#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hgk n VAL 32 N 0.00 0.03 -4.36 1.96 0.31 -1.26 -5.01 118.33 110.00 3hgk n VAL 32 Ca 0.00 -0.52 -0.25 0.00 -0.01 0.00 0.00 64.34 63.57 3hgk n VAL 32 Cb 0.00 1.31 -0.09 0.00 -0.91 0.00 0.00 33.84 34.15 3hgk n VAL 32 CO 0.00 0.00 0.00 -1.81 -1.32 0.00 0.00 176.83 173.70 3hgk s ASP 33 N -1.33 4.05 0.00 4.52 1.01 -1.26 -5.04 116.67 118.62 3hgk s ASP 33 Ca 0.19 -0.78 0.06 0.00 0.71 0.00 0.00 52.55 52.73 3hgk s ASP 33 Cb 0.14 -0.58 0.09 0.00 1.01 0.00 0.00 42.92 43.58 3hgk s ASP 33 CO 0.20 0.05 1.03 -0.11 0.21 0.00 0.00 175.17 176.56 3hgk n LEU 34 N -0.47 -0.56 -3.48 1.23 0.00 -1.26 -4.92 117.00 107.54 3hgk n LEU 34 Ca -0.08 -1.99 -0.40 0.00 0.00 0.00 0.00 56.01 53.54 3hgk n LEU 34 Cb 0.58 0.00 -0.00 0.00 0.00 0.00 0.00 43.42 44.00 3hgk n LEU 34 CO 0.37 1.28 2.26 -1.84 0.00 0.00 0.00 177.39 179.46 3hgk n GLU 35 N 0.11 4.67 -4.00 1.96 0.28 -1.26 -4.93 120.64 117.47 3hgk n GLU 35 Ca -0.20 -3.60 -0.32 0.00 -0.16 0.00 0.00 57.16 52.88 3hgk n GLU 35 Cb 0.80 -2.60 -0.15 0.00 1.43 0.00 0.00 31.44 30.92 3hgk n GLU 35 CO 0.00 0.00 0.00 -2.00 -0.16 0.00 0.00 177.13 174.97 3hgk s GLU 36 N -1.59 1.73 0.73 3.44 2.12 -1.26 -3.58 118.70 120.29 3hgk s GLU 36 Ca 0.52 -1.74 -0.11 0.00 0.36 0.00 0.00 54.97 54.00 3hgk s GLU 36 Cb 0.19 -3.19 0.03 0.00 0.26 0.00 0.00 34.13 31.42 3hgk s GLU 36 CO -0.10 -0.87 1.08 0.00 -0.54 0.00 0.00 175.26 174.83 3hgk s ALA 37 N 0.98 2.61 -0.01 6.30 0.00 -1.09 -4.90 121.76 125.64 3hgk s ALA 37 Ca 0.06 -0.18 0.02 0.00 0.00 0.00 0.00 51.96 51.85 3hgk s ALA 37 Cb -0.20 -3.09 0.00 0.00 0.00 0.00 0.00 23.12 19.83 3hgk s ALA 37 CO -0.07 -1.35 -0.05 -0.08 0.00 0.00 0.00 175.76 174.21 3hgk s THR 38 N -3.20 0.43 0.00 0.00 -1.32 -1.26 -4.42 115.64 105.87 3hgk s THR 38 Ca 0.59 -0.19 0.00 0.00 -1.21 0.00 0.00 61.69 60.88 3hgk s THR 38 Cb -0.13 -0.40 0.00 0.00 -1.51 0.00 0.00 72.50 70.47 3hgk s THR 38 CO 0.54 0.14 0.00 0.59 -2.21 0.00 0.00 174.62 173.68 3hgk n ASN 39 N 3.23 0.00 0.00 8.08 3.02 -1.26 -5.02 115.26 123.31 3hgk n ASN 39 Ca -0.16 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.39 3hgk n ASN 39 Cb 0.56 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.73 3hgk n ASN 39 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 3hgk n ASN 40 N 0.94 0.00 -1.16 6.41 5.15 -1.26 -5.11 115.26 120.23 3hgk n ASN 40 Ca 0.00 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 53.98 3hgk n ASN 40 Cb 0.00 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.25 3hgk n ASN 40 CO 0.00 0.00 0.00 2.22 1.40 0.00 0.00 177.26 180.88 3hgk n PHE 41 N 0.00 -1.62 -3.59 1.20 1.16 -1.26 -5.11 117.46 108.24 3hgk n PHE 41 Ca 0.00 0.00 -0.34 0.00 -1.87 0.00 0.00 57.45 55.24 3hgk n PHE 41 Cb 0.00 0.00 -0.05 0.00 -1.61 0.00 0.00 39.48 37.82 3hgk n PHE 41 CO 0.00 0.00 0.00 0.16 -1.87 0.00 0.00 176.76 175.05 3hgk s ASP 42 N -0.94 6.61 -0.03 5.98 -4.77 -1.26 -5.03 116.67 117.23 3hgk s ASP 42 Ca 0.00 0.76 -0.30 0.00 -3.30 0.00 0.00 52.55 49.71 3hgk s ASP 42 Cb 0.00 -2.16 -0.06 0.00 -1.09 0.00 0.00 42.92 39.60 3hgk s ASP 42 CO 0.00 0.15 1.76 -1.00 0.70 0.00 0.00 175.17 176.77 3hgk s HIS 43 N -1.45 1.76 -0.89 2.11 3.76 -1.26 -4.97 115.29 114.35 3hgk s HIS 43 Ca 0.35 0.00 -0.18 0.00 -0.15 0.00 0.00 55.06 55.08 3hgk s HIS 43 Cb -0.14 -4.02 0.15 0.00 1.11 0.00 0.00 32.58 29.68 3hgk s HIS 43 CO 0.19 -4.36 1.03 0.21 -0.85 0.00 0.00 174.74 170.96 3hgk s LYS 44 N 4.21 3.56 -0.41 1.40 2.47 -1.26 -4.99 119.74 124.72 3hgk s LYS 44 Ca 0.78 -1.86 -0.37 0.00 -1.56 0.00 0.00 55.97 52.96 3hgk s LYS 44 Cb -0.36 -4.77 -0.16 0.00 -1.46 0.00 0.00 37.83 31.08 3hgk s LYS 44 CO 0.33 -1.66 1.58 1.19 0.16 0.00 0.00 175.35 176.95 3hgk n PHE 45 N 6.03 1.14 -3.99 4.03 3.01 -1.26 -4.62 117.46 121.79 3hgk n PHE 45 Ca 0.20 0.75 -0.11 0.00 1.01 0.00 0.00 57.45 59.29 3hgk n PHE 45 Cb 0.48 -1.86 -0.03 0.00 -0.01 0.00 0.00 39.48 38.07 3hgk n PHE 45 CO 0.00 0.00 0.00 -0.51 1.01 0.00 0.00 176.76 177.26 3hgk s LEU 46 N 3.95 0.53 0.00 4.37 1.43 -1.26 -5.01 118.68 122.69 3hgk s LEU 46 Ca 0.93 -1.20 0.00 0.00 -1.03 0.00 0.00 54.13 52.83 3hgk s LEU 46 Cb -1.23 1.88 0.00 0.00 0.03 0.00 0.00 46.19 46.88 3hgk s LEU 46 CO 0.59 -1.33 0.00 2.30 0.23 0.00 0.00 176.35 178.15 3hgk n ILE 47 N -0.49 0.00 -3.58 -0.59 -5.35 -1.26 -4.39 119.36 103.70 3hgk n ILE 47 Ca -0.02 0.00 -0.17 0.00 -0.27 0.00 0.00 62.75 62.29 3hgk n ILE 47 Cb 0.61 0.00 0.01 0.00 -1.74 0.00 0.00 39.64 38.52 3hgk n ILE 47 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3hgk n GLY 48 N 0.00 2.62 3.28 3.28 0.00 -1.21 -5.05 105.19 108.11 3hgk n GLY 48 Ca 0.00 -2.24 -0.14 0.00 0.00 0.00 0.00 46.02 43.64 3hgk n GLY 48 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 3hgk s HIS 49 N -1.78 -0.33 0.24 1.61 2.46 -1.26 -3.52 115.29 112.71 3hgk s HIS 49 Ca 0.27 0.70 0.02 0.00 0.47 0.00 0.00 55.06 56.52 3hgk s HIS 49 Cb -0.02 0.14 -0.05 0.00 -0.13 0.00 0.00 32.58 32.52 3hgk s HIS 49 CO 0.17 -0.32 0.04 0.20 -2.47 0.00 0.00 174.74 172.36 3hgk s GLY 50 N -0.59 1.61 0.03 1.59 0.00 -0.34 -4.90 107.32 104.71 3hgk s GLY 50 Ca -0.07 -1.80 -0.08 0.00 0.00 0.00 0.00 44.72 42.77 3hgk s GLY 50 CO 0.03 -1.63 1.12 -2.08 0.00 0.00 0.00 173.10 170.54 3hgk h VAL 51 N 2.44 0.00 -3.53 1.40 2.07 -2.00 -3.27 116.25 113.36 3hgk h VAL 51 Ca -0.38 0.00 -0.67 0.00 0.82 0.00 0.00 66.70 66.46 3hgk h VAL 51 Cb 1.23 0.00 -0.37 0.00 -1.52 0.00 0.00 31.29 30.63 3hgk h VAL 51 CO 0.63 0.00 -0.57 -0.36 0.02 0.00 0.00 177.57 177.30 3hgk s PHE 52 N -3.60 3.51 0.00 1.57 0.40 -1.26 -5.05 117.98 113.55 3hgk s PHE 52 Ca -0.03 -2.80 0.00 0.00 -0.60 0.00 0.00 56.93 53.50 3hgk s PHE 52 Cb 0.02 -3.06 0.00 0.00 0.51 0.00 0.00 43.02 40.48 3hgk s PHE 52 CO 0.14 -0.89 0.00 0.41 0.70 0.00 0.00 175.22 175.58 3hgk n GLY 53 N 3.95 1.65 3.74 4.36 0.00 -1.24 -4.65 105.19 113.01 3hgk n GLY 53 Ca 0.03 -2.04 -0.32 0.00 0.00 0.00 0.00 46.02 43.68 3hgk n GLY 53 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3hgk s LYS 54 N -1.35 2.17 -0.05 1.61 1.02 0.19 -1.20 119.74 122.13 3hgk s LYS 54 Ca 0.00 -2.39 -0.03 0.00 0.02 0.00 0.00 55.97 53.57 3hgk s LYS 54 Cb 0.00 -1.40 0.02 0.00 -0.52 0.00 0.00 37.83 35.94 3hgk s LYS 54 CO 0.00 -0.40 0.12 0.08 -0.92 0.00 0.00 175.35 174.24 3hgk s VAL 55 N -2.93 -0.02 0.03 3.17 1.01 -1.23 -1.99 120.40 118.44 3hgk s VAL 55 Ca 0.07 0.09 0.03 0.00 0.00 0.00 0.00 61.98 62.16 3hgk s VAL 55 Cb 0.01 -0.19 -0.02 0.00 0.00 0.00 0.00 36.38 36.18 3hgk s VAL 55 CO 0.04 0.04 -0.10 -0.31 0.00 0.00 0.00 175.10 174.76 3hgk s TYR 56 N 0.57 0.90 -0.41 5.22 1.51 0.40 -3.33 117.35 122.22 3hgk s TYR 56 Ca -0.04 -0.31 -0.21 0.00 -1.01 0.00 0.00 57.07 55.50 3hgk s TYR 56 Cb -0.06 -0.55 0.02 0.00 -0.11 0.00 0.00 41.96 41.26 3hgk s TYR 56 CO -0.03 -0.01 0.64 0.21 -1.11 0.00 0.00 175.55 175.26 3hgk s LYS 57 N -0.93 3.40 -0.14 -0.62 2.20 -1.26 -1.41 119.74 120.98 3hgk s LYS 57 Ca -0.01 -0.24 -0.00 0.00 -0.36 0.00 0.00 55.97 55.36 3hgk s LYS 57 Cb -0.07 -3.91 0.03 0.00 -1.51 0.00 0.00 37.83 32.38 3hgk s LYS 57 CO 0.01 -0.93 -0.08 0.20 -0.36 0.00 0.00 175.35 174.19 3hgk s GLY 58 N 1.95 0.94 0.13 5.54 0.00 -1.05 -4.88 107.32 109.95 3hgk s GLY 58 Ca 0.23 -0.75 -0.30 0.00 0.00 0.00 0.00 44.72 43.90 3hgk s GLY 58 CO 0.18 0.82 1.15 0.14 0.00 0.00 0.00 173.10 175.39 3hgk s VAL 59 N 1.63 3.93 0.87 1.40 1.01 -1.26 -3.45 120.40 124.52 3hgk s VAL 59 Ca 0.03 1.53 -0.08 0.00 0.00 0.00 0.00 61.98 63.46 3hgk s VAL 59 Cb -0.14 -3.98 0.19 0.00 0.00 0.00 0.00 36.38 32.45 3hgk s VAL 59 CO -0.08 0.20 1.19 0.18 0.00 0.00 0.00 175.10 176.59 3hgk n LEU 60 N 3.02 0.00 0.09 3.92 4.77 -0.89 -4.98 117.00 122.93 3hgk n LEU 60 Ca 0.05 -1.84 -0.00 0.00 -0.03 0.00 0.00 56.01 54.19 3hgk n LEU 60 Cb 0.46 -0.85 0.29 0.00 -2.33 0.00 0.00 43.42 41.00 3hgk n LEU 60 CO 0.55 -1.23 0.76 0.03 -1.33 0.00 0.00 177.39 176.17 3hgk h ARG 61 N 0.00 0.27 -0.10 3.23 3.08 -1.96 -2.94 114.38 115.96 3hgk h ARG 61 Ca -0.39 -0.09 0.00 0.00 0.07 0.00 0.00 59.98 59.57 3hgk h ARG 61 Cb 1.23 -0.02 0.00 0.00 0.08 0.00 0.00 29.97 31.26 3hgk h ARG 61 CO 0.34 0.52 0.00 -0.40 -1.07 0.00 0.00 179.97 179.36 3hgk n ASP 62 N -4.15 1.33 0.00 7.04 5.75 -1.26 -4.91 116.55 120.35 3hgk n ASP 62 Ca -0.01 -1.59 0.00 0.00 -0.01 0.00 0.00 54.79 53.18 3hgk n ASP 62 Cb 0.38 -0.06 0.00 0.00 -1.03 0.00 0.00 41.12 40.40 3hgk n ASP 62 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3hgk n GLY 63 N 1.09 0.73 3.73 6.12 0.00 -1.11 -5.05 105.19 110.70 3hgk n GLY 63 Ca 0.17 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.77 3hgk n GLY 63 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hgk s ALA 64 N -2.50 3.46 -0.41 4.61 0.00 -1.26 -4.75 121.76 120.91 3hgk s ALA 64 Ca 0.00 0.98 -0.28 0.00 0.00 0.00 0.00 51.96 52.67 3hgk s ALA 64 Cb 0.00 -3.44 0.02 0.00 0.00 0.00 0.00 23.12 19.70 3hgk s ALA 64 CO 0.00 -0.43 1.04 0.15 0.00 0.00 0.00 175.76 176.52 3hgk s LYS 65 N 0.00 3.81 0.04 0.00 3.01 -1.26 -2.09 119.74 123.25 3hgk s LYS 65 Ca 0.55 0.64 0.06 0.00 -1.01 0.00 0.00 55.97 56.21 3hgk s LYS 65 Cb -0.33 -3.84 -0.02 0.00 -1.01 0.00 0.00 37.83 32.62 3hgk s LYS 65 CO 0.36 -1.14 -0.17 0.54 0.51 0.00 0.00 175.35 175.45 3hgk s VAL 66 N 3.93 1.34 -0.13 3.17 0.11 -1.22 -2.36 120.40 125.23 3hgk s VAL 66 Ca 0.43 -1.08 -0.07 0.00 -2.93 0.00 0.00 61.98 58.34 3hgk s VAL 66 Cb -0.10 -1.19 -0.04 0.00 -1.53 0.00 0.00 36.38 33.52 3hgk s VAL 66 CO 0.24 0.09 0.12 0.00 -3.33 0.00 0.00 175.10 172.22 3hgk s ALA 67 N -0.83 3.77 -0.18 1.54 0.00 0.36 -2.52 121.76 123.91 3hgk s ALA 67 Ca 0.04 -0.67 0.00 0.00 0.00 0.00 0.00 51.96 51.34 3hgk s ALA 67 Cb -0.08 -1.95 0.04 0.00 0.00 0.00 0.00 23.12 21.13 