#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hkb n ASP 5 N 0.00 4.81 0.06 0.00 -0.08 -1.26 -5.02 116.55 115.05 3hkb n ASP 5 Ca 0.00 -3.33 -0.03 0.00 -1.51 0.00 0.00 54.79 49.93 3hkb n ASP 5 Cb 0.00 -1.00 -0.01 0.00 2.34 0.00 0.00 41.12 42.44 3hkb n ASP 5 CO 0.00 0.00 0.00 0.24 0.12 0.00 0.00 177.20 177.56 3hkb h MET 6 N 5.22 -0.16 -6.25 -0.67 2.86 -1.89 -3.45 114.93 110.59 3hkb h MET 6 Ca 0.19 0.01 -0.31 0.00 -2.06 0.00 0.00 59.70 57.53 3hkb h MET 6 Cb 0.70 0.04 0.00 0.00 0.06 0.00 0.00 31.60 32.40 3hkb h MET 6 CO 1.01 -0.11 -0.83 -0.85 1.06 0.00 0.00 176.91 177.19 3hkb n GLU 7 N -2.63 -1.68 -2.92 1.72 0.28 -1.26 -4.35 120.64 109.79 3hkb n GLU 7 Ca -0.02 1.22 -0.43 0.00 -0.16 0.00 0.00 57.16 57.77 3hkb n GLU 7 Cb 0.07 -3.34 -0.04 0.00 1.43 0.00 0.00 31.44 29.56 3hkb n GLU 7 CO 0.00 0.00 0.00 0.14 -0.16 0.00 0.00 177.13 177.11 3hkb s VAL 8 N -2.59 4.46 -0.66 3.84 -7.23 -1.26 -3.61 120.40 113.35 3hkb s VAL 8 Ca 0.12 -0.40 -0.22 0.00 -1.81 0.00 0.00 61.98 59.67 3hkb s VAL 8 Cb -0.02 -4.60 0.07 0.00 0.56 0.00 0.00 36.38 32.40 3hkb s VAL 8 CO 0.85 -1.30 0.96 -0.63 -0.31 0.00 0.00 175.10 174.67 3hkb s ILE 9 N 3.69 4.34 -0.86 -0.62 1.01 -0.23 -4.86 121.20 123.66 3hkb s ILE 9 Ca 0.21 -0.39 -0.25 0.00 0.00 0.00 0.00 60.65 60.22 3hkb s ILE 9 Cb -0.18 -4.68 0.00 0.00 0.01 0.00 0.00 42.46 37.61 3hkb s ILE 9 CO 0.11 -1.46 1.67 -1.61 0.00 0.00 0.00 174.94 173.65 3hkb s GLU 10 N 4.03 3.00 -1.28 2.79 8.01 -1.26 -2.43 118.70 131.55 3hkb s GLU 10 Ca 0.22 -0.38 -0.17 0.00 0.01 0.00 0.00 54.97 54.65 3hkb s GLU 10 Cb -0.17 -4.89 0.10 0.00 -4.31 0.00 0.00 34.13 24.86 3hkb s GLU 10 CO 0.10 -2.69 1.67 1.47 0.01 0.00 0.00 175.26 175.82 3hkb n LEU 11 N 11.40 5.07 0.00 1.80 -0.00 -1.25 -4.84 117.00 129.18 3hkb n LEU 11 Ca 0.28 -4.08 0.00 0.00 -0.00 0.00 0.00 56.01 52.22 3hkb n LEU 11 Cb 0.49 -1.71 0.00 0.00 -0.00 0.00 0.00 43.42 42.20 3hkb n LEU 11 CO 0.66 0.33 0.00 -3.20 -0.00 0.00 0.00 177.39 175.18 3hkb n ASN 12 N 7.58 0.00 -4.32 1.45 2.85 -1.26 -4.36 115.26 117.19 3hkb n ASN 12 Ca 0.46 0.00 -0.30 0.00 -0.11 0.00 0.00 54.58 54.63 3hkb n ASN 12 Cb 0.45 0.00 -0.15 0.00 1.24 0.00 0.00 39.78 41.32 3hkb n ASN 12 CO 0.00 0.00 0.00 -0.75 -2.11 0.00 0.00 177.26 174.40 3hkb s LYS 13 N -4.96 1.83 0.36 1.20 2.20 -1.26 -0.82 119.74 118.29 3hkb s LYS 13 Ca 0.00 -1.04 0.04 0.00 -0.36 0.00 0.00 55.97 54.61 3hkb s LYS 13 Cb 0.00 -1.94 -0.03 0.00 -1.51 0.00 0.00 37.83 34.36 3hkb s LYS 13 CO 0.00 0.51 0.17 0.00 -0.36 0.00 0.00 175.35 175.67 3hkb h THR 15 N 1.98 1.29 -0.03 0.00 1.03 -2.04 -3.30 112.91 111.83 3hkb h THR 15 Ca -0.33 -1.57 -0.14 0.00 -0.01 0.00 0.00 66.41 64.36 3hkb h THR 15 Cb 1.26 1.48 -0.29 0.00 -1.07 0.00 0.00 68.15 69.52 3hkb h THR 15 CO 0.51 0.51 -0.90 -1.54 -0.01 0.00 0.00 175.52 174.09 3hkb n SER 16 N -4.04 1.25 0.00 0.00 3.41 -1.26 -5.09 113.62 107.89 3hkb n SER 16 Ca -0.02 -2.50 0.00 0.00 -0.26 0.00 0.00 58.87 56.09 3hkb n SER 16 Cb 0.53 -0.36 0.00 0.00 -0.26 0.00 0.00 64.21 64.12 3hkb n SER 16 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3hkb n GLY 17 N 0.04 3.74 0.00 5.00 0.00 -1.25 -5.16 105.19 107.57 3hkb n GLY 17 Ca 0.10 -0.67 0.00 0.00 0.00 0.00 0.00 46.02 45.44 3hkb n GLY 17 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 3hkb n GLN 18 N 0.00 0.00 -4.12 1.61 7.27 -1.26 -3.70 117.38 117.18 3hkb n GLN 18 Ca 0.00 0.00 -0.22 0.00 0.07 0.00 0.00 57.00 56.85 3hkb n GLN 18 Cb 0.00 0.00 -0.06 0.00 2.41 0.00 0.00 30.24 32.59 3hkb n GLN 18 CO 0.00 0.00 0.00 -1.12 0.07 0.00 0.00 177.06 176.01 3hkb s SER 19 N 0.00 4.99 -0.17 1.69 0.01 0.00 -5.01 113.70 115.22 3hkb s SER 19 Ca 0.00 -0.53 -0.31 0.00 1.31 0.00 0.00 55.95 56.43 3hkb s SER 19 Cb 0.00 -1.01 0.14 0.00 0.21 0.00 0.00 66.02 65.35 3hkb s SER 19 CO 0.00 -0.13 1.09 0.72 0.41 0.00 0.00 173.24 175.33 3hkb s PHE 20 N -2.28 -0.26 -0.02 2.43 -0.12 -1.26 -3.75 117.98 112.71 3hkb s PHE 20 Ca 0.35 0.36 0.08 0.00 -0.05 0.00 0.00 56.93 57.66 3hkb s PHE 20 Cb -0.06 0.48 -0.02 0.00 -0.63 0.00 0.00 43.02 42.80 3hkb s PHE 20 CO 0.23 -0.29 -0.25 -1.83 -0.05 0.00 0.00 175.22 173.03 3hkb s GLU 21 N -1.64 2.08 -0.90 1.99 -1.05 -1.02 -4.82 118.70 113.34 3hkb s GLU 21 Ca 0.03 -0.90 -0.01 0.00 -0.15 0.00 0.00 