -0.67 -0.39 0.00 -0.01 0.00 0.00 64.34 63.20 3hkz n VAL 263 Cb 0.64 -0.84 -0.06 0.00 -0.91 0.00 0.00 33.84 32.68 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 -2.45 4.67 -0.46 2.52 1.01 0.31 -5.09 120.40 120.91 3hkz s VAL 264 Ca -0.18 1.46 0.04 0.00 0.00 0.00 0.00 61.98 63.29 3hkz s VAL 264 Cb 0.07 -4.02 0.03 0.00 0.00 0.00 0.00 36.38 32.45 3hkz s VAL 264 CO 0.67 0.47 0.62 0.29 0.00 0.00 0.00 175.10 177.14