3hgk s ALA 67 CO 0.01 0.53 -0.09 -0.51 0.00 0.00 0.00 175.76 175.70 3hgk s LEU 68 N -0.75 1.97 -1.02 0.00 2.01 -0.50 -0.64 118.68 119.75 3hgk s LEU 68 Ca 0.13 -0.75 -0.02 0.00 0.01 0.00 0.00 54.13 53.50 3hgk s LEU 68 Cb -0.12 -1.13 0.31 0.00 0.01 0.00 0.00 46.19 45.26 3hgk s LEU 68 CO 0.03 -0.14 1.47 1.17 1.01 0.00 0.00 176.35 179.89 3hgk n LYS 69 N 4.76 4.47 -1.68 1.70 4.81 -0.21 -0.45 118.16 131.55 3hgk n LYS 69 Ca -0.14 -4.60 -0.44 0.00 -0.87 0.00 0.00 58.31 52.26 3hgk n LYS 69 Cb 0.47 -2.47 -0.04 0.00 0.02 0.00 0.00 35.03 33.01 3hgk n LYS 69 CO 0.00 0.00 0.00 -2.13 1.17 0.00 0.00 177.40 176.44 3hgk n ARG 70 N 0.96 2.53 -1.16 1.64 3.00 -0.84 -3.56 116.66 119.24 3hgk n ARG 70 Ca 0.30 0.92 -0.10 0.00 -0.00 0.00 0.00 57.85 58.97 3hgk n ARG 70 Cb 0.33 -2.78 0.14 0.00 0.00 0.00 0.00 32.46 30.15 3hgk n ARG 70 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.63 178.17 3hgk n ARG 71 N 5.42 2.36 0.10 -0.14 1.74 -1.23 0.56 116.66 125.47 3hgk n ARG 71 Ca 0.19 -3.51 -0.02 0.00 -0.77 0.00 0.00 57.85 53.74 3hgk n ARG 71 Cb 0.34 -1.94 -0.04 0.00 -1.02 0.00 0.00 32.46 29.79 3hgk n ARG 71 CO 0.00 0.00 0.00 1.15 -1.52 0.00 0.00 177.63 177.26 3hgk h THR 72 N 1.34 1.18 -2.62 0.55 2.02 -1.89 -3.42 112.91 110.07 3hgk h THR 72 Ca 0.25 -2.69 -0.54 0.00 0.77 0.00 0.00 66.41 64.19 3hgk h THR 72 Cb 1.40 2.57 -0.00 0.00 -1.74 0.00 0.00 68.15 70.38 3hgk h THR 72 CO 0.51 0.67 1.07 -2.84 0.37 0.00 0.00 175.52 175.30 3hgk s PRO 73 N -2.85 4.19 -0.56 6.66 0.02 -1.26 -4.09 135.00 137.11 3hgk s PRO 73 Ca 0.02 2.23 -0.15 0.00 0.02 0.00 0.00 61.00 63.12 3hgk s PRO 73 Cb 0.09 -3.92 0.02 0.00 0.02 0.00 0.00 34.50 30.71 3hgk s PRO 73 CO 0.78 -0.82 0.64 0.39 -0.33 0.00 0.00 177.00 177.66 3hgk n GLU 74 N 6.83 -1.93 -0.70 5.54 -0.58 -1.26 -3.72 120.64 124.82 3hgk n GLU 74 Ca 0.17 1.66 -0.12 0.00 -0.42 0.00 0.00 57.16 58.44 3hgk n GLU 74 Cb 0.42 -4.51 -0.09 0.00 -0.57 0.00 0.00 31.44 26.70 3hgk n GLU 74 CO 0.00 0.00 0.00 -1.13 -0.48 0.00 0.00 177.13 175.52 3hgk n SER 75 N -0.92 4.01 -4.58 1.62 3.41 -1.26 -4.61 113.62 111.29 3hgk n SER 75 Ca -0.01 -2.20 -0.43 0.00 -0.26 0.00 0.00 58.87 55.97 3hgk n SER 75 Cb 0.55 -0.99 -0.00 0.00 -0.26 0.00 0.00 64.21 63.50 3hgk n SER 75 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 3hgk s SER 76 N 2.55 6.84 -1.80 4.04 0.01 -1.26 -3.98 113.70 120.10 3hgk s SER 76 Ca 0.44 -2.45 0.00 0.00 1.31 0.00 0.00 55.95 55.25 3hgk s SER 76 Cb 0.19 -2.57 0.00 0.00 0.21 0.00 0.00 66.02 63.84 3hgk s SER 76 CO -0.01 -1.16 0.00 1.67 0.41 0.00 0.00 173.24 174.15 3hgk n GLN 77 N 8.32 -1.52 0.00 12.44 -0.06 -1.26 -4.83 117.38 130.47 3hgk n GLN 77 Ca 0.48 1.01 0.00 0.00 -2.00 0.00 0.00 57.00 56.49 3hgk n GLN 77 Cb 0.46 -5.42 0.00 0.00 -4.06 0.00 0.00 30.24 21.22 3hgk n GLN 77 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 3hgk n GLY 78 N -0.49 -0.30 0.10 1.69 0.00 -1.26 -3.05 105.19 101.90 3hgk n GLY 78 Ca -0.19 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.62 3hgk n GLY 78 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 3hgk n ILE 79 N -0.43 1.52 -0.30 -0.61 -0.00 -1.26 -3.46 119.36 114.83 3hgk n ILE 79 Ca 0.00 -0.04 -0.04 0.00 -0.00 0.00 0.00 62.75 62.67 3hgk n ILE 79 Cb 0.01 -2.06 0.07 0.00 -0.00 0.00 0.00 39.64 37.66 3hgk n ILE 79 CO 0.00 0.00 0.00 -0.08 -0.00 0.00 0.00 176.55 176.47 3hgk h GLU 80 N -1.00 1.11 -0.05 0.38 4.81 -1.96 -0.85 114.58 117.03 3hgk h GLU 80 Ca -0.35 -0.11 0.01 0.00 -0.13 0.00 0.00 59.36 58.79 3hgk h GLU 80 Cb 1.26 -0.23 -0.01 0.00 0.63 0.00 0.00 28.75 30.40 3hgk h GLU 80 CO -0.21 0.79 -0.03 0.93 -0.73 0.00 0.00 179.01 179.76 3hgk h GLU 81 N 1.12 -0.03 -0.72 1.92 5.08 -1.78 -0.73 114.58 119.44 3hgk h GLU 81 Ca 0.29 0.00 0.11 0.00 -1.00 0.00 0.00 59.36 58.76 3hgk h GLU 81 Cb -0.03 0.01 -0.08 0.00 0.50 0.00 0.00 28.75 29.15 3hgk h GLU 81 CO -0.05 -0.02 0.34 0.35 -1.00 0.00 0.00 179.01 178.62 3hgk h PHE 82 N -0.03 0.59 0.27 4.33 3.04 -1.43 -0.53 116.94 123.18 3hgk h PHE 82 Ca 0.03 0.03 -0.01 0.00 3.98 0.00 0.00 57.97 62.00 3hgk h PHE 82 Cb 0.08 -0.16 0.00 0.00 2.56 0.00 0.00 35.95 38.43 3hgk h PHE 82 CO -0.13 0.18 -0.13 0.93 -2.02 0.00 0.00 178.31 177.14 3hgk h GLU 83 N 0.55 -0.34 -0.85 1.11 5.08 -0.96 -2.65 114.58 116.51 3hgk h GLU 83 Ca 0.37 0.02 0.21 0.00 -1.00 0.00 0.00 59.36 58.95 3hgk h GLU 83 Cb 0.44 0.08 -0.05 0.00 0.50 0.00 0.00 28.75 29.72 3hgk h GLU 83 CO -0.31 0.00 0.58 1.15 -1.00 0.00 0.00 179.01 179.43 3hgk h THR 84 N -0.78 0.67 0.00 1.13 2.02 -0.81 0.73 112.91 115.87 3hgk h THR 84 Ca -0.04 -0.10 0.00 0.00 0.77 0.00 0.00 66.41 67.05 3hgk h THR 84 Cb 0.51 0.36 0.00 0.00 -1.74 0.00 0.00 68.15 67.27 3hgk h THR 84 CO 0.06 0.05 0.00 1.21 0.37 0.00 0.00 175.52 177.21 3hgk n GLU 85 N -4.45 0.25 -0.09 6.66 2.13 -0.24 -0.94 120.64 123.96 3hgk n GLU 85 Ca 0.18 0.30 -0.19 0.00 0.66 0.00 0.00 57.16 58.12 3hgk n GLU 85 Cb 0.73 -1.85 -0.12 0.00 0.27 0.00 0.00 31.44 30.47 3hgk n GLU 85 CO 0.00 0.00 0.00 0.82 -0.41 0.00 0.00 177.13 177.54 3hgk h ILE 86 N 0.00 1.22 0.28 6.31 2.04 0.77 -3.19 117.51 124.94 3hgk h ILE 86 Ca 0.00 -2.22 -0.01 0.00 1.00 0.00 0.00 64.86 63.63 3hgk h ILE 86 Cb 0.61 2.61 0.00 0.00 -0.74 0.00 0.00 36.82 39.30 3hgk h ILE 86 CO 0.00 0.41 -0.13 1.05 0.00 0.00 0.00 178.15 179.48 3hgk h GLU 87 N -1.00 -0.36 -0.02 2.37 4.11 -1.20 0.14 114.58 118.62 3hgk h GLU 87 Ca -0.22 0.02 0.01 0.00 0.07 0.00 0.00 59.36 59.24 3hgk h GLU 87 Cb 1.18 0.08 -0.00 0.00 0.50 0.00 0.00 28.75 30.51 3hgk h GLU 87 CO -0.13 -0.02 0.01 1.15 0.07 0.00 0.00 179.01 180.09 3hgk h THR 88 N -0.77 0.93 0.00 -1.06 2.02 -1.27 -2.96 112.91 109.80 3hgk h THR 88 Ca -0.04 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.14 3hgk h THR 88 Cb 0.50 0.99 0.00 0.00 -1.74 0.00 0.00 68.15 67.90 3hgk h THR 88 CO 0.06 0.00 -1.00 -0.11 0.37 0.00 0.00 175.52 174.84 3hgk n LEU 89 N -4.45 0.76 0.00 2.58 7.94 -1.21 -4.21 117.00 118.42 3hgk n LEU 89 Ca -0.03 -0.44 0.07 0.00 -1.11 0.00 0.00 56.01 54.50 3hgk n LEU 89 Cb 0.11 0.00 0.39 0.00 0.53 0.00 0.00 43.42 44.45 3hgk n LEU 89 CO 0.33 0.19 0.60 -1.20 -1.11 0.00 0.00 177.39 176.20 3hgk n SER 90 N -1.53 0.00 -1.22 1.96 7.64 0.49 -1.14 113.62 119.83 3hgk n SER 90 Ca 0.03 -0.57 0.05 0.00 1.01 0.00 0.00 58.87 59.39 3hgk n SER 90 Cb 0.32 0.00 0.24 0.00 -1.01 0.00 0.00 64.21 63.76 3hgk n SER 90 CO 0.00 0.00 0.00 0.49 -3.01 0.00 0.00 175.04 172.52 3hgk n PHE 91 N -0.92 1.10 -0.89 1.43 3.01 -1.26 -4.94 117.46 115.00 3hgk n PHE 91 Ca 0.10 -0.41 -0.14 0.00 1.01 0.00 0.00 57.45 58.01 3hgk n PHE 91 Cb 0.04 -0.24 -0.04 0.00 -0.01 0.00 0.00 39.48 39.23 3hgk n PHE 91 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 3hgk n ARG 93 N 5.16 1.69 -3.51 0.00 3.00 -1.26 -4.96 116.66 116.78 3hgk n ARG 93 Ca 0.16 -4.07 -0.15 0.00 -0.00 0.00 0.00 57.85 53.78 3hgk n ARG 93 Cb 0.34 -1.88 -0.05 0.00 0.00 0.00 0.00 32.46 30.87 3hgk n ARG 93 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.63 176.05 3hgk s HIS 94 N -1.76 -0.57 -2.51 -0.14 2.46 -1.26 -5.03 115.29 106.47 3hgk s HIS 94 Ca 0.36 0.87 0.26 0.00 0.47 0.00 0.00 55.06 57.02 3hgk s HIS 94 Cb 0.13 0.45 0.88 0.00 -0.13 0.00 0.00 32.58 33.90 3hgk s HIS 94 CO -0.07 -0.60 1.64 -0.35 -2.47 0.00 0.00 174.74 172.89 3hgk n PRO 95 N 0.61 1.78 -0.38 2.88 -0.04 -1.26 -4.14 135.00 134.45 3hgk n PRO 95 Ca -0.17 -1.14 0.08 0.00 -0.04 0.00 0.00 63.50 62.23 3hgk n PRO 95 Cb 0.59 -1.46 0.17 0.00 -0.04 0.00 0.00 33.50 32.75 3hgk n PRO 95 CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 3hgk n HIS 96 N 0.38 0.00 -4.13 0.54 8.25 -1.26 -4.75 115.22 114.25 3hgk n HIS 96 Ca 0.18 -1.22 -0.15 0.00 -0.26 0.00 0.00 57.72 56.27 3hgk n HIS 96 Cb 0.38 -0.20 -0.13 0.00 1.12 0.00 0.00 29.99 31.17 3hgk n HIS 96 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 3hgk s LEU 97 N -2.94 2.13 0.08 2.41 1.02 -1.26 -1.70 118.68 118.43 3hgk s LEU 97 Ca 0.34 -0.31 -0.31 0.00 0.02 0.00 0.00 54.13 53.87 3hgk s LEU 97 Cb 0.32 -0.24 -0.08 0.00 0.02 0.00 0.00 46.19 46.22 3hgk s LEU 97 CO -0.03 -0.05 1.48 -0.69 0.02 0.00 0.00 176.35 177.08 3hgk s VAL 98 N -0.71 3.24 -0.21 -1.59 1.01 0.14 -4.63 120.40 117.65 3hgk s VAL 98 Ca -0.03 0.80 -0.18 0.00 0.00 0.00 0.00 61.98 62.57 3hgk s VAL 98 Cb -0.06 -3.51 -0.03 0.00 0.00 0.00 0.00 36.38 32.78 3hgk s VAL 98 CO 0.00 0.03 0.51 -0.55 0.00 0.00 0.00 175.10 175.09 3hgk s SER 99 N 1.58 6.53 -0.08 3.32 0.15 -1.26 -4.95 113.70 118.99 3hgk s SER 99 Ca 0.67 0.64 -0.24 0.00 0.70 0.00 0.00 55.95 57.72 3hgk s SER 99 Cb -0.37 -2.29 -0.03 0.00 -1.71 0.00 0.00 66.02 61.62 3hgk s SER 99 CO 0.30 -0.18 0.76 -0.22 1.20 0.00 0.00 173.24 175.09 3hgk s LEU 100 N 1.69 4.29 -0.15 3.45 0.20 -1.26 -3.02 118.68 123.87 3hgk s LEU 100 Ca 0.23 1.23 -0.13 0.00 0.69 0.00 0.00 54.13 56.15 3hgk s LEU 100 Cb -0.15 -3.16 -0.10 0.00 -0.43 0.00 0.00 46.19 42.35 3hgk s LEU 100 CO 0.09 -0.19 0.08 0.40 -0.29 0.00 0.00 176.35 176.44 3hgk h ILE 101 N 4.86 0.47 -2.74 6.68 2.04 -0.04 -3.48 117.51 125.30 3hgk h ILE 101 Ca -0.39 -1.50 -0.09 0.00 1.00 0.00 0.00 64.86 63.89 3hgk h ILE 101 Cb 1.19 1.04 -0.02 0.00 -0.74 0.00 0.00 36.82 38.28 3hgk h ILE 101 CO 0.77 0.16 -0.01 0.61 0.00 0.00 0.00 178.15 179.68 3hgk n GLY 102 N 1.60 2.38 3.44 5.37 0.00 -1.20 -4.82 105.19 111.95 3hgk n GLY 102 Ca -0.13 -1.38 -0.16 0.00 0.00 0.00 0.00 46.02 44.35 3hgk n GLY 102 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 3hgk s PHE 103 N -4.68 1.30 -0.29 1.61 -0.71 -1.23 -1.08 117.98 112.89 3hgk s PHE 103 Ca 0.11 -1.43 -0.12 0.00 -1.04 0.00 0.00 56.93 54.45 3hgk s PHE 103 Cb -0.01 -0.25 0.11 0.00 -1.21 0.00 0.00 43.02 41.66 3hgk s PHE 103 CO 0.08 -1.10 0.65 0.00 -1.34 0.00 0.00 175.22 173.51 3hgk n ASP 105 N 5.05 2.63 -4.67 0.00 -0.08 -1.26 -2.60 116.55 115.63 3hgk n ASP 105 Ca -0.15 -2.06 -0.43 0.00 -1.51 0.00 0.00 54.79 50.65 3hgk n ASP 105 Cb 0.52 -0.17 -0.02 0.00 2.34 0.00 0.00 41.12 43.79 3hgk n ASP 105 CO 0.00 0.00 0.00 -0.70 0.12 0.00 0.00 177.20 176.62 3hgk s GLU 106 N -1.11 4.26 -0.87 -0.67 2.12 -1.26 -3.85 118.70 117.32 3hgk s GLU 106 Ca 0.16 1.72 -0.02 0.00 0.36 0.00 0.00 54.97 57.19 3hgk s GLU 106 Cb 0.09 -3.72 -0.03 0.00 0.26 0.00 0.00 34.13 30.73 3hgk s GLU 106 CO 0.10 -0.65 0.74 0.54 -0.54 0.00 0.00 175.26 175.45 3hgk n ARG 107 N 6.26 -3.34 0.00 4.30 1.74 -1.26 -3.68 116.66 120.69 3hgk n ARG 107 Ca 0.13 0.67 0.00 0.00 -0.77 0.00 0.00 57.85 57.88 3hgk n ARG 107 Cb 0.45 -4.98 0.00 0.00 -1.02 0.00 0.00 32.46 26.91 3hgk n ARG 107 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 3hgk n ASN 108 N -2.75 0.00 -4.70 0.55 3.02 -1.25 -4.94 115.26 105.19 3hgk n ASN 108 Ca -0.13 0.00 -0.33 0.00 -0.03 0.00 0.00 54.58 54.09 3hgk n ASN 108 Cb 0.61 -0.12 0.13 0.00 -0.61 0.00 0.00 39.78 39.79 3hgk n ASN 108 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 3hgk s GLU 109 N 0.00 1.59 -0.44 3.52 0.41 -1.24 -4.97 118.70 117.56 3hgk s GLU 109 Ca 0.00 1.69 0.07 0.00 -0.41 0.00 0.00 54.97 56.31 3hgk s GLU 109 Cb 0.00 -1.78 0.23 0.00 -1.78 0.00 0.00 34.13 30.80 3hgk s GLU 109 CO 0.00 -2.24 0.63 0.00 -0.49 0.00 0.00 175.26 173.17 3hgk n MET 110 N -3.44 0.62 -2.21 1.61 0.00 -1.24 -3.98 117.12 108.49 3hgk n MET 110 Ca 0.13 -2.59 -0.30 0.00 0.00 0.00 0.00 57.70 54.94 3hgk n MET 110 Cb 0.51 -1.40 0.00 0.00 0.00 0.00 0.00 33.22 32.33 3hgk n MET 110 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 175.97 176.39 3hgk s ILE 111 N -0.11 4.78 0.00 3.17 1.01 -1.07 -3.47 121.20 125.51 3hgk s ILE 111 Ca 0.33 0.64 0.04 0.00 0.00 0.00 0.00 60.65 61.65 3hgk s ILE 111 Cb 0.14 -3.86 -0.01 0.00 0.01 0.00 0.00 42.46 38.75 3hgk s ILE 111 CO -0.16 -1.00 -0.11 -0.76 0.00 0.00 0.00 174.94 172.91 3hgk s LEU 112 N -4.92 2.06 -0.10 2.97 1.43 -1.23 -2.48 118.68 116.41 3hgk s LEU 112 Ca 0.52 -0.27 0.03 0.00 -1.03 0.00 0.00 54.13 53.39 3hgk s LEU 112 Cb -0.11 -0.54 -0.01 0.00 0.03 0.00 0.00 46.19 45.56 3hgk s LEU 112 CO 0.49 0.09 -0.20 -0.63 0.23 0.00 0.00 176.35 176.33 3hgk s ILE 113 N -0.43 2.46 0.16 -0.59 1.01 -0.24 -1.05 121.20 122.51 3hgk s ILE 113 Ca 0.03 -0.89 -0.01 0.00 0.00 0.00 0.00 60.65 59.78 3hgk s ILE 113 Cb -0.05 -1.96 -0.04 0.00 0.01 0.00 0.00 42.46 40.41 3hgk s ILE 113 CO -0.00 0.55 0.08 -0.31 0.00 0.00 0.00 174.94 175.26 3hgk s TYR 114 N 0.13 1.01 0.10 3.97 1.51 0.19 0.72 117.35 124.98 3hgk s TYR 114 Ca -0.10 -1.27 -0.31 0.00 -1.01 0.00 0.00 57.07 54.37 3hgk s TYR 114 Cb -0.16 -0.53 -0.08 0.00 -0.11 0.00 0.00 41.96 41.08 3hgk s TYR 114 CO 0.06 -0.54 1.55 0.15 -1.11 0.00 0.00 175.55 175.66 3hgk s LYS 115 N -4.08 4.24 0.31 -0.62 3.01 -1.17 0.13 119.74 121.56 3hgk s LYS 115 Ca 0.30 2.25 -0.29 0.00 -1.01 0.00 0.00 55.97 57.21 3hgk s LYS 115 Cb 0.07 -3.40 -0.11 0.00 -1.01 0.00 0.00 37.83 33.38 3hgk s LYS 115 CO 0.06 -0.62 1.55 -0.47 0.51 0.00 0.00 175.35 176.37 3hgk s TYR 116 N 1.88 2.74 -0.39 3.18 5.04 -1.00 -4.56 117.35 124.25 3hgk s TYR 116 Ca 0.70 0.91 -0.09 0.00 -2.44 0.00 0.00 57.07 56.14 3hgk s TYR 116 Cb -0.39 -4.03 0.06 0.00 0.35 0.00 0.00 41.96 37.95 3hgk s TYR 116 CO 0.31 -3.32 0.22 -1.64 -1.34 0.00 0.00 175.55 169.77 3hgk s MET 117 N -0.90 2.68 0.31 4.97 -1.94 -1.26 -4.96 119.30 118.19 3hgk s MET 117 Ca 0.60 -1.29 0.07 0.00 -1.71 0.00 0.00 55.69 53.36 3hgk s MET 117 Cb -0.47 -3.72 0.83 0.00 2.01 0.00 0.00 34.83 33.49 3hgk s MET 117 CO 0.51 -0.83 1.70 0.93 -0.01 0.00 0.00 175.02 177.32 3hgk h GLU 118 N 8.39 0.41 -0.16 2.03 4.39 -1.85 -2.74 114.58 125.06 3hgk h GLU 118 Ca -0.24 -0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.44 3hgk h GLU 118 Cb 1.09 -0.09 0.00 0.00 -0.10 0.00 0.00 28.75 29.65 3hgk h GLU 118 CO 0.71 0.27 0.00 0.09 -1.16 0.00 0.00 179.01 178.92 3hgk n ASN 119 N -5.01 2.74 -0.11 1.42 3.02 -1.02 -5.01 115.26 111.29 3hgk n ASN 119 Ca 0.25 -1.88 0.00 0.00 -0.03 0.00 0.00 54.58 52.92 3hgk n ASN 119 Cb 0.74 -0.09 0.00 0.00 -0.61 0.00 0.00 39.78 39.81 3hgk n ASN 119 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3hgk n GLY 120 N 1.34 0.14 3.87 7.41 0.00 -1.04 -4.74 105.19 112.17 3hgk n GLY 120 Ca 0.17 -0.97 -0.30 0.00 0.00 0.00 0.00 46.02 44.92 3hgk n GLY 120 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3hgk s ASN 121 N -4.00 2.95 0.15 1.61 2.20 -1.26 -0.67 114.94 115.92 3hgk s ASN 121 Ca 0.00 0.42 -0.05 0.00 -0.94 0.00 0.00 52.86 52.29 3hgk s ASN 121 Cb 0.00 -0.57 -0.00 0.00 -2.00 0.00 0.00 41.25 38.67 3hgk s ASN 121 CO 0.00 -2.85 1.40 0.25 -2.94 0.00 0.00 177.10 172.96 3hgk h LEU 122 N -1.72 0.65 -0.62 3.54 5.85 -1.48 -3.27 115.31 118.26 3hgk h LEU 122 Ca -0.45 -0.42 0.09 0.00 0.84 0.00 0.00 57.88 57.95 3hgk h LEU 122 Cb 1.26 -0.19 -0.07 0.00 0.37 0.00 0.00 40.66 42.03 3hgk h LEU 122 CO 0.42 1.17 0.25 0.50 -0.34 0.00 0.00 178.44 180.44 3hgk h LYS 123 N 0.39 0.43 0.00 1.25 3.64 -1.90 -0.91 116.57 119.46 3hgk h LYS 123 Ca -0.03 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.32 3hgk h LYS 123 Cb 1.31 -0.10 0.00 0.00 -0.41 0.00 0.00 32.23 33.03 3hgk h LYS 123 CO 0.13 0.29 0.04 -2.13 -2.27 0.00 0.00 179.45 175.51 3hgk n ARG 124 N -4.97 0.00 -0.00 1.90 0.63 -1.23 0.52 116.66 113.51 3hgk n ARG 124 Ca 0.09 0.24 0.01 0.00 -0.92 0.00 0.00 57.85 57.28 3hgk n ARG 124 Cb 0.27 -1.54 0.01 0.00 0.45 0.00 0.00 32.46 31.65 3hgk n ARG 124 CO 0.00 0.00 0.00 0.72 -2.51 0.00 0.00 177.63 175.84 3hgk n HIS 125 N -1.21 0.01 -0.01 -0.14 8.25 -0.36 -4.75 115.22 117.00 3hgk n HIS 125 Ca 0.00 -0.02 -0.01 0.00 -0.26 0.00 0.00 57.72 57.42 3hgk n HIS 125 Cb 0.04 -0.00 -0.01 0.00 1.12 0.00 0.00 29.99 31.14 3hgk n HIS 125 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 3hgk n LEU 126 N 0.13 1.18 0.00 2.41 4.77 0.19 -4.51 117.00 121.17 3hgk n LEU 126 Ca 0.02 -0.01 0.00 0.00 -0.03 0.00 0.00 56.01 55.99 3hgk n LEU 126 Cb 0.08 -0.01 0.00 0.00 -2.33 0.00 0.00 43.42 41.16 3hgk n LEU 126 CO 0.02 0.24 0.00 0.00 -1.33 0.00 0.00 177.39 176.32 3hgk n TYR 127 N -2.27 0.00 0.00 -1.77 9.36 -0.36 -4.67 117.16 117.45 3hgk n TYR 127 Ca -0.04 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.18 3hgk n TYR 127 Cb 0.56 0.00 0.00 0.00 -0.63 0.00 0.00 39.34 39.27 3hgk n TYR 127 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 3hgk n GLY 128 N 0.02 0.22 0.00 2.98 0.00 -1.25 -4.65 105.19 102.51 3hgk n GLY 128 Ca 0.00 0.38 0.00 0.00 0.00 0.00 0.00 46.02 46.40 3hgk n GLY 128 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3hgk n SER 129 N 1.04 0.00 0.00 1.61 3.41 -1.26 -5.12 113.62 113.30 3hgk n SER 129 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 3hgk n SER 129 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 3hgk n SER 129 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 3hgk n ASP 130 N 0.00 -0.58 -1.52 4.04 9.92 -1.26 -5.07 116.55 122.07 3hgk n ASP 130 Ca 0.00 0.00 -0.00 0.00 -0.53 0.00 0.00 54.79 54.26 3hgk n ASP 130 Cb 0.00 0.00 -0.00 0.00 -0.64 0.00 0.00 41.12 40.48 3hgk n ASP 130 CO 0.00 0.00 0.00 -0.11 0.13 0.00 0.00 177.20 177.22 3hgk n LEU 131 N 0.00 -2.11 0.00 0.64 7.94 -1.26 -5.01 117.00 117.19 3hgk n LEU 131 Ca 0.00 0.03 -0.07 0.00 -1.11 0.00 0.00 56.01 54.86 3hgk n LEU 131 Cb 0.00 -1.04 0.07 0.00 0.53 0.00 0.00 43.42 42.97 3hgk n LEU 131 CO 0.00 -0.06 0.09 -0.81 -1.11 0.00 0.00 177.39 175.50 3hgk n PRO 132 N 0.02 -2.42 -3.10 1.96 -0.04 -1.26 -4.33 135.00 125.83 3hgk n PRO 132 Ca -0.00 -0.35 -0.23 0.00 -0.04 0.00 0.00 63.50 62.88 3hgk n PRO 132 Cb 0.00 -0.42 0.04 0.00 -0.04 0.00 0.00 33.50 33.08 3hgk n PRO 132 CO 0.00 0.00 0.00 2.41 -0.04 0.00 0.00 175.50 177.87 3hgk n THR 133 N -3.52 -2.13 -1.56 0.52 -1.04 -1.26 -4.76 114.28 100.54 3hgk n THR 133 Ca 0.03 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.04 3hgk n THR 133 Cb 0.14 -3.53 0.00 0.00 -1.82 0.00 0.00 70.33 65.12 3hgk n THR 133 CO 0.00 0.00 0.00 0.80 -0.64 0.00 0.00 175.07 175.23 3hgk n MET 134 N -4.17 0.00 -1.60 -2.82 1.56 -1.26 -4.84 117.12 103.99 3hgk n MET 134 Ca -0.10 0.00 0.00 0.00 -0.27 0.00 0.00 57.70 57.33 3hgk n MET 134 Cb 0.61 0.00 0.00 0.00 2.15 0.00 0.00 33.22 35.98 3hgk n MET 134 CO 0.00 0.00 0.00 -1.13 -0.73 0.00 0.00 175.97 174.11 3hgk n SER 135 N 0.82 1.37 -4.87 6.12 3.41 -1.26 -4.99 113.62 114.22 3hgk n SER 135 Ca 0.00 -0.95 -0.31 0.00 -0.26 0.00 0.00 58.87 57.36 3hgk n SER 135 Cb 0.00 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 63.92 3hgk n SER 135 CO 0.00 0.00 0.00 -0.32 -0.16 0.00 0.00 175.04 174.56 3hgk s MET 136 N -1.81 3.79 0.23 4.33 1.75 -1.26 -5.09 119.30 121.23 3hgk s MET 136 Ca 0.00 0.57 -0.04 0.00 -1.25 0.00 0.00 55.69 54.97 3hgk s MET 136 Cb 0.00 -2.32 0.05 0.00 2.84 0.00 0.00 34.83 35.40 3hgk s MET 136 CO 0.00 -0.12 0.28 -1.13 -0.65 0.00 0.00 175.02 173.41 3hgk n SER 137 N -1.47 -0.21 0.11 1.11 3.41 -1.26 -4.91 113.62 110.41 3hgk n SER 137 Ca 0.03 -1.02 -0.24 0.00 -0.26 0.00 0.00 58.87 57.38 3hgk n SER 137 Cb 0.54 -0.22 -0.15 0.00 -0.26 0.00 0.00 64.21 64.11 3hgk n SER 137 CO 0.00 0.00 0.00 -0.25 -0.16 0.00 0.00 175.04 174.63 3hgk h TRP 138 N -1.28 0.84 0.02 7.33 -0.00 -1.96 -2.94 115.95 117.96 3hgk h TRP 138 Ca -0.09 -0.61 -0.00 0.00 -0.00 0.00 0.00 58.89 58.18 3hgk h TRP 138 Cb 0.26 -0.03 -0.00 0.00 -0.00 0.00 0.00 29.16 29.39 3hgk h TRP 138 CO 0.00 1.60 -0.01 0.93 -0.00 0.00 0.00 178.44 180.96 3hgk h GLU 139 N 0.08 -0.03 -1.51 2.65 3.07 -1.98 0.18 114.58 117.05 3hgk h GLU 139 Ca -0.29 0.00 0.49 0.00 -0.50 0.00 