54.97 53.94 3hkb s GLU 21 Cb -0.01 -1.99 0.23 0.00 -0.44 0.00 0.00 34.13 31.93 3hkb s GLU 21 CO -0.03 0.53 0.84 1.55 0.95 0.00 0.00 175.26 179.10 3hkb n VAL 22 N 2.50 3.16 -1.68 1.83 3.14 -1.26 -1.07 118.33 124.95 3hkb n VAL 22 Ca -0.16 -5.18 -0.42 0.00 -2.96 0.00 0.00 64.34 55.62 3hkb n VAL 22 Cb 0.51 -2.35 -0.03 0.00 -1.06 0.00 0.00 33.84 30.92 3hkb n VAL 22 CO 0.00 0.00 0.00 -0.63 -6.46 0.00 0.00 176.83 169.74 3hkb s ILE 23 N -1.55 3.01 -0.18 1.55 1.01 -1.24 -4.87 121.20 118.92 3hkb s ILE 23 Ca 0.29 0.04 -0.03 0.00 0.00 0.00 0.00 60.65 60.94 3hkb s ILE 23 Cb -0.05 -3.02 -0.10 0.00 0.01 0.00 0.00 42.46 39.30 3hkb s ILE 23 CO -0.11 -0.00 -0.19 -0.11 0.00 0.00 0.00 174.94 174.53 3hkb n LEU 24 N 7.46 2.35 -3.86 2.97 7.94 -1.26 -4.55 117.00 128.05 3hkb n LEU 24 Ca 0.20 0.03 -0.14 0.00 -1.11 0.00 0.00 56.01 54.99 3hkb n LEU 24 Cb 0.41 -0.60 -0.15 0.00 0.53 0.00 0.00 43.42 43.61 3hkb n LEU 24 CO 0.68 0.65 -0.37 -0.54 -1.11 0.00 0.00 177.39 176.69 3hkb s LYS 25 N -2.36 0.14 0.12 1.96 -0.14 -1.26 -4.78 119.74 113.43 3hkb s LYS 25 Ca -0.25 0.00 -0.27 0.00 -1.36 0.00 0.00 55.97 54.09 3hkb s LYS 25 Cb 0.08 -0.22 -0.16 0.00 -1.68 0.00 0.00 37.83 35.85 3hkb s LYS 25 CO 0.38 -0.03 0.60 -2.30 -0.76 0.00 0.00 175.35 173.24 3hkb n PRO 26 N 3.42 0.00 -0.31 -1.68 -0.02 -1.26 -4.89 135.00 130.27 3hkb n PRO 26 Ca -0.18 0.00 0.05 0.00 -2.02 0.00 0.00 63.50 61.36 3hkb n PRO 26 Cb 0.56 -1.00 0.12 0.00 -0.02 0.00 0.00 33.50 33.17 3hkb n PRO 26 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 3hkb n PRO 27 N 1.00 -0.08 -2.06 0.52 -0.02 -1.26 -4.96 135.00 128.15 3hkb n PRO 27 Ca 0.16 1.34 -0.02 0.00 -2.02 0.00 0.00 63.50 62.96 3hkb n PRO 27 Cb 0.17 -2.00 0.00 0.00 -0.02 0.00 0.00 33.50 31.65 3hkb n PRO 27 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 3hkb n SER 28 N -5.40 -4.27 0.00 2.55 2.88 -1.26 -5.01 113.62 103.11 3hkb n SER 28 Ca 0.14 0.10 0.00 0.00 -1.33 0.00 0.00 58.87 57.78 3hkb n SER 28 Cb 0.44 -2.69 0.00 0.00 -0.75 0.00 0.00 64.21 61.21 3hkb n SER 28 CO 0.00 0.00 0.00 0.49 -1.23 0.00 0.00 175.04 174.30 3hkb n PHE 29 N -0.84 0.00 -3.62 0.66 3.01 -1.26 -5.32 117.46 110.09 3hkb n PHE 29 Ca 0.02 0.00 -0.06 0.00 1.01 0.00 0.00 57.45 58.42 3hkb n PHE 29 Cb 0.33 0.00 -0.06 0.00 -0.01 0.00 0.00 39.48 39.75 3hkb n PHE 29 CO 0.00 0.00 0.00 -0.51 1.01 0.00 0.00 176.76 177.26 3hkb s ASP 30 N -4.00 -0.22 -0.84 4.37 1.11 -1.26 -5.30 116.67 110.52 3hkb s ASP 30 Ca 0.00 0.32 -0.24 0.00 0.18 0.00 0.00 52.55 52.81 3hkb s ASP 30 Cb 0.00 0.28 0.06 0.00 1.07 0.00 0.00 42.92 44.33 3hkb s ASP 30 CO 0.00 -0.15 1.25 -2.84 1.18 0.00 0.00 175.17 174.61 3hkb s PRO 45 N -0.63 3.36 0.49 8.23 0.02 -1.26 -5.24 135.00 139.97 3hkb s PRO 45 Ca 0.04 -0.84 0.28 0.00 0.02 0.00 0.00 61.00 60.50 3hkb s PRO 45 Cb -0.02 -4.66 1.35 0.00 0.02 0.00 0.00 34.50 31.19 3hkb s PRO 45 CO -0.06 -2.05 1.83 1.03 -0.33 0.00 0.00 177.00 177.42 3hkb h SER 46 N 9.70 0.17 -4.09 2.53 0.87 -2.10 -3.48 113.55 117.15 3hkb h SER 46 Ca -0.07 0.03 0.00 0.00 -1.23 0.00 0.00 61.79 60.52 3hkb h SER 46 Cb 1.04 -0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.00 3hkb h SER 46 CO 1.28 0.04 -0.72 -0.11 -0.53 0.00 0.00 176.83 176.80 3hkb n LEU 47 N -4.37 -5.10 -0.04 2.23 0.00 -1.26 -4.98 117.00 103.49 3hkb n LEU 47 Ca 0.22 2.43 -0.13 0.00 0.00 0.00 0.00 56.01 58.52 3hkb n LEU 47 Cb 0.98 -2.62 -0.11 0.00 0.00 0.00 0.00 43.42 41.67 3hkb n LEU 47 CO 0.35 -1.40 0.54 -0.08 0.00 0.00 0.00 177.39 176.80 3hkb h GLU 48 N 3.23 0.00 0.00 1.96 4.57 -2.08 -3.40 114.58 118.86 3hkb h GLU 48 Ca 0.00 -0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.18 3hkb h GLU 48 Cb 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.59 3hkb h GLU 48 CO 0.00 0.68 0.00 -1.91 -1.18 0.00 0.00 179.01 176.60 3hkb n GLU 49 N -4.76 0.00 -2.07 1.92 4.07 -1.26 -3.92 120.64 114.62 3hkb n GLU 49 Ca -0.09 0.00 -0.31 0.00 -0.06 0.00 0.00 57.16 56.70 3hkb n GLU 49 Cb 0.34 0.00 -0.04 0.00 -0.06 0.00 0.00 31.44 31.67 3hkb n GLU 49 CO 0.00 0.00 0.00 0.42 -0.06 0.00 0.00 177.13 177.49 3hkb s ILE 50 N 0.00 3.44 0.00 6.31 -1.09 -1.26 -3.41 121.20 125.18 3hkb s ILE 50 Ca 0.00 -0.18 0.00 0.00 -2.23 0.00 0.00 60.65 58.24 3hkb s ILE 50 Cb 0.00 -4.03 0.00 