0.00 59.36 59.06 3hgk h GLU 139 Cb 2.10 0.01 -0.12 0.00 -0.84 0.00 0.00 28.75 29.90 3hgk h GLU 139 CO 0.22 -0.02 1.01 0.37 -1.40 0.00 0.00 179.01 179.19 3hgk h GLN 140 N -0.03 0.03 -0.34 2.33 5.75 -1.95 2.19 115.11 123.08 3hgk h GLN 140 Ca -0.00 -0.00 -0.17 0.00 -0.15 0.00 0.00 58.65 58.33 3hgk h GLN 140 Cb 0.03 -0.01 -0.00 0.00 1.07 0.00 0.00 27.48 28.56 3hgk h GLN 140 CO 0.00 0.02 -0.43 0.00 -2.65 0.00 0.00 178.83 175.77 3hgk h ARG 141 N 0.03 0.89 -0.05 1.69 3.08 -1.22 -2.91 114.38 115.87 3hgk h ARG 141 Ca 0.87 -0.49 -0.24 0.00 0.07 0.00 0.00 59.98 60.18 3hgk h ARG 141 Cb 2.97 0.03 0.01 0.00 0.08 0.00 0.00 29.97 33.07 3hgk h ARG 141 CO -0.33 1.14 -0.93 -0.07 -1.07 0.00 0.00 179.97 178.70 3hgk h LEU 142 N 0.71 0.86 -0.80 3.04 3.38 0.66 -0.83 115.31 122.32 3hgk h LEU 142 Ca 0.05 -0.64 0.11 0.00 0.09 0.00 0.00 57.88 57.49 3hgk h LEU 142 Cb 1.03 -0.26 -0.08 0.00 0.09 0.00 0.00 40.66 41.44 3hgk h LEU 142 CO 0.10 1.44 0.42 -0.33 0.09 0.00 0.00 178.44 180.16 3hgk h GLU 143 N 0.42 0.64 0.00 1.13 4.39 -0.90 0.18 114.58 120.45 3hgk h GLU 143 Ca -0.09 -0.04 0.00 0.00 0.34 0.00 0.00 59.36 59.57 3hgk h GLU 143 Cb 1.57 -0.15 0.00 0.00 -0.10 0.00 0.00 28.75 30.08 3hgk h GLU 143 CO 0.18 0.43 0.00 0.82 -1.16 0.00 0.00 179.01 179.28 3hgk h ILE 144 N 0.66 0.00 0.10 3.13 2.04 -1.38 0.25 117.51 122.31 3hgk h ILE 144 Ca 0.41 -0.92 -0.14 0.00 1.00 0.00 0.00 64.86 65.21 3hgk h ILE 144 Cb 0.48 1.92 0.01 0.00 -0.74 0.00 0.00 36.82 38.49 3hgk h ILE 144 CO -0.30 0.00 -0.62 0.00 0.00 0.00 0.00 178.15 177.23 3hgk h ILE 146 N -0.55 0.99 -0.29 0.00 2.04 -0.69 -2.68 117.51 116.32 3hgk h ILE 146 Ca -0.11 -0.58 0.03 0.00 1.00 0.00 0.00 64.86 65.20 3hgk h ILE 146 Cb 1.47 1.35 -0.05 0.00 -0.74 0.00 0.00 36.82 38.85 3hgk h ILE 146 CO 0.10 0.14 -0.30 1.23 0.00 0.00 0.00 178.15 179.32 3hgk h GLY 147 N -0.47 -1.53 -0.59 5.37 0.00 -0.65 0.24 103.07 105.44 3hgk h GLY 147 Ca -0.02 0.83 0.37 0.00 0.00 0.00 0.00 47.33 48.51 3hgk h GLY 147 CO 0.03 -0.43 0.91 0.00 0.00 0.00 0.00 176.54 177.05 3hgk h ALA 148 N -0.53 3.10 -0.16 3.60 0.00 -1.55 -2.23 119.26 121.49 3hgk h ALA 148 Ca 0.05 -0.03 -0.09 0.00 0.00 0.00 0.00 54.91 54.85 3hgk h ALA 148 Cb 0.29 0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.17 3hgk h ALA 148 CO -0.36 -1.49 -0.23 0.00 0.00 0.00 0.00 179.25 177.16 3hgk h ALA 149 N 1.39 0.24 -0.81 0.00 0.00 -0.18 -2.44 119.26 117.46 3hgk h ALA 149 Ca 0.63 -0.38 0.08 0.00 0.00 0.00 0.00 54.91 55.24 3hgk h ALA 149 Cb 2.39 -0.04 -0.07 0.00 0.00 0.00 0.00 17.79 20.07 3hgk h ALA 149 CO -0.06 0.21 0.47 -0.09 0.00 0.00 0.00 179.25 179.78 3hgk h ARG 150 N 0.06 0.80 -0.56 0.00 9.65 -0.95 0.19 114.38 123.57 3hgk h ARG 150 Ca 0.02 -0.05 0.06 0.00 -1.10 0.00 0.00 59.98 58.90 3hgk h ARG 150 Cb 0.81 -0.18 -0.09 0.00 -1.39 0.00 0.00 29.97 29.12 3hgk h ARG 150 CO 0.05 0.53 -0.51 0.78 2.80 0.00 0.00 179.97 183.63 3hgk h GLY 151 N 0.82 -1.10 0.67 2.80 0.00 -1.17 0.16 103.07 105.24 3hgk h GLY 151 Ca 0.38 0.78 -0.00 0.00 0.00 0.00 0.00 47.33 48.48 3hgk h GLY 151 CO -0.22 -0.15 -0.04 1.41 0.00 0.00 0.00 176.54 177.55 3hgk h LEU 152 N -0.22 -0.09 -0.71 3.11 3.38 -0.96 -2.98 115.31 116.84 3hgk h LEU 152 Ca 0.09 -0.29 0.11 0.00 0.09 0.00 0.00 57.88 57.88 3hgk h LEU 152 Cb 0.46 0.02 -0.12 0.00 0.09 0.00 0.00 40.66 41.11 3hgk h LEU 152 CO -0.65 0.25 -0.40 -0.74 0.09 0.00 0.00 178.44 177.00 3hgk h HIS 153 N -0.44 -1.14 -0.28 1.13 2.76 -0.31 0.37 115.15 117.23 3hgk h HIS 153 Ca -0.01 0.09 0.03 0.00 -2.20 0.00 0.00 60.37 58.27 3hgk h HIS 153 Cb 0.38 0.60 -0.04 0.00 1.55 0.00 0.00 27.41 29.90 3hgk h HIS 153 CO 0.04 -0.40 -0.24 -0.92 -1.30 0.00 0.00 177.93 175.11 3hgk h TYR 154 N -0.14 -0.74 -0.48 5.26 -0.00 -0.75 0.31 116.97 120.44 3hgk h TYR 154 Ca 0.24 0.04 0.14 0.00 -0.00 0.00 0.00 58.73 59.15 3hgk h TYR 154 Cb 0.56 0.36 -0.02 0.00 -0.00 0.00 0.00 36.73 37.63 3hgk h TYR 154 CO -0.74 -0.18 0.42 -0.07 -0.00 0.00 0.00 178.16 177.59 3hgk h LEU 155 N -0.09 0.00 0.00 2.82 4.07 -0.49 0.56 115.31 122.19 3hgk h LEU 155 Ca 0.05 0.00 -0.09 0.00 0.08 0.00 0.00 57.88 57.92 3hgk h LEU 155 Cb 0.21 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 41.94 3hgk h LEU 155 CO -0.31 0.00 -0.44 0.45 -1.08 0.00 0.00 178.44 177.06 3hgk h HIS 156 N 0.00 0.00 -0.24 1.13 3.86 0.13 0.37 115.15 120.40 3hgk h HIS 156 Ca 0.23 0.00 -0.11 0.00 -1.16 0.00 0.00 60.37 59.32 3hgk h HIS 156 Cb 1.07 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 29.53 3hgk h HIS 156 CO 0.00 0.40 -0.33 1.15 0.86 0.00 0.00 177.93 180.01 3hgk h THR 157 N 0.00 1.29 -1.16 2.45 2.02 0.38 -3.19 112.91 114.70 3hgk h THR 157 Ca -0.01 -1.43 -0.67 0.00 0.77 0.00 0.00 66.41 65.07 3hgk h THR 157 Cb 1.31 1.46 -0.28 0.00 -1.74 0.00 0.00 68.15 68.91 3hgk h THR 157 CO 0.05 0.45 0.88 0.54 0.37 0.00 0.00 175.52 177.82 3hgk n ARG 158 N -4.07 2.65 -0.38 6.66 1.74 -0.56 -4.68 116.66 118.01 3hgk n ARG 158 Ca -0.01 -3.23 0.00 0.00 -0.77 0.00 0.00 57.85 53.84 3hgk n ARG 158 Cb 0.46 -2.25 0.00 0.00 -1.02 0.00 0.00 32.46 29.65 3hgk n ARG 158 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3hgk n ALA 159 N -0.75 0.00 -2.63 7.54 0.00 -1.20 -4.78 120.51 118.68 3hgk n ALA 159 Ca 0.59 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 53.62 3hgk n ALA 159 Cb 0.57 -0.62 -0.05 0.00 0.00 0.00 0.00 19.45 19.35 3hgk n ALA 159 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 3hgk s ILE 160 N -0.49 4.85 -0.11 0.00 1.01 0.13 -0.48 121.20 126.10 3hgk s ILE 160 Ca 0.00 1.43 -0.17 0.00 0.00 0.00 0.00 60.65 61.92 3hgk s ILE 160 Cb 0.00 -4.10 -0.05 0.00 0.01 0.00 0.00 42.46 38.33 3hgk s ILE 160 CO 0.00 -0.09 0.42 -0.63 0.00 0.00 0.00 174.94 174.64 3hgk s ILE 161 N 2.82 5.19 -0.06 2.92 1.01 -0.21 -3.50 121.20 129.38 3hgk s ILE 161 Ca 0.33 0.84 0.13 0.00 0.00 0.00 0.00 60.65 61.94 3hgk s ILE 161 Cb -0.15 -3.76 -0.09 0.00 0.01 0.00 0.00 42.46 38.47 3hgk s ILE 161 CO 0.08 0.38 1.18 -0.74 0.00 0.00 0.00 174.94 175.84 3hgk h HIS 162 N 6.41 0.00 0.00 3.97 -0.00 -1.94 -1.79 115.15 121.81 3hgk h HIS 162 Ca -0.43 0.00 0.00 0.00 -0.00 0.00 0.00 60.37 59.94 3hgk h HIS 162 Cb 1.18 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 28.59 3hgk h HIS 162 CO 0.63 0.71 0.00 0.54 -0.00 0.00 0.00 177.93 179.81 3hgk n ARG 163 N -3.17 0.00 -3.18 5.26 1.74 -1.26 -3.85 116.66 112.21 3hgk n ARG 163 Ca -0.03 0.00 -0.22 0.00 -0.77 0.00 0.00 57.85 56.83 3hgk n ARG 163 Cb 0.85 -3.14 -0.05 0.00 -1.02 0.00 0.00 32.46 29.10 3hgk n ARG 163 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 3hgk n ASP 164 N 0.00 1.35 -4.64 0.55 2.03 -1.26 -4.40 116.55 110.17 3hgk n ASP 164 Ca 0.00 -3.04 -0.41 0.00 0.52 0.00 0.00 54.79 51.87 3hgk n ASP 164 Cb 0.00 -0.62 -0.06 0.00 -0.72 0.00 0.00 41.12 39.72 3hgk n ASP 164 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 3hgk s VAL 165 N -2.33 4.97 -0.01 5.18 1.01 -1.26 -4.89 120.40 123.06 3hgk s VAL 165 Ca 0.40 1.24 -0.28 0.00 0.00 0.00 0.00 61.98 63.33 3hgk s VAL 165 Cb 0.27 -3.97 0.09 0.00 0.00 0.00 0.00 36.38 32.77 3hgk s VAL 165 CO -0.09 0.05 0.78 -1.59 0.00 0.00 0.00 175.10 174.25 3hgk s LYS 166 N 2.30 0.95 0.41 2.72 -2.85 -1.26 -4.79 119.74 117.22 3hgk s LYS 166 Ca 0.29 -0.07 0.25 0.00 -1.00 0.00 0.00 55.97 55.44 3hgk s LYS 166 Cb -0.16 0.44 1.36 0.00 -2.06 0.00 0.00 37.83 37.41 3hgk s LYS 166 CO 0.09 -0.36 1.62 0.66 0.10 0.00 0.00 175.35 177.46 3hgk h SER 167 N 2.42 0.30 0.60 0.03 4.64 -1.95 0.28 113.55 119.87 3hgk h SER 167 Ca -0.25 0.18 -0.13 0.00 -0.47 0.00 0.00 61.79 61.11 3hgk h SER 167 Cb 1.21 0.16 -0.02 0.00 -0.31 0.00 0.00 62.40 63.45 3hgk h SER 167 CO 0.35 -0.24 -0.63 0.40 -0.87 0.00 0.00 176.83 175.84 3hgk h ILE 168 N 0.10 1.45 -0.10 0.95 2.04 -1.96 -2.41 117.51 117.58 3hgk h ILE 168 Ca 0.82 -2.14 0.00 0.00 1.00 0.00 0.00 64.86 64.54 3hgk h ILE 168 Cb 2.37 2.15 0.00 0.00 -0.74 0.00 0.00 36.82 40.60 3hgk h ILE 168 CO -0.54 0.61 0.00 0.59 0.00 0.00 0.00 178.15 178.82 3hgk n ASN 169 N -3.80 0.76 -2.73 1.72 3.02 0.96 -4.32 115.26 110.87 3hgk n ASN 169 Ca -0.01 -1.67 -0.32 0.00 -0.03 0.00 0.00 54.58 52.55 3hgk n ASN 169 Cb 0.62 -0.06 0.01 0.00 -0.61 0.00 0.00 39.78 39.74 3hgk n ASN 169 CO 0.00 0.00 0.00 -0.38 -2.62 0.00 0.00 177.26 174.26 3hgk n ILE 170 N -0.23 3.03 -0.96 2.41 5.41 -1.17 -0.96 119.36 126.89 3hgk n ILE 170 Ca 0.12 -4.90 -0.31 0.00 1.00 0.00 0.00 62.75 58.66 3hgk n ILE 170 Cb 0.17 -1.29 0.02 0.00 -0.71 0.00 0.00 39.64 37.82 3hgk n ILE 170 CO 0.00 0.00 0.00 0.18 0.00 0.00 0.00 176.55 176.73 3hgk n LEU 171 N -0.44 -3.59 -4.31 1.39 4.32 -1.00 -3.56 117.00 109.81 3hgk n LEU 171 Ca 0.43 0.42 -0.22 0.00 -0.02 0.00 0.00 56.01 56.62 3hgk n LEU 171 Cb 0.48 -0.67 -0.11 0.00 -1.62 0.00 0.00 43.42 41.50 3hgk n LEU 171 CO 0.39 -4.23 -0.48 -0.76 -1.22 0.00 0.00 177.39 171.09 3hgk s LEU 172 N 4.84 2.41 0.00 2.23 1.02 0.15 -0.85 118.68 128.48 3hgk s LEU 172 Ca 0.42 -0.82 0.00 0.00 0.02 0.00 0.00 54.13 53.75 3hgk s LEU 172 Cb -0.33 -0.80 0.00 0.00 0.02 0.00 0.00 46.19 45.08 3hgk s LEU 172 CO 0.58 -0.03 0.00 -0.90 0.02 0.00 0.00 176.35 176.02 3hgk n ASP 173 N 0.48 0.94 -0.32 2.29 5.68 -1.10 -2.44 116.55 122.09 3hgk n ASP 173 Ca -0.15 -0.63 0.15 0.00 -0.50 0.00 0.00 54.79 53.66 3hgk n ASP 173 Cb 0.56 0.00 0.33 0.00 -1.14 0.00 0.00 41.12 40.87 3hgk n ASP 173 CO 0.00 0.00 0.00 -0.33 -1.33 0.00 0.00 177.20 175.54 3hgk h GLU 174 N 0.00 0.44 -0.86 0.11 5.08 -1.93 0.15 114.58 117.57 3hgk h GLU 174 Ca 0.00 -0.03 -0.50 0.00 -1.00 0.00 0.00 59.36 57.83 3hgk h GLU 174 Cb 0.00 -0.10 -0.27 0.00 0.50 0.00 0.00 28.75 28.88 3hgk h GLU 174 CO 0.00 0.29 0.49 0.09 -1.00 0.00 0.00 179.01 178.88 3hgk n ASN 175 N -4.99 4.61 -3.69 1.42 4.13 -1.26 -4.94 115.26 110.53 3hgk n ASN 175 Ca 0.24 -3.70 -0.23 0.00 1.68 0.00 0.00 54.58 52.57 3hgk n ASN 175 Cb 0.68 -0.81 0.05 0.00 -1.54 0.00 0.00 39.78 38.16 3hgk n ASN 175 CO 0.00 0.00 0.00 0.49 0.28 0.00 0.00 177.26 178.03 3hgk n PHE 176 N -1.06 -2.14 -3.56 3.10 3.01 0.52 -4.98 117.46 112.36 3hgk n PHE 176 Ca 0.55 0.89 -0.38 0.00 1.01 0.00 0.00 57.45 59.52 3hgk n PHE 176 Cb 1.25 -4.49 -0.10 0.00 -0.01 0.00 0.00 39.48 36.13 3hgk n PHE 176 CO 0.00 0.00 0.00 0.08 1.01 0.00 0.00 176.76 177.85 3hgk s VAL 177 N -3.51 5.29 0.36 -4.37 1.01 -1.26 -4.82 120.40 113.11 3hgk s VAL 177 Ca 0.20 0.27 -0.28 0.00 0.00 0.00 0.00 61.98 62.17 3hgk s VAL 177 Cb -0.10 -3.56 -0.11 0.00 0.00 0.00 0.00 36.38 32.61 3hgk s VAL 177 CO 0.79 0.26 1.50 -2.16 0.00 0.00 0.00 175.10 175.49 3hgk s PRO 178 N 1.60 4.13 -0.08 2.72 0.04 -1.26 -2.70 135.00 139.44 3hgk s PRO 178 Ca 0.09 2.55 -0.03 0.00 0.04 0.00 0.00 61.00 63.65 3hgk s PRO 178 Cb -0.15 -2.99 0.05 0.00 0.04 0.00 0.00 34.50 31.45 3hgk s PRO 178 CO 0.09 -0.53 0.17 0.15 0.04 0.00 0.00 177.00 176.91 3hgk s LYS 179 N -1.77 0.05 0.67 4.56 -0.14 -0.03 -4.20 119.74 118.89 3hgk s LYS 179 Ca 0.54 0.54 -0.14 0.00 -1.36 0.00 0.00 55.97 55.55 3hgk s LYS 179 Cb -0.46 -0.24 0.01 0.00 -1.68 0.00 0.00 37.83 35.46 3hgk s LYS 179 CO 0.60 -0.28 1.10 0.42 -0.76 0.00 0.00 175.35 176.43 3hgk s ILE 180 N 2.06 3.38 0.15 2.17 -1.09 -0.69 -2.38 121.20 124.81 3hgk s ILE 180 Ca 0.00 0.59 -0.03 0.00 -2.23 0.00 0.00 60.65 58.99 3hgk s ILE 180 Cb -0.12 -3.12 0.01 0.00 -1.58 0.00 0.00 42.46 37.66 3hgk s ILE 180 CO -0.06 -0.45 0.25 1.07 -1.23 0.00 0.00 174.94 174.52 3hgk n THR 181 N -2.62 0.00 -3.27 2.92 5.66 -0.13 0.28 114.28 117.12 3hgk n THR 181 Ca 0.10 -0.61 -0.32 0.00 -3.05 0.00 0.00 64.05 60.16 3hgk n THR 181 Cb 0.52 0.44 0.03 0.00 -1.55 0.00 0.00 70.33 69.77 3hgk n THR 181 CO 0.00 0.00 0.00 -0.67 -3.05 0.00 0.00 175.07 171.35 3hgk n ASP 182 N -1.65 -5.13 0.11 1.09 -0.08 -1.26 -4.90 116.55 104.73 3hgk n ASP 182 Ca -0.01 -0.09 0.10 0.00 -1.51 0.00 0.00 54.79 53.28 3hgk n ASP 182 Cb 0.24 -1.45 0.01 0.00 2.34 0.00 0.00 41.12 42.26 3hgk n ASP 182 CO 0.00 0.00 0.00 -0.26 0.12 0.00 0.00 177.20 177.06 3hgk h PHE 183 N 2.10 0.00 -0.01 -0.67 -1.00 -1.95 -3.41 116.94 112.00 3hgk h PHE 183 Ca -0.47 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.32 3hgk h PHE 183 Cb 1.25 0.00 -0.00 0.00 3.61 0.00 0.00 35.95 40.81 3hgk h PHE 183 CO 0.00 0.07 0.00 0.41 -1.61 0.00 0.00 178.31 177.18 3hgk n GLY 184 N 1.19 -0.01 0.07 -1.45 0.00 -1.26 0.38 105.19 104.11 3hgk n GLY 184 Ca -0.00 0.01 0.13 0.00 0.00 0.00 0.00 46.02 46.15 3hgk n GLY 184 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 3hgk n ILE 185 N -3.17 0.38 -0.63 -0.61 2.08 -1.26 -4.54 119.36 111.60 3hgk n ILE 185 Ca 0.00 -0.23 -0.31 0.00 0.56 0.00 0.00 62.75 62.78 3hgk n ILE 185 Cb 0.01 -0.28 0.19 0.00 -0.75 0.00 0.00 39.64 38.81 3hgk n ILE 185 CO 0.00 0.00 0.00 -1.54 0.56 0.00 0.00 176.55 175.57 3hgk n SER 186 N -2.06 -0.38 -4.13 4.38 3.41 1.21 -4.84 113.62 111.21 3hgk n SER 186 Ca 0.05 0.26 -0.13 0.00 -0.26 0.00 0.00 58.87 58.79 3hgk n SER 186 Cb 0.42 -1.40 -0.11 0.00 -0.26 0.00 0.00 64.21 62.86 3hgk n SER 186 CO 0.00 0.00 0.00 -0.75 -0.16 0.00 0.00 175.04 174.13 3hgk s LYS 187 N -4.49 0.71 0.11 4.33 2.47 -0.67 -5.01 119.74 117.18 3hgk s LYS 187 Ca 0.66 -1.04 0.10 0.00 -1.56 0.00 0.00 55.97 54.14 3hgk s LYS 187 Cb -0.23 -0.35 -0.04 0.00 -1.46 0.00 0.00 37.83 35.75 3hgk s LYS 187 CO 0.61 0.04 -0.24 0.21 0.16 0.00 0.00 175.35 176.13 3hgk s LYS 188 N -2.56 1.60 0.30 4.03 2.20 -1.26 -1.04 119.74 123.00 3hgk s LYS 188 Ca 0.01 -1.25 0.08 0.00 -0.36 0.00 0.00 55.97 54.45 3hgk s LYS 188 Cb -0.04 -1.98 -0.04 0.00 -1.51 0.00 0.00 37.83 34.27 3hgk s LYS 188 CO -0.01 0.47 0.15 0.20 -0.36 0.00 0.00 175.35 175.81 3hgk s GLY 189 N -1.89 1.69 -0.10 5.54 0.00 0.37 -4.98 107.32 107.94 3hgk s GLY 189 Ca 0.15 -1.63 -0.04 0.00 0.00 0.00 0.00 44.72 43.19 3hgk s GLY 189 CO 0.06 -1.63 -0.08 -0.84 0.00 0.00 0.00 173.10 170.61 3hgk h THR 190 N 1.55 0.00 0.00 0.90 2.02 -1.98 -3.38 112.91 112.01 3hgk h THR 190 Ca -0.45 -0.79 0.00 0.00 0.77 0.00 0.00 66.41 65.94 3hgk h THR 190 Cb 1.25 0.00 0.00 0.00 -1.74 0.00 0.00 68.15 67.66 3hgk h THR 190 CO 0.61 0.00 0.00 1.21 0.37 0.00 0.00 175.52 177.71 3hgk n GLU 191 N -4.14 0.00 -3.05 6.66 4.07 -1.26 -4.86 120.64 118.05 3hgk n GLU 191 Ca -0.03 0.00 -0.12 0.00 -0.06 0.00 0.00 57.16 56.95 3hgk n GLU 191 Cb 0.13 -1.48 0.01 0.00 -0.06 0.00 0.00 31.44 30.04 3hgk n GLU 191 CO 0.00 0.00 0.00 1.28 -0.06 0.00 0.00 177.13 178.35 3hgk n LEU 192 N -0.98 -6.52 0.00 4.31 4.77 -1.26 -4.28 117.00 113.05 3hgk n LEU 192 Ca 0.00 0.21 0.00 0.00 -0.03 0.00 0.00 56.01 56.19 3hgk n LEU 192 Cb 0.00 -3.01 0.00 0.00 -2.33 0.00 0.00 43.42 38.08 3hgk n LEU 192 CO 0.00 -1.57 0.00 0.61 -1.33 0.00 0.00 177.39 175.10 3hgk n GLY 193 N -0.69 2.25 0.31 -0.72 0.00 -1.26 -4.81 105.19 100.27 3hgk n GLY 193 Ca 0.03 -0.74 0.00 0.00 0.00 0.00 0.00 46.02 45.31 3hgk n GLY 193 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3hgk n GLN 194 N 0.00 0.75 -2.18 1.61 6.02 -1.26 -4.84 117.38 117.49 3hgk n GLN 194 Ca 0.00 0.00 -0.42 0.00 -0.01 0.00 0.00 57.00 56.57 3hgk n GLN 194 Cb 0.00 -1.23 -0.03 0.00 1.02 0.00 0.00 30.24 30.00 3hgk n GLN 194 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 177.06 177.00 3hgk s THR 195 N -1.38 3.50 -0.48 5.09 -4.23 -1.26 -4.93 115.64 111.95 3hgk s THR 195 Ca 0.00 0.98 0.04 0.00 -1.18 0.00 0.00 61.69 61.54 3hgk s THR 195 Cb 0.00 -3.63 0.41 0.00 1.34 0.00 0.00 72.50 70.62 3hgk s THR 195 CO 0.00 0.03 1.19 0.00 -0.54 0.00 0.00 174.62 175.30 3hgk n HIS 196 N 4.82 3.40 0.00 3.99 1.44 -1.26 -4.51 115.22 123.10 3hgk n HIS 196 Ca 0.13 -3.08 0.00 0.00 -2.01 0.00 0.00 57.72 52.75 3hgk n HIS 196 Cb 0.43 -0.19 0.00 0.00 0.12 0.00 0.00 29.99 30.34 3hgk n HIS 196 CO 0.00 0.00 0.00 1.47 -2.81 0.00 0.00 176.34 175.00 3hgk n LEU 197 N -0.48 0.00 -4.47 2.39 -0.00 -1.19 -4.73 117.00 108.53 3hgk n LEU 197 Ca 0.40 0.00 -0.42 0.00 -0.00 0.00 0.00 56.01 55.99 3hgk n LEU 197 Cb 0.61 0.00 0.01 0.00 -0.00 0.00 0.00 43.42 44.04 3hgk n LEU 197 CO 0.35 0.00 0.11 0.52 -0.00 0.00 0.00 177.39 178.37 3hgk n VAL 200 N 0.00 1.83 -2.51 1.47 0.31 -1.26 -1.06 118.33 117.11 3hgk n VAL 200 Ca 0.00 -0.50 -0.42 0.00 -0.01 0.00 0.00 64.34 63.41 3hgk n VAL 200 Cb 0.00 -0.58 -0.03 0.00 -0.91 0.00 0.00 33.84 32.31 3hgk n VAL 200 CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 3hgk s VAL 201 N -1.45 4.16 -0.06 2.52 1.01 -1.26 -5.04 120.40 120.28 3hgk s VAL 201 Ca 0.63 1.63 -0.17 0.00 0.00 0.00 0.00 61.98 64.07 3hgk s VAL 201 Cb -0.60 -4.04 0.04 0.00 0.00 0.00 0.00 36.38 31.77 3hgk s VAL 201 CO 0.58 0.17 0.40 -0.54 0.00 0.00 0.00 175.10 175.71 3hgk s LYS 202 N 0.63 0.69 0.00 2.72 1.02 -1.26 -5.16 119.74 118.38 3hgk s LYS 202 Ca 0.55 0.09 0.00 0.00 0.02 0.00 0.00 55.97 56.63 3hgk s LYS 202 Cb -0.28 0.31 0.00 0.00 -0.52 0.00 0.00 37.83 37.35 3hgk s LYS 202 CO 0.31 -0.17 0.00 0.41 -0.92 0.00 0.00 175.35 174.97 3hgk n GLY 203 N 1.64 0.48 3.66 -3.33 0.00 -1.26 -4.81 105.19 101.57 3hgk n GLY 203 Ca -0.19 -1.84 -0.41 0.00 0.00 0.00 0.00 46.02 43.59 3hgk n GLY 203 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3hgk s THR 204 N -1.51 4.95 0.57 2.61 2.01 -1.26 -4.91 115.64 118.10 3hgk s THR 204 Ca 0.00 1.38 0.45 0.00 0.31 0.00 0.00 61.69 63.83 3hgk s THR 204 Cb 0.00 -4.03 0.66 0.00 0.01 0.00 0.00 72.50 69.15 3hgk s THR 204 CO 0.00 0.06 1.53 0.25 -0.69 0.00 0.00 174.62 175.77 3hgk h LEU 205 N 8.33 0.00 0.00 4.42 5.85 -1.98 0.41 115.31 132.34 3hgk h LEU 205 Ca -0.30 0.00 -0.23 0.00 0.84 0.00 0.00 57.88 58.19 3hgk h LEU 205 Cb 1.13 0.00 -0.04 0.00 0.37 0.00 0.00 40.66 42.12 3hgk h LEU 205 CO 0.80 0.00 -1.68 0.61 -0.34 0.00 0.00 178.44 177.84 3hgk n GLY 206 N -1.88 -1.09 0.09 3.75 0.00 -1.26 -4.37 105.19 100.44 3hgk n GLY 206 Ca 0.39 -0.14 -0.02 0.00 0.00 0.00 0.00 46.02 46.26 3hgk n GLY 206 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 3hgk h TYR 207 N 0.00 0.00 -1.72 1.61 -1.99 -0.58 -3.48 116.97 110.81 3hgk h TYR 207 Ca -0.25 0.00 -0.65 0.00 2.00 0.00 0.00 58.73 59.83 3hgk h TYR 207 Cb 1.80 0.00 0.10 0.00 2.00 0.00 0.00 36.73 40.64 3hgk h TYR 207 CO 0.00 0.67 -0.14 -0.89 -0.00 0.00 0.00 178.16 177.80 3hgk n ILE 208 N -2.93 1.80 -1.84 -2.88 2.08 -0.62 -4.03 119.36 110.93 3hgk n ILE 208 Ca -0.11 -0.45 -0.42 0.00 0.56 0.00 0.00 62.75 62.33 3hgk n ILE 208 Cb 0.88 -0.51 -0.03 0.00 -0.75 0.00 0.00 39.64 39.23 3hgk n ILE 208 CO 0.00 0.00 0.00 -0.62 0.56 0.00 0.00 176.55 176.49 3hgk s ASP 209 N -0.67 6.53 0.13 4.38 -1.08 -1.26 -4.91 116.67 119.80 3hgk s ASP 209 Ca 0.64 2.59 -0.15 0.00 -0.52 0.00 0.00 52.55 55.10 3hgk s ASP 209 Cb -0.84 -2.56 -0.00 0.00 -1.46 0.00 0.00 42.92 38.06 3hgk s ASP 209 CO 0.57 -0.94 1.64 1.55 0.52 0.00 0.00 175.17 178.51 3hgk h PRO 210 N 8.60 0.67 -0.06 4.34 0.13 -1.92 -0.77 132.00 142.99 3hgk h PRO 210 Ca -0.44 -0.16 0.04 0.00 -0.87 0.00 0.00 66.00 64.57 3hgk h PRO 210 Cb 1.21 -0.09 -0.05 0.00 0.13 0.00 0.00 31.00 32.19 3hgk h PRO 210 CO 0.94 0.68 -0.29 1.49 -0.23 0.00 0.00 178.00 180.58 3hgk h GLU 211 N 0.55 -0.39 -0.62 0.86 4.81 -1.91 0.45 114.58 118.32 3hgk h GLU 211 Ca 0.13 0.03 0.13 0.00 -0.13 0.00 0.00 59.36 59.52 3hgk h GLU 211 Cb 0.30 0.09 -0.12 0.00 0.63 0.00 0.00 28.75 29.65 3hgk h GLU 211 CO -0.00 -0.26 -0.14 -0.92 -0.73 0.00 0.00 179.01 176.96 3hgk h TYR 212 N -0.41 -0.29 0.53 0.92 3.20 -1.75 0.11 116.97 119.28 3hgk h TYR 212 Ca 0.08 0.05 -0.02 0.00 3.14 0.00 0.00 58.73 61.98 3hgk h TYR 212 Cb 0.52 0.23 -0.00 0.00 1.54 0.00 0.00 36.73 39.02 3hgk h TYR 212 CO -0.35 -0.26 -0.30 0.35 -1.64 0.00 0.00 178.16 175.96 3hgk h PHE 213 N 0.01 -0.80 0.00 -3.82 3.57 0.23 0.45 116.94 116.58 3hgk h PHE 213 Ca 0.30 -0.01 -0.09 0.00 3.53 0.00 0.00 57.97 61.70 3hgk h PHE 213 Cb 0.47 0.28 -0.01 0.00 2.79 0.00 0.00 35.95 39.47 3hgk h PHE 213 CO -0.49 -0.47 -0.43 -0.84 -2.23 0.00 0.00 178.31 173.85 3hgk h ILE 214 N -0.78 1.16 0.00 1.41 3.07 0.38 -3.35 117.51 119.40 3hgk h ILE 214 Ca -0.06 -1.54 -0.36 0.00 1.55 0.00 0.00 64.86 64.45 3hgk h ILE 214 Cb 0.63 1.86 -0.05 0.00 -0.27 0.00 0.00 36.82 38.98 3hgk h ILE 214 CO 0.08 0.42 -2.21 0.29 -1.05 0.00 0.00 178.15 175.67 3hgk n LYS 215 N -3.82 0.47 0.00 0.16 5.02 0.34 -5.04 118.16 115.29 3hgk n LYS 215 Ca -0.01 0.19 0.00 0.00 -2.02 0.00 0.00 58.31 56.47 3hgk n LYS 215 Cb 0.48 -1.30 0.00 0.00 -0.02 0.00 0.00 35.03 34.19 3hgk n LYS 215 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3hgk n GLY 216 N 1.79 2.47 3.64 0.72 0.00 0.16 -5.05 105.19 108.91 3hgk n GLY 216 Ca -0.42 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.18 3hgk n GLY 216 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 3hgk s ARG 217 N -0.30 3.94 -0.23 1.61 1.70 -1.26 -4.88 118.95 119.52 3hgk s ARG 217 Ca 0.00 1.92 -0.10 0.00 -0.47 0.00 0.00 55.73 57.08 3hgk s ARG 217 Cb 0.00 -4.03 -0.05 0.00 -0.57 0.00 0.00 34.95 30.30 3hgk s ARG 217 CO 0.00 -1.13 0.15 -1.17 -1.08 0.00 0.00 175.30 172.07 3hgk s LEU 218 N 4.82 4.09 0.00 -1.89 2.96 -0.22 -4.45 118.68 123.98 3hgk s LEU 218 Ca 0.74 0.11 0.01 0.00 -0.22 0.00 0.00 54.13 54.77 3hgk s LEU 218 Cb -0.29 -2.09 -0.00 0.00 0.50 0.00 0.00 46.19 44.30 3hgk s LEU 218 CO 0.29 0.08 0.05 0.35 -1.32 0.00 0.00 176.35 175.80 3hgk n THR 219 N 4.18 0.00 0.31 3.68 -2.24 -1.26 -3.18 114.28 115.77 3hgk n THR 219 Ca -0.15 -2.09 0.14 0.00 -2.27 0.00 0.00 64.05 59.68 3hgk n THR 219 Cb 0.52 0.54 0.46 0.00 -2.10 0.00 0.00 70.33 69.74 3hgk n THR 219 CO 0.00 0.00 0.00 1.05 -0.57 0.00 0.00 175.07 175.55 3hgk h GLU 220 N 0.00 0.00 -0.02 -0.78 4.11 -1.88 -3.15 114.58 112.85 3hgk h GLU 220 Ca -0.34 0.00 -0.15 0.00 0.07 0.00 0.00 59.36 58.95 3hgk h GLU 220 Cb 1.10 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.33 3hgk h GLU 220 CO 0.55 0.00 -0.66 0.87 0.07 0.00 0.00 179.01 179.84 3hgk h LYS 221 N 0.00 0.09 -0.46 1.06 1.79 -1.95 -2.87 116.57 114.23 3hgk h LYS 221 Ca 0.00 -0.07 0.13 0.00 -2.18 0.00 0.00 60.65 58.53 3hgk h LYS 221 Cb 0.69 0.01 -0.02 0.00 -1.58 0.00 0.00 32.23 31.33 3hgk h LYS 221 CO 0.00 0.72 0.49 0.77 -1.08 0.00 0.00 179.45 180.35 3hgk h SER 222 N 0.06 0.00 0.59 0.86 0.02 -1.96 1.69 113.55 114.81 3hgk h SER 222 Ca -0.01 0.00 -0.24 0.00 -0.84 0.00 0.00 61.79 60.70 3hgk h SER 222 Cb 1.18 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.72 3hgk h SER 222 CO 0.09 0.00 -1.06 0.44 -1.14 0.00 0.00 176.83 175.16 3hgk h ASP 223 N 0.00 0.37 -0.13 3.07 3.32 -1.70 -2.91 116.42 118.43 3hgk h ASP 223 Ca 0.22 -0.35 -0.01 0.00 0.02 0.00 0.00 57.03 56.92 3hgk h ASP 223 Cb 1.19 -0.12 -0.01 0.00 0.22 0.00 0.00 39.33 40.62 3hgk h ASP 223 CO -0.00 1.21 0.06 0.58 -1.72 0.00 0.00 179.24 179.37 3hgk h VAL 224 N 0.11 1.13 -0.06 -1.35 2.07 0.23 0.04 116.25 118.42 3hgk h VAL 224 Ca -0.09 -0.36 0.02 0.00 0.82 0.00 0.00 66.70 67.09 3hgk h VAL 224 Cb 1.75 1.14 -0.04 0.00 -1.52 0.00 0.00 31.29 32.61 3hgk h VAL 224 CO 0.17 0.11 -0.40 0.22 0.02 0.00 0.00 177.57 177.70 3hgk h TYR 225 N 0.07 -1.17 -1.04 1.57 3.20 -0.69 0.93 116.97 119.84 3hgk h TYR 225 Ca 0.04 0.04 0.30 0.00 3.14 0.00 0.00 58.73 62.26 3hgk h TYR 225 Cb 0.13 0.52 -0.04 0.00 1.54 0.00 0.00 36.73 38.88 3hgk h TYR 225 CO -0.03 -0.41 0.80 0.77 -1.64 0.00 0.00 178.16 177.66 3hgk h SER 226 N -0.45 0.00 0.00 -2.11 0.02 -1.30 0.19 113.55 109.90 3hgk h SER 226 Ca 0.02 0.00 -0.13 0.00 -0.84 0.00 0.00 61.79 60.84 3hgk h SER 226 Cb 0.51 0.00 0.01 0.00 0.14 0.00 0.00 62.40 63.06 3hgk h SER 226 CO -0.30 0.00 -0.50 0.15 -1.14 0.00 0.00 176.83 175.04 3hgk h PHE 227 N 0.00 0.50 -0.94 3.45 3.57 0.11 -2.63 116.94 121.00 3hgk h PHE 227 Ca 0.49 -0.27 0.21 0.00 3.53 0.00 0.00 57.97 61.93 3hgk h PHE 227 Cb 2.09 -0.06 -0.12 0.00 2.79 0.00 0.00 35.95 40.66 3hgk h PHE 227 CO 0.00 1.09 0.50 0.78 -2.23 0.00 0.00 178.31 178.45 3hgk h GLY 228 N -0.24 1.67 0.93 2.40 0.00 0.14 0.62 103.07 108.59 3hgk h GLY 228 Ca -0.06 -0.25 -0.01 0.00 0.00 0.00 0.00 47.33 47.00 3hgk h GLY 228 CO 0.10 -0.19 -0.20 -2.08 0.00 0.00 0.00 176.54 174.16 3hgk h VAL 229 N 0.55 0.58 -0.51 4.60 2.07 -1.31 -2.56 116.25 119.67 3hgk h VAL 229 Ca 0.57 0.00 0.06 0.00 0.82 0.00 0.00 66.70 68.15 3hgk h VAL 229 Cb 1.02 0.58 -0.05 0.00 -1.52 0.00 0.00 31.29 31.32 3hgk h VAL 229 CO -0.46 0.00 0.23 0.58 0.02 0.00 0.00 177.57 177.93 3hgk h VAL 230 N -0.52 0.90 -0.82 2.57 2.07 -0.45 -0.74 116.25 119.26 3hgk h VAL 230 Ca -0.04 -0.15 0.12 0.00 0.82 0.00 0.00 66.70 67.45 3hgk h VAL 230 Cb 0.42 0.42 -0.13 0.00 -1.52 0.00 0.00 31.29 30.49 3hgk h VAL 230 CO 0.05 0.08 -0.43 -0.07 0.02 0.00 0.00 177.57 177.21 3hgk h LEU 231 N 0.44 -1.56 -0.17 2.57 3.38 0.45 0.20 115.31 120.62 3hgk h LEU 231 Ca 0.23 0.28 -0.05 0.00 0.09 0.00 0.00 57.88 58.44 3hgk h LEU 231 Cb 0.19 0.75 -0.00 0.00 0.09 0.00 0.00 40.66 41.69 3hgk h LEU 231 CO -0.20 -0.30 -0.08 -0.26 0.09 0.00 0.00 178.44 177.70 3hgk h PHE 232 N -0.09 0.41 0.00 1.13 0.04 -1.21 -1.95 116.94 115.26 3hgk h PHE 232 Ca 0.25 -0.10 0.00 0.00 2.80 0.00 0.00 57.97 60.92 3hgk h PHE 232 Cb 0.55 -0.09 0.00 0.00 2.20 0.00 0.00 35.95 38.61 3hgk h PHE 232 CO -0.82 0.66 0.47 -1.91 -0.60 0.00 0.00 178.31 176.11 3hgk n GLU 233 N -4.62 0.04 -0.13 1.51 2.13 0.50 0.93 120.64 121.01 3hgk n GLU 233 Ca -0.05 0.44 -0.27 0.00 0.66 0.00 0.00 57.16 57.94 3hgk n GLU 233 Cb 0.30 -2.10 -0.11 0.00 0.27 0.00 0.00 31.44 29.80 3hgk n GLU 233 CO 0.00 0.00 0.00 0.28 -0.41 0.00 0.00 177.13 177.00 3hgk n VAL 234 N -1.74 1.54 -0.06 6.31 0.31 -0.04 -3.32 118.33 121.33 3hgk n VAL 234 Ca -0.00 -0.36 -0.08 0.00 -0.01 0.00 0.00 64.34 63.89 3hgk n VAL 234 Cb 0.48 -1.84 -0.02 0.00 -0.91 0.00 0.00 33.84 31.55 3hgk n VAL 234 CO 0.00 0.00 0.00 0.25 -1.32 0.00 0.00 176.83 175.76 3hgk h LEU 235 N -0.82 -0.25 0.13 7.52 5.85 0.11 -3.31 115.31 124.54 3hgk h LEU 235 Ca -0.62 0.08 -0.34 0.00 0.84 0.00 0.00 57.88 57.83 3hgk h LEU 235 Cb 1.62 0.16 -0.01 0.00 0.37 0.00 0.00 40.66 42.80 3hgk h LEU 235 CO -0.33 -0.09 -1.83 0.00 -0.34 0.00 0.00 178.44 175.86 3hgk n ALA 237 N -2.86 0.00 -1.04 0.00 0.00 -1.21 -3.26 120.51 112.14 3hgk n ALA 237 Ca -0.26 0.00 -0.32 0.00 0.00 0.00 0.00 53.44 52.86 3hgk n ALA 237 Cb 1.06 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 20.48 3hgk n ALA 237 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 3hgk n ARG 238 N -2.43 2.34 -0.00 0.00 0.00 -1.26 -4.25 116.66 111.06 3hgk n ARG 238 Ca 0.00 -1.80 0.00 0.00 -0.00 0.00 0.00 57.85 56.05 3hgk n ARG 238 Cb 0.00 -2.71 0.00 0.00 0.00 0.00 0.00 32.46 29.75 3hgk n ARG 238 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.63 178.08 3hgk n SER 239 N 5.00 0.11 -0.06 6.15 2.88 -1.26 -0.88 113.62 125.55 3hgk n SER 239 Ca 0.53 -0.30 -0.06 0.00 -1.33 0.00 0.00 58.87 57.71 3hgk n SER 239 Cb 0.24 -0.02 -0.09 0.00 -0.75 0.00 0.00 64.21 63.58 3hgk n SER 239 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3hgk n ALA 240 N 1.23 1.70 0.00 -1.46 0.00 -1.26 -4.89 120.51 115.83 3hgk n ALA 240 Ca 0.00 -0.78 0.00 0.00 0.00 0.00 0.00 53.44 52.66 3hgk n ALA 240 Cb 0.01 0.01 0.00 0.00 0.00 0.00 0.00 19.45 19.47 3hgk n ALA 240 CO 0.00 0.00 0.00 1.51 0.00 0.00 0.00 177.50 179.01 3hgk n ILE 241 N -2.47 0.00 -3.99 0.00 3.06 -0.06 -3.73 119.36 112.17 3hgk n ILE 241 Ca -0.20 0.00 -0.33 0.00 -2.50 0.00 0.00 62.75 59.72 3hgk n ILE 241 Cb 0.88 0.00 -0.14 0.00 0.54 0.00 0.00 39.64 40.92 3hgk n ILE 241 CO 0.00 0.00 0.00 0.54 -2.50 0.00 0.00 176.55 174.59 3hgk s VAL 242 N 0.00 2.50 -0.15 9.51 0.11 -1.26 0.38 120.40 131.49 3hgk s VAL 242 Ca 0.00 -1.80 0.02 0.00 -2.93 0.00 0.00 61.98 57.27 3hgk s VAL 242 Cb 0.00 -2.58 0.01 0.00 -1.53 0.00 0.00 36.38 32.28 3hgk s VAL 242 CO 0.00 -0.25 -0.20 -1.58 -3.33 0.00 0.00 175.10 169.74 3hgk s GLN 243 N 1.09 3.07 -0.65 1.54 2.00 -1.13 -5.05 119.66 120.53 3hgk s GLN 243 Ca -0.01 -0.82 -0.03 0.00 -2.00 0.00 0.00 55.36 52.49 3hgk s GLN 243 Cb -0.20 -2.50 0.20 0.00 0.80 0.00 0.00 33.01 31.31 3hgk s GLN 243 CO -0.05 -0.02 2.42 0.43 -0.50 0.00 0.00 175.29 177.57 3hgk n SER 244 N 4.10 6.99 0.00 6.67 7.64 -1.26 -4.50 113.62 133.26 3hgk n SER 244 Ca -0.20 -3.50 0.00 0.00 1.01 0.00 0.00 58.87 56.18 3hgk n SER 244 Cb 0.51 -1.16 0.00 0.00 -1.01 0.00 0.00 64.21 62.55 3hgk n SER 244 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 3hgk n LEU 245 N 0.24 0.06 0.00 -3.43 4.77 -1.26 -5.10 117.00 112.27 3hgk n LEU 245 Ca 0.51 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.49 3hgk n LEU 245 Cb 0.40 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.49 3hgk n LEU 245 CO 0.42 -0.33 0.00 -2.65 -1.33 0.00 0.00 177.39 173.50 3hgk n PRO 246 N -2.57 -1.12 0.00 3.23 -0.02 -1.26 -5.07 135.00 128.19 3hgk n PRO 246 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.48 3hgk n PRO 246 Cb 0.13 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.61 3hgk n PRO 246 CO 0.00 0.00 0.00 -2.13 1.98 0.00 0.00 175.50 175.35 3hgk n ARG 247 N -1.43 2.25 -0.33 -0.52 3.00 -1.26 -4.76 116.66 113.61 3hgk n ARG 247 Ca 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 57.85 57.85 3hgk n ARG 247 Cb 0.00 0.00 0.12 0.00 0.00 0.00 0.00 32.46 32.58 3hgk n ARG 247 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.63 175.72 3hgk n GLU 248 N 0.00 2.11 -1.09 -0.14 