0.00 -1.58 0.00 0.00 42.46 36.85 3hkb s ILE 50 CO 0.00 -0.98 0.15 0.00 -1.23 0.00 0.00 174.94 172.88 3hkb n GLN 51 N 8.98 0.00 0.00 2.79 -0.00 -1.25 -4.70 117.38 123.20 3hkb n GLN 51 Ca 0.33 -0.15 0.00 0.00 -0.00 0.00 0.00 57.00 57.18 3hkb n GLN 51 Cb 0.49 -0.16 0.00 0.00 -0.00 0.00 0.00 30.24 30.56 3hkb n GLN 51 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.06 178.69 3hkb n LYS 52 N 0.00 0.93 0.00 2.61 4.76 -1.22 -2.53 118.16 122.71 3hkb n LYS 52 Ca 0.00 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.44 3hkb n LYS 52 Cb 0.48 -1.39 0.00 0.00 -1.84 0.00 0.00 35.03 32.28 3hkb n LYS 52 CO 0.00 0.00 0.00 1.17 -1.37 0.00 0.00 177.40 177.20 3hkb n LYS 53 N 0.13 1.20 0.11 1.97 4.81 -1.26 -4.44 118.16 120.68 3hkb n LYS 53 Ca 0.00 0.00 0.13 0.00 -0.87 0.00 0.00 58.31 57.57 3hkb n LYS 53 Cb 0.28 -0.66 0.35 0.00 0.02 0.00 0.00 35.03 35.01 3hkb n LYS 53 CO 0.00 0.00 0.00 1.25 1.17 0.00 0.00 177.40 179.82 3hkb h LEU 54 N 0.00 0.00 -1.78 3.14 5.85 -1.84 -2.50 115.31 118.18 3hkb h LEU 54 Ca 0.00 -0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.69 3hkb h LEU 54 Cb 0.33 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.36 3hkb h LEU 54 CO 0.00 0.02 0.00 -1.84 -0.34 0.00 0.00 178.44 176.28 3hkb n GLU 55 N -2.31 0.82 0.02 1.25 0.28 -1.05 -4.01 120.64 115.63 3hkb n GLU 55 Ca 0.05 -1.15 0.11 0.00 -0.16 0.00 0.00 57.16 56.01 3hkb n GLU 55 Cb 0.44 -1.12 -0.11 0.00 1.43 0.00 0.00 31.44 32.08 3hkb n GLU 55 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 3hkb n ALA 56 N 0.24 2.99 0.10 -1.84 0.00 -1.21 -3.17 120.51 117.63 3hkb n ALA 56 Ca 0.04 -0.46 0.04 0.00 0.00 0.00 0.00 53.44 53.07 3hkb n ALA 56 Cb 0.21 -0.85 -0.00 0.00 0.00 0.00 0.00 19.45 18.81 3hkb n ALA 56 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3hkb h ALA 57 N 2.15 0.67 0.00 0.00 0.00 -1.64 -3.03 119.26 117.41 3hkb h ALA 57 Ca 0.00 -0.46 -0.00 0.00 0.00 0.00 0.00 54.91 54.44 3hkb h ALA 57 Cb 0.93 0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.79 3hkb h ALA 57 CO 0.00 0.54 -0.01 1.49 0.00 0.00 0.00 179.25 181.27 3hkb h GLU 58 N 0.00 0.00 -0.18 0.00 4.81 -1.70 -3.08 114.58 114.44 3hkb h GLU 58 Ca -0.06 0.00 -0.13 0.00 -0.13 0.00 0.00 59.36 59.03 3hkb h GLU 58 Cb 1.34 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.71 3hkb h GLU 58 CO 0.04 0.01 -0.46 0.93 -0.73 0.00 0.00 179.01 178.80 3hkb h GLU 59 N 0.00 0.45 -0.33 1.92 4.39 -1.48 0.34 114.58 119.86 3hkb h GLU 59 Ca -0.00 -0.24 -0.16 0.00 0.34 0.00 0.00 59.36 59.30 3hkb h GLU 59 Cb 0.87 0.01 -0.00 0.00 -0.10 0.00 0.00 28.75 29.53 3hkb h GLU 59 CO 0.00 0.82 -0.41 0.00 -1.16 0.00 0.00 179.01 178.26 3hkb h ARG 60 N 0.36 0.86 0.15 2.33 3.08 -1.46 -3.17 114.38 116.53 3hkb h ARG 60 Ca 0.02 -0.49 -0.01 0.00 0.07 0.00 0.00 59.98 59.58 3hkb h ARG 60 Cb 0.95 0.03 0.00 0.00 0.08 0.00 0.00 29.97 31.03 3hkb h ARG 60 CO 0.08 1.13 -0.07 -0.09 -1.07 0.00 0.00 179.97 179.95 3hkb h ARG 61 N 0.65 -0.19 0.00 0.04 2.43 -1.51 -1.77 114.38 114.03 3hkb h ARG 61 Ca 0.04 0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.23 3hkb h ARG 61 Cb 1.01 0.04 0.00 0.00 -0.42 0.00 0.00 29.97 30.60 3hkb h ARG 61 CO 0.10 0.06 0.35 1.17 -1.51 0.00 0.00 179.97 180.13 3hkb n LYS 62 N -4.89 0.00 -0.04 0.20 4.81 0.10 -1.64 118.16 116.70 3hkb n LYS 62 Ca -0.05 0.12 -0.06 0.00 -0.87 0.00 0.00 58.31 57.46 3hkb n LYS 62 Cb 0.17 -1.85 -0.02 0.00 0.02 0.00 0.00 35.03 33.35 3hkb n LYS 62 CO 0.00 0.00 0.00 0.98 1.17 0.00 0.00 177.40 179.55 3hkb n TYR 63 N -1.10 0.00 0.89 5.64 9.36 -1.20 -4.00 117.16 126.76 3hkb n TYR 63 Ca 0.00 0.00 0.09 0.00 3.32 0.00 0.00 57.90 61.31 3hkb n TYR 63 Cb 0.35 -0.33 0.46 0.00 -0.63 0.00 0.00 39.34 39.19 3hkb n TYR 63 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 3hkb n GLN 64 N -4.13 0.31 -0.09 2.98 10.64 -0.65 -0.57 117.38 125.87 3hkb n GLN 64 Ca -0.09 0.10 -0.12 0.00 -1.83 0.00 0.00 57.00 55.05 3hkb n GLN 64 Cb 0.34 -1.50 -0.15 0.00 -0.86 0.00 0.00 30.24 28.08 3hkb n GLN 64 CO 0.00 0.00 0.00 -1.91 -1.83 0.00 0.00 177.06 173.32 3hkb n GLU 65 N -1.23 0.68 -0.02 2.61 0.00 -0.75 -3.91 120.64 118.01 3hkb n GLU 65 Ca 0.09 0.07 0.00 0.00 0.00 0.00 0.00 57.16 57.32 3hkb n GLU 65 Cb 0.13 -1.56 0.01 0.00 0.00 0.00 0.00 31.44 30.02 3hkb n GLU 65 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 3hkb n ALA 66 N -2.86 2.54 0.03 4.31 0.00 0.26 -3.55 120.51 121.25 3hkb n ALA 66 Ca -0.34 -0.05 0.00 0.00 0.00 0.00 0.00 53.44 53.05 3hkb n ALA 66 Cb 1.11 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 19.55 3hkb n ALA 66 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 3hkb n GLU 67 N 0.08 0.00 -0.05 0.00 2.13 -0.91 -4.11 120.64 117.77 3hkb n GLU 67 Ca 0.01 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.83 3hkb n GLU 67 Cb 0.31 -0.44 0.00 0.00 0.27 0.00 0.00 31.44 31.58 3hkb n GLU 67 CO 0.00 0.00 0.00 1.28 -0.41 0.00 0.00 177.13 178.00 3hkb n LEU 68 N -3.23 0.82 0.00 4.31 4.77 -1.23 0.55 117.00 122.99 3hkb n LEU 68 Ca 0.00 -0.38 0.00 0.00 -0.03 0.00 0.00 56.01 55.60 3hkb n LEU 68 Cb 0.21 -0.16 0.00 0.00 -2.33 0.00 0.00 43.42 41.14 3hkb n LEU 68 CO 0.00 0.15 0.00 -0.11 -1.33 0.00 0.00 177.39 176.10 3hkb n LEU 69 N 1.47 0.00 -1.41 2.23 7.94 -1.24 -4.75 117.00 121.25 3hkb n LEU 69 Ca 0.00 0.00 0.07 0.00 -1.11 0.00 0.00 56.01 54.97 3hkb n LEU 69 Cb 0.09 0.00 0.30 0.00 0.53 0.00 0.00 43.42 44.35 3hkb n LEU 69 CO 0.00 0.00 0.74 1.17 -1.11 0.00 0.00 177.39 178.19 3hkb n LYS 70 N -0.95 3.41 -0.16 1.96 4.81 0.19 -1.98 118.16 125.43 3hkb n LYS 70 Ca 0.00 -2.38 0.05 0.00 -0.87 0.00 0.00 58.31 55.10 3hkb n LYS 70 Cb 0.00 -1.84 0.13 0.00 0.02 0.00 0.00 35.03 33.33 3hkb n LYS 70 CO 0.00 0.00 0.00 0.72 1.17 0.00 0.00 177.40 179.29 3hkb n HIS 71 N 0.83 0.37 0.00 5.64 8.25 0.14 -4.36 115.22 126.09 3hkb n HIS 71 Ca 0.21 -0.59 0.00 0.00 -0.26 0.00 0.00 57.72 57.08 3hkb n HIS 71 Cb 0.80 -0.08 0.00 0.00 1.12 0.00 0.00 29.99 31.83 3hkb n HIS 71 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 3hkb n LEU 72 N -0.05 0.24 0.00 2.41 4.32 -1.10 -3.75 117.00 119.06 3hkb n LEU 72 Ca 0.10 0.00 0.12 0.00 -0.02 0.00 0.00 56.01 56.21 3hkb n LEU 72 Cb 0.46 0.00 0.67 0.00 -1.62 0.00 0.00 43.42 42.94 3hkb n LEU 72 CO 0.06 0.04 0.90 0.00 -1.22 0.00 0.00 177.39 177.17 3hkb n ALA 73 N -2.01 2.33 -0.06 -1.18 0.00 -0.84 -1.93 120.51 116.81 3hkb n ALA 73 Ca 0.00 -0.14 -0.04 0.00 0.00 0.00 0.00 53.44 53.27 3hkb n ALA 73 Cb 0.49 -1.39 -0.01 0.00 0.00 0.00 0.00 19.45 18.54 3hkb n ALA 73 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 3hkb h GLU 74 N 0.00 0.00 -0.77 0.00 5.08 -1.76 -3.28 114.58 113.85 3hkb h GLU 74 Ca 0.00 0.00 0.22 0.00 -1.00 0.00 0.00 59.36 58.58 3hkb h GLU 74 Cb 0.09 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.31 3hkb h GLU 74 CO 0.00 0.00 0.69 -0.22 -1.00 0.00 0.00 179.01 178.48 3hkb h LYS 75 N -0.93 0.00 0.19 2.33 1.63 -1.64 0.16 116.57 118.31 3hkb h LYS 75 Ca 0.00 0.00 -0.27 0.00 -0.85 0.00 0.00 60.65 59.53 3hkb h LYS 75 Cb 0.41 0.00 0.03 0.00 -0.60 0.00 0.00 32.23 32.08 3hkb h LYS 75 CO 0.00 0.00 -1.18 -0.09 -3.45 0.00 0.00 179.45 174.73 3hkb h ARG 76 N 0.00 0.47 -1.05 1.90 9.65 -1.57 -3.27 114.38 120.51 3hkb h ARG 76 Ca 0.37 -0.76 0.00 0.00 -1.10 0.00 0.00 59.98 58.49 3hkb h ARG 76 Cb 1.74 0.28 0.00 0.00 -1.39 0.00 0.00 29.97 30.60 3hkb h ARG 76 CO -0.00 1.35 0.00 0.39 2.80 0.00 0.00 179.97 184.51 3hkb n GLU 77 N -3.89 0.72 0.00 0.20 -0.58 0.54 -1.25 120.64 116.38 3hkb n GLU 77 Ca -0.15 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.59 3hkb n GLU 77 Cb 0.97 -1.23 0.00 0.00 -0.57 0.00 0.00 31.44 30.62 3hkb n GLU 77 CO 0.00 0.00 0.00 1.58 -0.48 0.00 0.00 177.13 178.23 3hkb n HIS 78 N 0.44 0.00 -0.09 -0.32 -0.00 -1.21 -4.09 115.22 109.95 3hkb n HIS 78 Ca 0.00 0.00 -0.08 0.00 0.46 0.00 0.00 57.72 58.10 3hkb n HIS 78 Cb 0.29 0.00 -0.00 0.00 -0.12 0.00 0.00 29.99 30.15 3hkb n HIS 78 CO 0.00 0.00 0.00 0.93 0.46 0.00 0.00 176.34 177.73 3hkb h GLU 79 N 0.00 0.36 -0.42 1.57 5.08 -1.26 0.77 114.58 120.69 3hkb h GLU 79 Ca 0.00 -0.02 0.04 0.00 -1.00 0.00 0.00 59.36 58.38 3hkb h GLU 79 Cb 0.87 -0.08 -0.02 0.00 0.50 0.00 0.00 28.75 30.02 3hkb h GLU 79 CO 0.00 0.24 0.28 0.00 -1.00 0.00 0.00 179.01 178.53 3hkb h ARG 80 N 0.37 0.38 0.13 2.33 3.08 -1.74 0.50 114.38 119.43 3hkb h ARG 80 Ca 0.13 -0.02 -0.01 0.00 0.07 0.00 0.00 59.98 60.15 3hkb h ARG 80 Cb 0.01 -0.09 0.00 0.00 0.08 0.00 0.00 29.97 29.98 3hkb h ARG 80 CO -0.07 0.25 -0.06 0.93 -1.07 0.00 0.00 