2.13 -1.26 -3.28 120.64 119.11 3hgk n GLU 248 Ca 0.00 -1.06 -0.15 0.00 0.66 0.00 0.00 57.16 56.61 3hgk n GLU 248 Cb 0.00 -1.68 0.22 0.00 0.27 0.00 0.00 31.44 30.26 3hgk n GLU 248 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 3hgk n MET 249 N 0.15 2.67 -0.04 5.31 0.00 -1.26 -4.72 117.12 119.23 3hgk n MET 249 Ca 0.12 -3.06 -0.15 0.00 0.00 0.00 0.00 57.70 54.61 3hgk n MET 249 Cb 0.65 -2.14 -0.08 0.00 0.00 0.00 0.00 33.22 31.65 3hgk n MET 249 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 175.97 175.73 3hgk h VAL 250 N 1.54 1.37 -2.79 3.17 3.04 -1.80 -3.41 116.25 117.37 3hgk h VAL 250 Ca 0.45 -1.68 -0.64 0.00 -1.01 0.00 0.00 66.70 63.83 3hgk h VAL 250 Cb 2.52 2.09 -0.15 0.00 -2.01 0.00 0.00 31.29 33.74 3hgk h VAL 250 CO 0.88 0.50 0.46 0.21 -1.01 0.00 0.00 177.57 178.61 3hgk s ASN 251 N -6.52 6.20 0.60 3.17 3.84 -1.26 -2.82 114.94 118.15 3hgk s ASN 251 Ca -0.13 -0.97 0.28 0.00 0.21 0.00 0.00 52.86 52.25 3hgk s ASN 251 Cb 0.06 -2.40 1.20 0.00 -0.55 0.00 0.00 41.25 39.55 3hgk s ASN 251 CO 0.81 -1.34 1.58 0.25 -2.79 0.00 0.00 177.10 175.61 3hgk h LEU 252 N 11.03 0.00 0.13 3.21 6.46 -0.31 0.68 115.31 136.51 3hgk h LEU 252 Ca -0.28 0.00 -0.01 0.00 -0.12 0.00 0.00 57.88 57.47 3hgk h LEU 252 Cb 1.07 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 41.01 3hgk h LEU 252 CO 1.15 0.00 -0.06 0.00 -0.62 0.00 0.00 178.44 178.91 3hgk h ALA 253 N 0.96 -0.17 0.00 1.25 0.00 -1.90 -0.99 119.26 118.41 3hgk h ALA 253 Ca 0.36 -0.25 -0.00 0.00 0.00 0.00 0.00 54.91 55.03 3hgk h ALA 253 Cb 2.11 0.07 -0.00 0.00 0.00 0.00 0.00 17.79 19.97 3hgk h ALA 253 CO -0.00 -0.29 -0.00 1.49 0.00 0.00 0.00 179.25 180.45 3hgk h GLU 254 N -0.78 0.00 0.00 0.00 4.81 -0.31 -3.09 114.58 115.20 3hgk h GLU 254 Ca -0.02 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.21 3hgk h GLU 254 Cb 0.55 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.93 3hgk h GLU 254 CO 0.03 0.00 0.00 1.87 -0.73 0.00 0.00 179.01 180.18 3hgk n TRP 255 N -4.49 0.00 -0.06 0.92 -0.00 0.16 -2.59 117.44 111.39 3hgk n TRP 255 Ca -0.03 0.00 0.25 0.00 -0.00 0.00 0.00 57.50 57.72 3hgk n TRP 255 Cb 0.09 -0.37 0.71 0.00 -0.00 0.00 0.00 31.31 31.75 3hgk n TRP 255 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 177.69 177.69 3hgk h ALA 256 N -2.00 2.52 0.98 5.87 0.00 -1.33 0.33 119.26 125.64 3hgk h ALA 256 Ca 0.00 -0.02 -0.05 0.00 0.00 0.00 0.00 54.91 54.84 3hgk h ALA 256 Cb 0.00 0.05 0.01 0.00 0.00 0.00 0.00 17.79 17.85 3hgk h ALA 256 CO 0.00 -0.96 -0.47 0.28 0.00 0.00 0.00 179.25 178.10 3hgk h VAL 257 N 0.00 0.02 -0.19 0.00 2.07 -1.67 0.15 116.25 116.62 3hgk h VAL 257 Ca 0.33 -0.02 0.06 0.00 0.82 0.00 0.00 66.70 67.88 3hgk h VAL 257 Cb 1.53 0.02 -0.01 0.00 -1.52 0.00 0.00 31.29 31.31 3hgk h VAL 257 CO -0.00 0.00 0.27 -0.08 0.02 0.00 0.00 177.57 177.78 3hgk h GLU 258 N -1.34 0.00 0.02 1.57 4.81 -0.10 1.03 114.58 120.57 3hgk h GLU 258 Ca -0.13 0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 59.09 3hgk h GLU 258 Cb 1.01 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.39 3hgk h GLU 258 CO 0.22 0.00 -0.01 0.77 -0.73 0.00 0.00 179.01 179.26 3hgk h SER 259 N 0.00 -0.02 1.33 1.04 0.02 -1.16 0.25 113.55 115.01 3hgk h SER 259 Ca 0.09 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.04 3hgk h SER 259 Cb 0.63 0.01 0.00 0.00 0.14 0.00 0.00 62.40 63.17 3hgk h SER 259 CO -0.00 0.07 -0.13 1.57 -1.14 0.00 0.00 176.83 177.19 3hgk n HIS 260 N -2.52 0.82 0.08 3.45 -0.00 0.49 -0.23 115.22 117.31 3hgk n HIS 260 Ca -0.00 0.24 -0.13 0.00 -0.00 0.00 0.00 57.72 57.83 3hgk n HIS 260 Cb 0.01 -0.87 -0.05 0.00 -0.00 0.00 0.00 29.99 29.08 3hgk n HIS 260 CO 0.00 0.00 0.00 -0.97 -0.00 0.00 0.00 176.34 175.37 3hgk h ASN 261 N 0.00 0.46 0.00 0.26 -0.73 0.97 -3.42 115.58 113.12 3hgk h ASN 261 Ca 0.00 -0.39 0.00 0.00 1.87 0.00 0.00 56.30 57.78 3hgk h ASN 261 Cb 0.73 -0.14 0.00 0.00 0.27 0.00 0.00 38.32 39.18 3hgk h ASN 261 CO 0.00 1.20 0.00 0.59 -0.37 0.00 0.00 177.43 178.85 3hgk n ASN 262 N -3.70 0.00 0.31 1.15 3.02 -1.17 -5.02 115.26 109.86 3hgk n ASN 262 Ca -0.06 0.00 0.07 0.00 -0.03 0.00 0.00 54.58 54.55 3hgk n ASN 262 Cb 0.86 0.27 0.36 0.00 -0.61 0.00 0.00 39.78 40.66 3hgk n ASN 262 CO 0.00 0.00 0.00 1.23 -2.62 0.00 0.00 177.26 175.87 3hgk h GLY 263 N 0.00 0.00 0.00 7.41 0.00 -0.81 -3.37 103.07 106.30 3hgk h GLY 263 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 3hgk h GLY 263 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 176.54 176.36 3hgk n GLN 264 N -2.57 0.00 -3.37 4.80 7.27 0.16 -4.96 117.38 118.71 3hgk n GLN 264 Ca -0.01 0.00 -0.22 0.00 0.07 0.00 0.00 57.00 56.84 3hgk n GLN 264 Cb 0.68 0.00 -0.01 0.00 2.41 0.00 0.00 30.24 33.31 3hgk n GLN 264 CO 0.00 0.00 0.00 -0.11 0.07 0.00 0.00 177.06 177.02 3hgk n LEU 265 N 0.00 -1.23 -4.59 1.69 7.94 0.67 -4.68 117.00 116.80 3hgk n LEU 265 Ca 0.00 -0.36 -0.53 0.00 -1.11 0.00 0.00 56.01 54.01 3hgk n LEU 265 Cb 0.04 -1.90 -0.06 0.00 0.53 0.00 0.00 43.42 42.02 3hgk n LEU 265 CO 0.00 0.12 0.89 -0.62 -1.11 0.00 0.00 177.39 176.67 3hgk n GLU 266 N -3.57 1.01 -0.15 1.96 1.02 -1.26 -4.85 120.64 114.80 3hgk n GLU 266 Ca -0.00 0.36 0.11 0.00 -0.02 0.00 0.00 57.16 57.61 3hgk n GLU 266 Cb 0.53 -1.99 0.18 0.00 -0.02 0.00 0.00 31.44 30.14 3hgk n GLU 266 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 3hgk n GLN 267 N 2.59 2.34 0.11 3.49 6.02 -1.26 -4.31 117.38 126.37 3hgk n GLN 267 Ca 0.19 -2.14 0.12 0.00 -0.01 0.00 0.00 57.00 55.16 3hgk n GLN 267 Cb 0.17 -1.47 0.13 0.00 1.02 0.00 0.00 30.24 30.10 3hgk n GLN 267 CO 0.00 0.00 0.00 0.82 -1.01 0.00 0.00 177.06 176.87 3hgk h ILE 268 N 4.14 0.00 0.00 5.09 2.04 -1.97 -3.36 117.51 123.45 3hgk h ILE 268 Ca 0.00 -0.79 -0.01 0.00 1.00 0.00 0.00 64.86 65.07 3hgk h ILE 268 Cb 0.93 1.46 -0.00 0.00 -0.74 0.00 0.00 36.82 38.47 3hgk h ILE 268 CO 0.00 0.00 -0.03 -0.37 0.00 0.00 0.00 178.15 177.75 3hgk h VAL 269 N 0.00 0.11 -2.39 1.67 -1.51 -1.98 -3.46 116.25 108.69 3hgk h VAL 269 Ca 0.00 -0.40 -0.45 0.00 -1.23 0.00 0.00 66.70 64.62 3hgk h VAL 269 Cb 0.89 1.35 0.07 0.00 -2.13 0.00 0.00 31.29 31.47 3hgk h VAL 269 CO 0.00 0.03 0.05 1.51 -1.23 0.00 0.00 177.57 177.93 3hgk s ASP 270 N -5.63 4.81 0.00 4.19 -4.77 -1.26 -4.59 116.67 109.42 3hgk s ASP 270 Ca -0.01 -0.16 0.00 0.00 -3.30 0.00 0.00 52.55 49.07 3hgk s ASP 270 Cb 0.11 -0.46 0.00 0.00 -1.09 0.00 0.00 42.92 41.48 3hgk s ASP 270 CO 0.52 -1.52 0.00 -0.81 0.70 0.00 0.00 175.17 174.06 3hgk n PRO 271 N -2.61 3.40 -0.92 2.11 -0.04 -1.20 -4.77 135.00 130.96 3hgk n PRO 271 Ca 0.11 0.00 -0.12 0.00 -0.04 0.00 0.00 63.50 63.46 3hgk n PRO 271 Cb 0.60 0.00 -0.08 0.00 -0.04 0.00 0.00 33.50 33.99 3hgk n PRO 271 CO 0.00 0.00 0.00 -1.71 -0.04 0.00 0.00 175.50 173.75 3hgk n ASN 272 N 0.00 5.63 0.10 3.54 4.05 -1.26 -4.28 115.26 123.04 3hgk n ASN 272 Ca 0.00 -2.65 0.12 0.00 0.45 0.00 0.00 54.58 52.50 3hgk n ASN 272 Cb 0.00 -1.26 0.46 0.00 1.23 0.00 0.00 39.78 40.21 3hgk n ASN 272 CO 0.00 0.00 0.00 -0.11 -3.05 0.00 0.00 177.26 174.10 3hgk n LEU 273 N 1.67 0.59 0.00 1.20 0.00 -1.26 -4.99 117.00 114.21 3hgk n LEU 273 Ca 0.30 0.61 0.00 0.00 0.00 0.00 0.00 56.01 56.92 3hgk n LEU 273 Cb 0.69 -0.49 0.00 0.00 0.00 0.00 0.00 43.42 43.63 3hgk n LEU 273 CO 0.15 -0.37 0.00 0.00 0.00 0.00 0.00 177.39 177.17 3hgk n ALA 274 N -1.73 0.00 -0.10 1.96 0.00 -1.26 -3.25 120.51 116.13 3hgk n ALA 274 Ca 0.04 0.00 -0.10 0.00 0.00 0.00 0.00 53.44 53.37 3hgk n ALA 274 Cb 0.29 0.00 0.10 0.00 0.00 0.00 0.00 19.45 19.84 3hgk n ALA 274 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 3hgk n ASP 275 N -1.88 3.38 -0.03 0.00 8.00 -1.26 -4.46 116.55 120.30 3hgk n ASP 275 Ca 0.00 -2.77 -0.17 0.00 0.71 0.00 0.00 54.79 52.56 3hgk n ASP 275 Cb 0.00 -0.66 -0.07 0.00 -0.02 0.00 0.00 41.12 40.37 3hgk n ASP 275 CO 0.00 0.00 0.00 0.11 -0.39 0.00 0.00 177.20 176.92 3hgk h LYS 276 N 0.68 0.78 -6.56 -1.24 1.57 -1.97 -3.44 116.57 106.40 3hgk h LYS 276 Ca 0.28 -0.63 -0.53 0.00 -1.87 0.00 0.00 60.65 57.91 3hgk h LYS 276 Cb 1.86 0.13 0.00 0.00 0.08 0.00 0.00 32.23 34.30 3hgk h LYS 276 CO 0.52 1.24 0.53 0.42 -0.57 0.00 0.00 179.45 181.58 3hgk s ILE 277 N -3.78 3.95 0.56 1.86 1.01 -1.26 -5.02 121.20 118.53 3hgk s ILE 277 Ca -0.11 1.51 -0.20 0.00 0.00 0.00 0.00 60.65 61.86 3hgk s ILE 277 Cb 0.08 -3.97 -0.04 0.00 0.01 0.00 0.00 42.46 38.54 3hgk s ILE 277 CO 0.90 0.18 1.23 -0.60 0.00 0.00 0.00 174.94 176.65 3hgk s ARG 278 N 0.43 3.12 0.54 2.79 3.52 -1.26 -4.92 118.95 123.18 3hgk s ARG 278 Ca 0.55 1.89 0.24 0.00 -0.13 0.00 0.00 55.73 58.28 3hgk s ARG 278 Cb -0.30 -2.06 1.52 0.00 -1.56 0.00 0.00 34.95 32.55 3hgk s ARG 278 CO 0.32 -1.10 2.17 -1.00 -0.81 0.00 0.00 175.30 174.88 3hgk h PRO 279 N 1.17 0.00 0.05 5.12 0.13 -1.96 -2.76 132.00 133.75 3hgk h PRO 279 Ca -0.50 0.00 -0.22 0.00 -0.87 0.00 0.00 66.00 64.41 3hgk h PRO 279 Cb 1.29 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.40 3hgk h PRO 279 CO 0.56 0.04 -1.15 1.49 -0.23 0.00 0.00 178.00 178.71 3hgk h GLU 280 N 0.00 0.10 -0.97 0.86 4.81 -1.91 -3.19 114.58 114.29 3hgk h GLU 280 Ca -0.00 -0.17 0.03 0.00 -0.13 0.00 0.00 59.36 59.09 3hgk h GLU 280 Cb 0.08 0.06 -0.06 0.00 0.63 0.00 0.00 28.75 29.47 3hgk h GLU 280 CO 0.00 1.08 0.63 0.66 -0.73 0.00 0.00 179.01 180.66 3hgk h SER 281 N -0.70 1.06 -0.61 1.04 4.64 -1.80 -1.75 113.55 115.42 3hgk h SER 281 Ca -0.28 -0.01 -0.02 0.00 -0.47 0.00 0.00 61.79 61.00 3hgk h SER 281 Cb 1.45 -0.25 -0.03 0.00 -0.31 0.00 0.00 62.40 63.27 3hgk h SER 281 CO -0.07 0.73 0.30 0.25 -0.87 0.00 0.00 176.83 177.17 3hgk h LEU 282 N 1.23 0.82 -1.15 5.97 5.85 -1.64 0.24 115.31 126.64 3hgk h LEU 282 Ca 0.38 -0.09 -0.03 