179.97 179.95 3hkb h GLU 81 N 0.39 -0.17 0.40 0.04 5.08 -1.07 -3.28 114.58 115.98 3hkb h GLU 81 Ca 0.18 0.01 -0.02 0.00 -1.00 0.00 0.00 59.36 58.53 3hkb h GLU 81 Cb 0.20 0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.49 3hkb h GLU 81 CO -0.04 0.30 -0.19 -0.39 -1.00 0.00 0.00 179.01 177.69 3hkb h VAL 82 N -0.85 0.60 -1.10 3.13 -1.51 0.55 -2.77 116.25 114.31 3hkb h VAL 82 Ca -0.02 -0.31 0.30 0.00 -1.23 0.00 0.00 66.70 65.44 3hkb h VAL 82 Cb 0.54 0.75 -0.09 0.00 -2.13 0.00 0.00 31.29 30.37 3hkb h VAL 82 CO 0.03 0.06 0.72 0.16 -1.23 0.00 0.00 177.57 177.31 3hkb h ILE 83 N -0.72 0.45 -0.32 7.19 3.07 -1.05 0.31 117.51 126.44 3hkb h ILE 83 Ca -0.05 -0.10 0.00 0.00 1.55 0.00 0.00 64.86 66.26 3hkb h ILE 83 Cb 0.50 0.14 0.00 0.00 -0.27 0.00 0.00 36.82 37.20 3hkb h ILE 83 CO 0.09 0.05 0.00 0.00 -1.05 0.00 0.00 178.15 177.24 3hkb n GLN 84 N -4.56 2.45 -0.07 0.16 10.64 -1.23 -3.81 117.38 120.97 3hkb n GLN 84 Ca 0.27 -2.18 -0.14 0.00 -1.83 0.00 0.00 57.00 53.11 3hkb n GLN 84 Cb 1.01 -1.50 -0.12 0.00 -0.86 0.00 0.00 30.24 28.77 3hkb n GLN 84 CO 0.00 0.00 0.00 0.87 -1.83 0.00 0.00 177.06 176.10 3hkb h LYS 85 N 4.43 0.00 -0.78 2.61 1.79 -0.08 -2.27 116.57 122.28 3hkb h LYS 85 Ca 0.00 0.00 0.08 0.00 -2.18 0.00 0.00 60.65 58.55 3hkb h LYS 85 Cb 0.97 0.00 -0.05 0.00 -1.58 0.00 0.00 32.23 31.57 3hkb h LYS 85 CO 0.00 0.92 0.51 0.00 -1.08 0.00 0.00 179.45 179.80 3hkb h ALA 86 N -0.16 1.73 -0.10 3.86 0.00 -1.68 0.42 119.26 123.33 3hkb h ALA 86 Ca -0.06 -0.01 -0.22 0.00 0.00 0.00 0.00 54.91 54.62 3hkb h ALA 86 Cb 0.98 -0.18 0.01 0.00 0.00 0.00 0.00 17.79 18.60 3hkb h ALA 86 CO -0.03 0.12 -0.82 0.82 0.00 0.00 0.00 179.25 179.34 3hkb h ILE 87 N 0.75 1.32 0.00 0.00 2.04 -1.71 -0.66 117.51 119.25 3hkb h ILE 87 Ca 0.35 -2.11 -0.00 0.00 1.00 0.00 0.00 64.86 64.10 3hkb h ILE 87 Cb 0.38 2.12 -0.00 0.00 -0.74 0.00 0.00 36.82 38.57 3hkb h ILE 87 CO -0.13 0.65 -0.00 -0.33 0.00 0.00 0.00 178.15 178.34 3hkb h GLU 88 N 0.41 0.00 -0.00 2.37 5.08 -0.25 -0.42 114.58 121.77 3hkb h GLU 88 Ca -0.06 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.30 3hkb h GLU 88 Cb 1.44 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.69 3hkb h GLU 88 CO 0.16 0.00 -0.18 -0.85 -1.00 0.00 0.00 179.01 177.14 3hkb n GLU 89 N -3.09 3.20 0.03 2.33 0.28 0.12 -3.20 120.64 120.31 3hkb n GLU 89 Ca 0.01 -0.32 -0.14 0.00 -0.16 0.00 0.00 57.16 56.55 3hkb n GLU 89 Cb 0.33 -0.91 -0.14 0.00 1.43 0.00 0.00 31.44 32.15 3hkb n GLU 89 CO 0.00 0.00 0.00 -0.97 -0.16 0.00 0.00 177.13 176.00 3hkb h ASN 90 N 0.48 0.24 -0.13 -1.84 -1.24 -1.07 -3.12 115.58 108.89 3hkb h ASN 90 Ca 0.00 -0.38 0.04 0.00 0.71 0.00 0.00 56.30 56.67 3hkb h ASN 90 Cb 0.19 -0.08 -0.01 0.00 0.73 0.00 0.00 38.32 39.16 3hkb h ASN 90 CO 0.00 1.33 0.10 0.78 -1.29 0.00 0.00 177.43 178.35 3hkb h ASN 91 N 0.04 0.00 0.79 1.15 2.35 -1.24 -2.67 115.58 116.00 3hkb h ASN 91 Ca -0.26 0.00 -0.21 0.00 -0.55 0.00 0.00 56.30 55.29 3hkb h ASN 91 Cb 1.99 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 40.34 3hkb h ASN 91 CO 0.12 0.00 -0.97 -1.13 -1.65 0.00 0.00 177.43 173.81 3hkb h ASN 92 N 0.00 0.14 -0.14 5.81 -0.73 -1.61 -3.03 115.58 116.02 3hkb h ASN 92 Ca 0.06 -0.13 -0.08 0.00 1.87 0.00 0.00 56.30 58.02 3hkb h ASN 92 Cb 0.26 -0.04 -0.00 0.00 0.27 0.00 0.00 38.32 38.81 3hkb h ASN 92 CO -0.00 1.02 -0.22 0.15 -0.37 0.00 0.00 177.43 178.02 3hkb h PHE 93 N 0.04 0.49 0.00 0.67 3.57 -1.41 -2.94 116.94 117.36 3hkb h PHE 93 Ca -0.04 -0.17 0.00 0.00 3.53 0.00 0.00 57.97 61.29 3hkb h PHE 93 Cb 1.66 -0.10 0.00 0.00 2.79 0.00 0.00 35.95 40.31 3hkb h PHE 93 CO 0.02 0.83 0.00 -0.89 -2.23 0.00 0.00 178.31 176.04 3hkb n ILE 94 N -4.48 0.00 0.58 1.41 -0.00 -1.12 0.06 119.36 115.81 3hkb n ILE 94 Ca -0.06 1.29 0.00 0.00 -0.00 0.00 0.00 62.75 63.98 3hkb n ILE 94 Cb 0.42 -2.27 0.00 0.00 -0.00 0.00 0.00 39.64 37.79 3hkb n ILE 94 CO 0.00 0.00 0.00 0.29 -0.00 0.00 0.00 176.55 176.84 3hkb n LYS 95 N -1.78 0.40 0.00 0.38 4.01 -1.15 0.23 118.16 120.25 3hkb n LYS 95 Ca 0.00 0.00 -0.03 0.00 -0.51 0.00 0.00 58.31 57.77 3hkb n LYS 95 Cb 0.00 -1.11 -0.01 0.00 -0.51 0.00 0.00 35.03 33.40 3hkb n LYS 95 CO 0.00 0.00 0.00 -0.12 -1.11 0.00 0.00 177.40 176.17 3hkb n MET 96 N -0.06 0.16 -0.78 1.97 0.00 -1.11 -4.78 117.12 112.53 3hkb n MET 96 Ca 0.00 0.06 -0.06 0.00 -0.00 0.00 0.00 57.70 57.71 3hkb n MET 96 Cb 0.05 -0.78 0.22 0.00 0.00 0.00 0.00 33.22 32.71 3hkb n MET 96 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 3hkb n ALA 97 N -3.76 4.13 -0.11 -5.12 0.00 0.11 -1.31 120.51 114.44 3hkb n ALA 97 Ca -0.05 -1.75 -0.22 0.00 0.00 0.00 0.00 53.44 51.42 3hkb n ALA 97 Cb 0.19 -1.21 -0.09 0.00 0.00 0.00 0.00 19.45 18.34 3hkb n ALA 97 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 3hkb n LYS 98 N -0.10 0.56 0.00 0.00 0.00 0.62 -4.49 118.16 114.75 3hkb n LYS 98 Ca 0.32 0.43 0.14 0.00 0.00 0.00 0.00 58.31 59.19 3hkb n LYS 98 Cb 1.15 -1.62 0.60 0.00 0.00 0.00 0.00 35.03 35.16 3hkb n LYS 98 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.40 176.55 3hkb n GLU 99 N -4.38 0.31 0.00 1.64 0.00 -1.20 -2.24 120.64 114.77 3hkb n GLU 99 Ca -0.37 -0.07 0.07 0.00 0.00 0.00 0.00 57.16 56.78 3hkb n GLU 99 Cb 0.71 -1.50 0.31 0.00 0.00 0.00 0.00 31.44 30.96 3hkb n GLU 99 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.13 178.76 3hkb n LYS 100 N -1.28 0.09 -0.04 3.44 5.02 -0.43 -2.91 118.16 122.05 3hkb n LYS 100 Ca 0.11 0.22 -0.08 0.00 -2.02 0.00 0.00 58.31 56.54 3hkb n LYS 100 Cb 0.30 -1.50 -0.04 0.00 -0.02 0.00 0.00 35.03 33.77 3hkb n LYS 100 CO 0.00 0.00 0.00 -0.11 -0.52 0.00 0.00 177.40 176.77 3hkb n LEU 101 N -1.40 1.66 0.13 -0.35 0.00 -0.95 -4.22 117.00 111.87 3hkb n LEU 101 Ca 0.05 0.04 0.11 0.00 0.00 0.00 0.00 56.01 56.21 3hkb n LEU 101 Cb 0.13 -0.28 0.49 0.00 0.00 0.00 0.00 43.42 43.76 3hkb n LEU 101 CO 0.11 0.39 0.84 0.00 0.00 0.00 0.00 177.39 178.73 3hkb n ALA 102 N -3.12 1.57 -0.07 1.96 0.00 -1.10 -0.08 120.51 119.68 3hkb n ALA 102 Ca -0.16 0.09 0.08 0.00 0.00 0.00 0.00 53.44 53.45 3hkb n ALA 102 Cb 0.64 -1.37 0.19 0.00 0.00 0.00 0.00 19.45 18.91 3hkb n ALA 102 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3hkb n GLN 103 N -2.19 2.50 -0.07 0.00 10.64 -1.14 -3.51 117.38 123.60 3hkb n GLN 103 Ca 0.02 -2.12 0.03 0.00 -1.83 0.00 0.00 57.00 53.10 3hkb n GLN 103 Cb 0.20 -1.37 0.07 0.00 -0.86 0.00 0.00 30.24 28.28 3hkb n GLN 103 CO 0.00 0.00 0.00 1.17 -1.83 0.00 0.00 177.06 176.40 3hkb n LYS 104 N 0.94 2.21 -0.00 2.61 4.81 0.89 -4.23 118.16 125.39 3hkb n LYS 104 Ca 0.15 -1.57 0.02 0.00 -0.87 0.00 0.00 58.31 56.04 3hkb n LYS 104 Cb 0.48 -1.13 -0.03 0.00 0.02 0.00 0.00 35.03 34.37 3hkb n LYS 104 CO 0.00 0.00 0.00 -0.12 1.17 0.00 0.00 177.40 178.45 3hkb n MET 105 N 0.09 1.10 -0.22 1.64 1.56 0.04 -4.16 117.12 117.17 3hkb n MET 105 Ca 0.05 -0.03 0.07 0.00 -0.27 0.00 0.00 57.70 57.53 3hkb n MET 105 Cb 0.30 -1.01 0.20 0.00 2.15 0.00 0.00 33.22 34.85 3hkb n MET 105 CO 0.00 0.00 0.00 0.39 -0.73 0.00 0.00 175.97 175.63 3hkb n GLU 106 N -1.53 2.00 -0.12 2.12 -0.58 -1.23 -1.66 120.64 119.64 3hkb n GLU 106 Ca -0.00 -1.56 -0.15 0.00 -0.42 0.00 0.00 57.16 55.03 3hkb n GLU 106 Cb 0.09 -1.34 -0.14 0.00 -0.57 0.00 0.00 31.44 29.48 3hkb n GLU 106 CO 0.00 0.00 0.00 0.43 -0.48 0.00 0.00 177.13 177.08 3hkb n SER 107 N 0.77 1.15 0.22 1.62 7.64 -1.26 -3.92 113.62 119.85 3hkb n SER 107 Ca 0.15 -0.08 -0.10 0.00 1.01 0.00 0.00 58.87 59.85 3hkb n SER 107 Cb 0.37 0.18 -0.05 0.00 -1.01 0.00 0.00 64.21 63.70 3hkb n SER 107 CO 0.00 0.00 0.00 -1.13 -3.01 0.00 0.00 175.04 170.90 3hkb h ASN 108 N 0.00 -0.53 -0.61 6.43 -0.73 -1.71 -1.82 115.58 116.61 3hkb h ASN 108 Ca -0.57 0.02 0.13 0.00 1.87 0.00 0.00 56.30 57.75 3hkb h ASN 108 Cb 2.05 0.14 -0.10 0.00 0.27 0.00 0.00 38.32 40.67 3hkb h ASN 108 CO -0.04 -0.14 0.01 0.50 -0.37 0.00 0.00 177.43 177.40 3hkb h LYS 109 N -1.12 0.13 -0.37 6.67 3.64 -1.59 -0.55 116.57 123.38 3hkb h LYS 109 Ca -0.06 -0.01 -0.05 0.00 -1.27 0.00 0.00 60.65 59.26 3hkb h LYS 109 Cb 0.48 -0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 32.26 3hkb h LYS 109 CO 0.11 0.08 0.02 0.93 -2.27 0.00 0.00 179.45 178.32 3hkb h GLU 110 N 0.13 0.57 0.39 1.90 5.08 -1.68 -2.58 114.58 118.38 3hkb h GLU 110 Ca 0.32 -0.12 -0.02 0.00 -1.00 0.00 0.00 59.36 58.54 3hkb h GLU 110 Cb 0.52 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.68 3hkb h GLU 110 CO -0.51 0.57 -0.19 -0.91 -1.00 0.00 0.00 179.01 176.97 3hkb h ASN 111 N 0.54 -0.44 -0.23 