0.00 0.84 0.00 0.00 57.88 58.98 3hgk h LEU 282 Cb -0.02 -0.21 -0.00 0.00 0.37 0.00 0.00 40.66 40.79 3hgk h LEU 282 CO -0.12 0.70 -0.15 -0.09 -0.34 0.00 0.00 178.44 178.45 3hgk h ARG 283 N 0.91 0.00 0.00 1.25 2.43 -1.31 -2.74 114.38 114.91 3hgk h ARG 283 Ca 0.22 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.39 3hgk h ARG 283 Cb 0.10 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.65 3hgk h ARG 283 CO -0.03 0.15 -0.15 -0.22 -1.51 0.00 0.00 179.97 178.20 3hgk h LYS 284 N 0.00 0.00 -1.13 0.20 1.63 -0.99 -2.74 116.57 113.55 3hgk h LYS 284 Ca -0.00 0.00 0.42 0.00 -0.85 0.00 0.00 60.65 60.22 3hgk h LYS 284 Cb 0.70 0.00 -0.16 0.00 -0.60 0.00 0.00 32.23 32.17 3hgk h LYS 284 CO 0.02 0.00 0.66 0.35 -3.45 0.00 0.00 179.45 177.03 3hgk h PHE 285 N -0.93 0.73 0.08 1.91 3.57 -0.54 0.45 116.94 122.21 3hgk h PHE 285 Ca 0.00 0.03 -0.25 0.00 3.53 0.00 0.00 57.97 61.29 3hgk h PHE 285 Cb 0.15 -0.17 -0.01 0.00 2.79 0.00 0.00 35.95 38.71 3hgk h PHE 285 CO -0.07 -0.35 -1.28 0.78 -2.23 0.00 0.00 178.31 175.16 3hgk h GLY 286 N 0.07 0.20 -0.55 2.40 0.00 -1.66 -2.97 103.07 100.55 3hgk h GLY 286 Ca 0.83 -0.51 0.35 0.00 0.00 0.00 0.00 47.33 48.00 3hgk h GLY 286 CO -0.63 0.45 0.82 -1.80 0.00 0.00 0.00 176.54 175.38 3hgk h ASP 287 N -0.48 0.23 0.06 0.19 3.58 0.16 0.32 116.42 120.47 3hgk h ASP 287 Ca -0.29 0.06 -0.00 0.00 0.42 0.00 0.00 57.03 57.22 3hgk h ASP 287 Cb 1.62 0.03 0.00 0.00 1.72 0.00 0.00 39.33 42.70 3hgk h ASP 287 CO 0.00 -0.01 -0.03 0.74 -2.88 0.00 0.00 179.24 177.07 3hgk h THR 288 N 0.17 0.60 -1.10 2.25 2.02 -1.28 -2.64 112.91 112.94 3hgk h THR 288 Ca 0.66 -1.34 0.30 0.00 0.77 0.00 0.00 66.41 66.80 3hgk h THR 288 Cb 2.13 1.11 -0.09 0.00 -1.74 0.00 0.00 68.15 69.56 3hgk h THR 288 CO -0.21 0.19 0.72 0.00 0.37 0.00 0.00 175.52 176.59 3hgk h ALA 289 N -0.64 2.41 -0.25 6.16 0.00 -0.62 1.32 119.26 127.64 3hgk h ALA 289 Ca -0.01 0.06 -0.18 0.00 0.00 0.00 0.00 54.91 54.78 3hgk h ALA 289 Cb 0.38 0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.23 3hgk h ALA 289 CO 0.01 -0.84 -0.56 0.28 0.00 0.00 0.00 179.25 178.14 3hgk h VAL 290 N 0.30 1.29 -0.10 0.00 2.07 -0.62 -3.06 116.25 116.14 3hgk h VAL 290 Ca 0.63 -1.77 -0.04 0.00 0.82 0.00 0.00 66.70 66.34 3hgk h VAL 290 Cb 1.76 1.69 -0.01 0.00 -1.52 0.00 0.00 31.29 33.21 3hgk h VAL 290 CO -0.28 0.57 -0.11 0.11 0.02 0.00 0.00 177.57 177.87 3hgk h LYS 291 N 0.59 0.14 0.00 1.57 1.57 0.19 -1.73 116.57 118.90 3hgk h LYS 291 Ca 0.01 -0.03 -0.07 0.00 -1.87 0.00 0.00 60.65 58.69 3hgk h LYS 291 Cb 1.15 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 33.43 3hgk h LYS 291 CO 0.12 0.26 -0.33 0.00 -0.57 0.00 0.00 179.45 178.93 3hgk n LEU 293 N -3.88 3.91 -4.48 0.00 4.77 -0.66 -3.26 117.00 113.41 3hgk n LEU 293 Ca -0.01 -1.96 -0.42 0.00 -0.03 0.00 0.00 56.01 53.58 3hgk n LEU 293 Cb 0.40 -0.49 0.00 0.00 -2.33 0.00 0.00 43.42 41.01 3hgk n LEU 293 CO 0.37 0.92 0.18 0.00 -1.33 0.00 0.00 177.39 177.52 3hgk n ALA 294 N 1.49 -1.27 -0.35 -1.18 0.00 -1.19 -4.85 120.51 113.16 3hgk n ALA 294 Ca 0.24 0.22 0.09 0.00 0.00 0.00 0.00 53.44 53.98 3hgk n ALA 294 Cb 0.64 -1.82 0.26 0.00 0.00 0.00 0.00 19.45 18.52 3hgk n ALA 294 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 3hgk h LEU 295 N 1.03 0.83 -9.32 0.00 3.38 -1.94 -3.40 115.31 105.89 3hgk h LEU 295 Ca -0.40 0.07 -0.67 0.00 0.09 0.00 0.00 57.88 56.97 3hgk h LEU 295 Cb 1.39 -0.09 -0.15 0.00 0.09 0.00 0.00 40.66 41.90 3hgk h LEU 295 CO 0.53 0.39 -0.67 -0.94 0.09 0.00 0.00 178.44 177.85 3hgk s SER 296 N -5.57 4.91 0.38 -0.43 1.04 -1.26 -4.55 113.70 108.21 3hgk s SER 296 Ca -0.12 -0.09 0.10 0.00 0.48 0.00 0.00 55.95 56.32 3hgk s SER 296 Cb 0.23 -1.21 0.86 0.00 0.10 0.00 0.00 66.02 65.99 3hgk s SER 296 CO 0.80 0.26 1.91 0.77 0.98 0.00 0.00 173.24 177.97 3hgk h SER 297 N 4.25 0.58 -0.67 7.02 4.64 -1.97 -2.59 113.55 124.82 3hgk h SER 297 Ca -0.49 0.02 0.11 0.00 -0.47 0.00 0.00 61.79 60.96 3hgk h SER 297 Cb 1.17 -0.10 -0.11 0.00 -0.31 0.00 0.00 62.40 63.06 3hgk h SER 297 CO 0.56 0.33 -0.25 1.21 -0.87 0.00 0.00 176.83 177.81 3hgk n GLU 298 N -4.51 -0.15 -0.32 4.77 4.07 -1.26 -0.32 120.64 122.92 3hgk n GLU 298 Ca 0.14 1.03 0.07 0.00 -0.06 0.00 0.00 57.16 58.34 3hgk n GLU 298 Cb 0.40 -1.53 0.22 0.00 -0.06 0.00 0.00 31.44 30.48 3hgk n GLU 298 CO 0.00 0.00 0.00 -0.25 -0.06 0.00 0.00 177.13 176.82 3hgk n ASP 299 N -4.99 2.89 -4.90 4.31 8.00 -0.97 -4.91 116.55 115.97 3hgk n ASP 299 Ca 0.07 -2.13 -0.28 0.00 0.71 0.00 0.00 54.79 53.17 3hgk n ASP 299 Cb 0.27 -0.38 0.00 0.00 -0.02 0.00 0.00 41.12 40.99 3hgk n ASP 299 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 3hgk s ARG 300 N -1.52 3.46 0.01 -1.24 0.52 0.57 -4.86 118.95 115.89 3hgk s ARG 300 Ca 0.33 0.23 -0.09 0.00 -0.52 0.00 0.00 55.73 55.68 3hgk s ARG 300 Cb 0.19 -2.33 -0.05 0.00 0.52 0.00 0.00 34.95 33.28 3hgk s ARG 300 CO 0.19 -0.32 0.32 -1.25 0.02 0.00 0.00 175.30 174.27 3hgk s PRO 301 N -4.83 3.69 0.56 3.54 0.04 -1.26 -5.07 135.00 131.67 3hgk s PRO 301 Ca 0.49 0.09 -0.21 0.00 0.04 0.00 0.00 61.00 61.42 3hgk s PRO 301 Cb -0.10 -3.10 -0.04 0.00 0.04 0.00 0.00 34.50 31.29 3hgk s PRO 301 CO 0.46 0.65 1.30 -1.54 0.04 0.00 0.00 177.00 177.91 3hgk s SER 302 N -1.50 5.27 0.00 6.66 1.04 -1.26 -4.78 113.70 119.13 3hgk s SER 302 Ca 0.27 2.63 0.00 0.00 0.48 0.00 0.00 55.95 59.33 3hgk s SER 302 Cb -0.14 -2.62 0.00 0.00 0.10 0.00 0.00 66.02 63.36 3hgk s SER 302 CO 0.15 -1.55 0.49 0.23 0.98 0.00 0.00 173.24 173.53 3hgk n MET 303 N -1.17 0.00 0.13 4.02 2.81 -1.26 -1.36 117.12 120.29 3hgk n MET 303 Ca 0.11 0.10 -0.06 0.00 -1.81 0.00 0.00 57.70 56.04 3hgk n MET 303 Cb 0.46 -1.54 -0.03 0.00 -0.71 0.00 0.00 33.22 31.41 3hgk n MET 303 CO 0.00 0.00 0.00 0.78 1.51 0.00 0.00 175.97 178.26 3hgk h GLY 304 N 0.00 -0.42 0.21 3.03 0.00 -1.94 -3.00 103.07 100.95 3hgk h GLY 304 Ca 0.00 0.15 0.02 0.00 0.00 0.00 0.00 47.33 47.51 3hgk h GLY 304 CO 0.00 -0.15 -0.43 -0.55 0.00 0.00 0.00 176.54 175.40 3hgk h ASP 305 N -1.01 -1.30 -1.30 0.19 3.32 -1.56 -1.66 116.42 113.10 3hgk h ASP 305 Ca -0.04 0.15 0.38 0.00 0.02 0.00 0.00 57.03 57.54 3hgk h ASP 305 Cb 0.31 0.49 -0.08 0.00 0.22 0.00 0.00 39.33 40.27 3hgk h ASP 305 CO 0.07 -0.49 0.89 0.58 -1.72 0.00 0.00 179.24 178.57 3hgk h VAL 306 N -0.64 0.31 0.00 -1.35 2.07 -1.69 0.69 116.25 115.65 3hgk h VAL 306 Ca 0.03 -0.04 -0.14 0.00 0.82 0.00 0.00 66.70 67.37 3hgk h VAL 306 Cb 0.68 0.19 -0.02 0.00 -1.52 0.00 0.00 31.29 30.62 3hgk h VAL 306 CO -0.28 0.02 -0.78 0.25 0.02 0.00 0.00 177.57 176.81 3hgk h LEU 307 N 0.12 0.00 0.02 2.57 5.85 -1.17 -2.45 115.31 120.24 3hgk h LEU 307 Ca 0.68 0.00 -0.00 0.00 0.84 0.00 0.00 57.88 59.40 3hgk h LEU 307 Cb 2.37 0.00 0.00 0.00 0.37 0.00 0.00 40.66 43.40 3hgk h LEU 307 CO -0.17 0.62 -0.01 -0.25 -0.34 0.00 0.00 178.44 178.29 3hgk h TRP 308 N 0.00 -0.03 -0.69 1.25 7.01 0.84 -3.20 115.95 121.14 3hgk h TRP 308 Ca -0.04 -0.00 0.11 0.00 2.11 0.00 0.00 58.89 61.07 3hgk h TRP 308 Cb 1.51 0.01 -0.08 0.00 -2.10 0.00 0.00 29.16 28.50 3hgk h TRP 308 CO 0.00 0.68 0.29 0.87 -2.79 0.00 0.00 178.44 177.49 3hgk h LYS 309 N -0.94 0.47 0.31 2.65 1.57 -0.66 -0.01 116.57 119.96 3hgk h LYS 309 Ca -0.00 -0.03 -0.00 0.00 -1.87 0.00 0.00 60.65 58.75 3hgk h LYS 309 Cb 0.72 -0.11 -0.04 0.00 0.08 0.00 0.00 32.23 32.88 3hgk h LYS 309 CO 0.00 0.31 -0.52 -0.07 -0.57 0.00 0.00 179.45 178.61 3hgk h LEU 310 N 0.49 -1.50 -0.49 2.94 3.38 -1.57 -1.07 115.31 117.49 3hgk h LEU 310 Ca 0.36 0.14 0.10 0.00 0.09 0.00 0.00 57.88 58.56 3hgk h LEU 310 Cb 0.45 0.53 -0.08 0.00 0.09 0.00 0.00 40.66 41.65 3hgk h LEU 310 CO -0.32 -0.61 -0.01 -0.33 0.09 0.00 0.00 178.44 177.25 3hgk h GLU 311 N -0.88 0.10 -1.00 1.13 5.08 -1.44 -1.75 114.58 115.82 3hgk h GLU 311 Ca -0.03 -0.01 0.22 0.00 -1.00 0.00 0.00 59.36 58.54 3hgk h GLU 311 Cb 0.82 -0.02 -0.11 0.00 0.50 0.00 0.00 28.75 29.94 3hgk h GLU 311 CO -0.18 0.07 0.62 -0.92 -1.00 0.00 0.00 179.01 177.59 3hgk h TYR 312 N 0.10 0.96 -0.03 4.33 3.20 -0.36 0.30 116.97 125.47 3hgk h TYR 312 Ca 0.25 0.03 -0.24 0.00 3.14 0.00 0.00 58.73 61.90 3hgk h TYR 312 Cb 0.37 -0.28 0.01 0.00 1.54 0.00 0.00 36.73 38.37 3hgk h TYR 312 CO -0.32 0.16 -0.95 0.00 -1.64 0.00 0.00 178.16 175.41 3hgk h ALA 313 N 1.66 0.26 -0.16 1.82 0.00 -0.37 0.39 119.26 122.87 3hgk h ALA 313 Ca 0.59 -0.68 -0.01 0.00 0.00 0.00 0.00 54.91 54.81 3hgk h ALA 313 Cb 1.09 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.89 3hgk h ALA 313 CO -0.38 0.73 0.05 1.25 0.00 0.00 0.00 179.25 180.90 3hgk h LEU 314 N 0.36 0.19 0.08 0.00 5.85 -0.37 -1.88 115.31 119.54 3hgk h LEU 314 Ca -0.10 -0.01 -0.00 0.00 0.84 0.00 0.00 57.88 58.61 3hgk h LEU 314 Cb 1.59 -0.05 0.00 0.00 0.37 0.00 0.00 40.66 42.57 3hgk h LEU 314 CO 0.18 0.19 -0.04 -0.09 -0.34 0.00 0.00 178.44 178.34 3hgk h ARG 315 N 0.21 -0.10 0.00 1.25 2.43 -0.20 -3.17 114.38 114.81 3hgk h ARG 315 Ca 0.06 0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.23 3hgk h ARG 315 Cb 0.07 0.02 0.00 0.00 -0.42 0.00 0.00 29.97 29.64 3hgk h ARG 315 CO -0.00 0.39 0.44 -0.07 -1.51 0.00 0.00 179.97 179.21 3hgk h LEU 316 N -0.65 0.00 0.10 3.80 3.38 0.41 -2.79 115.31 119.56 3hgk h LEU 316 Ca -0.01 0.00 -0.33 0.00 0.09 0.00 0.00 57.88 57.63 3hgk h LEU 316 Cb 0.53 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.26 3hgk h LEU 316 CO 0.02 0.00 -1.79 -0.61 0.09 0.00 0.00 178.44 176.14 3hgk h GLN 317 N 0.00 0.21 -0.03 1.13 -0.00 -1.33 -3.41 115.11 111.67 3hgk h GLN 317 Ca 0.00 -0.36 0.00 0.00 -0.00 0.00 0.00 58.65 58.29 3hgk h GLN 317 Cb 0.88 0.13 0.00 0.00 0.00 0.00 0.00 27.48 28.50 3hgk h GLN 317 CO 0.00 1.17 0.00 -0.85 0.00 0.00 0.00 178.83 179.15