1.42 -0.26 -0.27 -3.25 115.58 113.09 3hkb h ASN 111 Ca 0.12 0.02 -0.02 0.00 -0.56 0.00 0.00 56.30 55.85 3hkb h ASN 111 Cb 0.31 0.11 -0.02 0.00 -1.06 0.00 0.00 38.32 37.67 3hkb h ASN 111 CO 0.01 -0.01 0.09 -0.09 -1.06 0.00 0.00 177.43 176.37 3hkb h ARG 112 N -1.12 0.42 -0.89 0.81 2.43 -1.26 -2.22 114.38 112.56 3hkb h ARG 112 Ca -0.05 -0.05 0.03 0.00 -0.81 0.00 0.00 59.98 59.09 3hkb h ARG 112 Cb 0.40 -0.08 -0.05 0.00 -0.42 0.00 0.00 29.97 29.82 3hkb h ARG 112 CO 0.09 0.37 0.58 0.93 -1.51 0.00 0.00 179.97 180.43 3hkb h GLU 113 N 0.42 1.11 -0.03 0.20 5.08 -1.57 -0.24 114.58 119.54 3hkb h GLU 113 Ca 0.10 -0.07 -0.14 0.00 -1.00 0.00 0.00 59.36 58.25 3hkb h GLU 113 Cb 0.13 -0.25 -0.02 0.00 0.50 0.00 0.00 28.75 29.11 3hkb h GLU 113 CO -0.01 0.73 -0.64 0.00 -1.00 0.00 0.00 179.01 178.09 3hkb h ALA 114 N 1.35 0.87 -0.08 3.43 0.00 -1.50 -0.74 119.26 122.59 3hkb h ALA 114 Ca 0.34 -0.57 -0.08 0.00 0.00 0.00 0.00 54.91 54.60 3hkb h ALA 114 Cb -0.04 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 3hkb h ALA 114 CO -0.10 0.78 -0.33 1.25 0.00 0.00 0.00 179.25 180.85 3hkb h HIS 115 N 0.09 0.17 0.08 0.00 -0.00 -0.72 0.49 115.15 115.26 3hkb h HIS 115 Ca -0.01 -0.04 -0.30 0.00 -0.00 0.00 0.00 60.37 60.02 3hkb h HIS 115 Cb 1.15 -0.04 -0.02 0.00 -0.00 0.00 0.00 27.41 28.50 3hkb h HIS 115 CO 0.01 0.47 -1.60 -0.07 -0.00 0.00 0.00 177.93 176.74 3hkb h LEU 116 N 0.14 0.26 -0.79 0.26 4.07 -0.94 -3.11 115.31 115.19 3hkb h LEU 116 Ca 0.02 -0.42 0.00 0.00 0.08 0.00 0.00 57.88 57.56 3hkb h LEU 116 Cb 0.65 -0.08 0.00 0.00 1.08 0.00 0.00 40.66 42.31 3hkb h LEU 116 CO 0.05 1.36 -0.13 0.00 -1.08 0.00 0.00 178.44 178.63 3hkb n ALA 117 N -2.66 2.83 0.47 1.53 0.00 -0.29 -2.55 120.51 119.85 3hkb n ALA 117 Ca -0.17 -0.44 0.10 0.00 0.00 0.00 0.00 53.44 52.93 3hkb n ALA 117 Cb 1.04 -1.12 -0.14 0.00 0.00 0.00 0.00 19.45 19.22 3hkb n ALA 117 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3hkb n ALA 118 N -0.16 3.74 1.33 0.00 0.00 0.17 -3.39 120.51 122.21 3hkb n ALA 118 Ca 0.15 -0.55 0.13 0.00 0.00 0.00 0.00 53.44 53.18 3hkb n ALA 118 Cb 0.37 -0.75 0.40 0.00 0.00 0.00 0.00 19.45 19.47 3hkb n ALA 118 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3hkb n MET 119 N -1.88 1.40 -0.11 0.00 0.00 -1.15 -3.11 117.12 112.27 3hkb n MET 119 Ca -0.00 -0.89 -0.22 0.00 0.00 0.00 0.00 57.70 56.59 3hkb n MET 119 Cb 0.45 -1.48 -0.09 0.00 0.00 0.00 0.00 33.22 32.09 3hkb n MET 119 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 175.97 175.86 3hkb n LEU 120 N -0.02 2.09 0.04 3.17 7.94 -1.06 -3.63 117.00 125.53 3hkb n LEU 120 Ca 0.15 0.15 0.06 0.00 -1.11 0.00 0.00 56.01 55.27 3hkb n LEU 120 Cb 0.38 -0.71 0.27 0.00 0.53 0.00 0.00 43.42 43.89 3hkb n LEU 120 CO 0.20 0.61 0.68 1.21 -1.11 0.00 0.00 177.39 178.99 3hkb n GLU 121 N -3.75 0.05 0.02 1.96 2.13 -1.22 0.80 120.64 120.63 3hkb n GLU 121 Ca -0.44 0.42 -0.18 0.00 0.66 0.00 0.00 57.16 57.62 3hkb n GLU 121 Cb 0.86 -1.62 -0.12 0.00 0.27 0.00 0.00 31.44 30.82 3hkb n GLU 121 CO 0.00 0.00 0.00 -0.09 -0.41 0.00 0.00 177.13 176.63 3hkb h ARG 122 N 0.00 0.40 0.20 5.31 2.43 -1.74 -3.36 114.38 117.63 3hkb h ARG 122 Ca 0.00 -0.48 -0.32 0.00 -0.81 0.00 0.00 59.98 58.37 3hkb h ARG 122 Cb 0.15 0.15 0.02 0.00 -0.42 0.00 0.00 29.97 29.87 3hkb h ARG 122 CO 0.00 1.15 -1.50 1.25 -1.51 0.00 0.00 179.97 179.36 3hkb h LEU 123 N -0.14 0.67 -1.70 3.80 5.85 0.33 -3.13 115.31 121.00 3hkb h LEU 123 Ca -0.10 -0.92 -0.01 0.00 0.84 0.00 0.00 57.88 57.69 3hkb h LEU 123 Cb 1.42 -0.22 -0.01 0.00 0.37 0.00 0.00 40.66 42.23 3hkb h LEU 123 CO 0.13 1.70 0.11 1.56 -0.34 0.00 0.00 178.44 181.60 3hkb h GLN 124 N 0.02 0.31 0.00 1.25 4.20 -0.07 -2.43 115.11 118.38 3hkb h GLN 124 Ca -0.28 -0.03 -0.01 0.00 0.06 0.00 0.00 58.65 58.39 3hkb h GLN 124 Cb 2.04 -0.07 -0.00 0.00 0.30 0.00 0.00 27.48 29.75 3hkb h GLN 124 CO 0.20 0.24 -0.04 1.49 -0.67 0.00 0.00 178.83 180.05 3hkb h GLU 125 N 0.31 0.00 -0.46 1.46 4.22 -1.69 0.27 114.58 118.69 3hkb h GLU 125 Ca 0.08 0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.52 3hkb h GLU 125 Cb 0.03 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.28 3hkb h GLU 125 CO -0.01 0.04 0.00 1.63 -2.18 0.00 0.00 179.01 178.49 3hkb n LYS 126 N -3.18 2.53 -0.03 1.92 5.02 -0.93 -3.72 118.16 119.77 3hkb n LYS 126 Ca -0.00 -2.35 -0.02 0.00 -2.02 0.00 0.00 58.31 53.92 3hkb n LYS 126 Cb 0.29 -1.51 -0.07 0.00 -0.02 0.00 0.00 35.03 33.72 3hkb n LYS 126 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 3hkb n ASP 127 N 1.47 2.98 0.00 4.39 8.00 -0.26 -4.23 116.55 128.90 3hkb n ASP 127 Ca 0.20 0.00 0.09 0.00 0.71 0.00 0.00 54.79 55.79 3hkb n ASP 127 Cb 0.59 0.89 0.56 0.00 -0.02 0.00 0.00 41.12 43.14 3hkb n ASP 127 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 3hkb n LYS 128 N -2.17 0.86 -0.03 -1.24 4.01 0.79 -2.93 118.16 117.45 3hkb n LYS 128 Ca -0.10 0.00 -0.22 0.00 -0.51 0.00 0.00 58.31 57.48 3hkb n LYS 128 Cb 0.62 -1.34 -0.13 0.00 -0.51 0.00 0.00 35.03 33.67 3hkb n LYS 128 CO 0.00 0.00 0.00 1.25 -1.11 0.00 0.00 177.40 177.54 3hkb h HIS 129 N 0.00 0.32 -0.76 2.13 -0.00 -1.73 -3.16 115.15 111.95 3hkb h HIS 129 Ca 0.00 -0.24 -0.06 0.00 -0.00 0.00 0.00 60.37 60.08 3hkb h HIS 129 Cb 0.00 -0.01 -0.03 0.00 -0.00 0.00 0.00 27.41 27.36 3hkb h HIS 129 CO 0.00 1.64 0.25 0.00 -0.00 0.00 0.00 177.93 179.82 3hkb h ALA 130 N -0.14 0.99 0.00 5.26 0.00 -1.72 0.87 119.26 124.53 3hkb h ALA 130 Ca -0.37 -0.22 -0.01 0.00 0.00 0.00 0.00 54.91 54.31 3hkb h ALA 130 Cb 1.74 -0.29 -0.00 0.00 0.00 0.00 0.00 17.79 19.24 3hkb h ALA 130 CO -0.01 0.66 -0.05 1.05 0.00 0.00 0.00 179.25 180.90 3hkb h GLU 131 N 1.12 0.00 -0.25 0.00 9.09 -1.69 0.77 114.58 123.63 3hkb h GLU 131 Ca 0.25 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.66 3hkb h GLU 131 Cb 0.29 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.39 3hkb h GLU 131 CO -0.01 0.05 0.00 -0.85 0.05 0.00 0.00 179.01 178.25 3hkb n GLU 132 N -3.44 1.99 0.00 1.06 0.00 -0.55 -3.77 120.64 115.93 3hkb n GLU 132 Ca -0.02 -1.82 0.00 0.00 0.00 0.00 0.00 57.16 55.32 3hkb n GLU 132 Cb 0.17 -1.32 0.00 0.00 0.00 0.00 0.00 31.44 30.30 3hkb n GLU 132 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.13 177.41 3hkb n VAL 133 N 0.82 0.00 0.05 3.84 0.31 0.19 -4.42 118.33 119.12 3hkb n VAL 133 Ca 0.12 -0.26 -0.22 0.00 -0.01 0.00 0.00 64.34 63.97 3hkb n VAL 133 Cb 0.43 1.24 -0.14 0.00 -0.91 0.00 0.00 33.84 34.45 3hkb n VAL 133 CO 0.00 0.00 0.00 -0.09 -1.32 0.00 0.00 176.83 175.42 3hkb h ARG 134 N 0.00 0.33 0.00 5.55 2.43 -1.05 -3.19 114.38 118.45 3hkb h ARG 134 Ca 0.00 -0.56 0.00 0.00 -0.81 0.00 0.00 59.98 58.61 3hkb h ARG 134 Cb 0.12 0.21 0.00 0.00 -0.42 0.00 0.00 29.97 29.88 3hkb h ARG 134 CO 0.00 1.27 0.04 1.63 -1.51 0.00 0.00 179.97 181.39 3hkb n LYS 135 N -3.86 0.00 0.20 0.20 5.02 -1.25 -0.10 118.16 118.38 3hkb n LYS 135 Ca -0.22 0.42 0.10 0.00 -2.02 0.00 0.00 58.31 56.59 3hkb n LYS 135 Cb 0.95 -1.54 0.14 0.00 -0.02 0.00 0.00 35.03 34.57 3hkb n LYS 135 CO 0.00 0.00 0.00 -0.97 -0.52 0.00 0.00 177.40 175.91 3hkb h ASN 136 N 0.00 0.00 0.13 4.39 -1.24 -1.76 -3.32 115.58 113.77 3hkb h ASN 136 Ca 0.00 0.00 -0.21 0.00 0.71 0.00 0.00 56.30 56.80 3hkb h ASN 136 Cb 0.08 0.00 0.01 0.00 0.73 0.00 0.00 38.32 39.14 3hkb h ASN 136 CO 0.00 0.09 -0.99 0.11 -1.29 0.00 0.00 177.43 175.35 3hkb h LYS 137 N 0.00 0.27 -0.22 6.67 6.56 -0.64 -3.19 116.57 126.02 3hkb h LYS 137 Ca -0.00 -0.45 0.00 0.00 -1.06 0.00 0.00 60.65 59.14 3hkb h LYS 137 Cb 1.07 0.17 0.00 0.00 -0.57 0.00 0.00 32.23 32.90 3hkb h LYS 137 CO 0.01 1.22 0.00 -0.85 -2.06 0.00 0.00 179.45 177.77 3hkb n GLU 138 N -4.09 0.72 -0.12 3.15 -0.00 -1.19 -2.38 120.64 116.73 3hkb n GLU 138 Ca -0.18 0.00 0.00 0.00 -0.00 0.00 0.00 57.16 56.98 3hkb n GLU 138 Cb 0.83 -1.11 0.00 0.00 -0.00 0.00 0.00 31.44 31.16 3hkb n GLU 138 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 177.13 178.60 3hkb n LEU 139 N -0.30 0.00 -3.03 -1.84 -0.00 -1.25 -4.92 117.00 105.65 3hkb n LEU 139 Ca 0.00 -0.25 -0.16 0.00 -0.00 0.00 0.00 56.01 55.60 3hkb n LEU 139 Cb 0.05 0.00 -0.03 0.00 -0.00 0.00 0.00 43.42 43.45 3hkb n LEU 139 CO 0.00 0.08 -0.09 2.29 -0.00 0.00 0.00 177.39 179.67 3hkb n LYS 140 N 0.00 0.57 0.00 1.47 0.00 -1.00 -5.06 118.16 114.14 3hkb n LYS 140 Ca 0.00 -2.57 0.06 0.00 -0.00 0.00 0.00 58.31 55.80 3hkb n LYS 140 Cb 0.55 -1.44 0.05 0.00 -0.00 0.00 0.00 35.03 34.19 3hkb n LYS 140 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.40 177.79