#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hpt s VAL 17 N 0.00 5.08 0.00 1.39 1.01 0.95 -3.91 120.40 124.92 3hpt s VAL 17 Ca 0.00 1.10 0.00 0.00 0.00 0.00 0.00 61.98 63.08 3hpt s VAL 17 Cb 0.00 -3.90 0.00 0.00 0.00 0.00 0.00 36.38 32.48 3hpt s VAL 17 CO 0.00 0.19 0.00 0.61 0.00 0.00 0.00 175.10 175.90 3hpt n GLY 18 N 3.63 0.12 7.00 4.51 0.00 -1.26 -1.75 105.19 117.45 3hpt n GLY 18 Ca -0.03 -0.96 0.00 0.00 0.00 0.00 0.00 46.02 45.03 3hpt n GLY 18 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hpt n GLY 19 N 0.00 0.62 3.47 -0.02 0.00 -1.26 -4.92 105.19 103.08 3hpt n GLY 19 Ca 0.00 -0.77 -0.10 0.00 0.00 0.00 0.00 46.02 45.16 3hpt n GLY 19 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 3hpt s GLN 20 N 0.00 1.31 0.40 1.61 -2.07 -0.47 -5.00 119.66 115.44 3hpt s GLN 20 Ca 0.00 -0.95 -0.27 0.00 -1.82 0.00 0.00 55.36 52.33 3hpt s GLN 20 Cb 0.00 0.48 -0.09 0.00 -1.09 0.00 0.00 33.01 32.31 3hpt s GLN 20 CO 0.00 -0.54 1.35 -1.21 -1.32 0.00 0.00 175.29 173.57 3hpt s GLU 21 N -3.90 4.00 0.09 9.60 2.02 -1.26 -0.57 118.70 128.68 3hpt s GLU 21 Ca 0.11 2.27 -0.31 0.00 0.02 0.00 0.00 54.97 57.06 3hpt s GLU 21 Cb 0.00 -2.82 -0.07 0.00 0.10 0.00 0.00 34.13 31.35 3hpt s GLU 21 CO -0.02 -0.51 1.30 0.00 0.02 0.00 0.00 175.26 176.06 3hpt s LYS 23 N 1.10 2.30 -0.28 0.00 1.02 -1.26 -4.91 119.74 117.71 3hpt s LYS 23 Ca 0.62 0.67 -0.41 0.00 0.02 0.00 0.00 55.97 56.86 3hpt s LYS 23 Cb -0.33 -1.94 -0.17 0.00 -0.52 0.00 0.00 37.83 34.87 3hpt s LYS 23 CO 0.30 -1.47 1.65 -3.47 -0.92 0.00 0.00 175.35 171.43 3hpt n ASP 24 N -3.34 1.97 0.00 2.83 2.03 -1.26 -1.12 116.55 117.67 3hpt n ASP 24 Ca 0.07 1.11 0.00 0.00 0.52 0.00 0.00 54.79 56.49 3hpt n ASP 24 Cb 0.56 -1.08 0.00 0.00 -0.72 0.00 0.00 41.12 39.88 3hpt n ASP 24 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 3hpt n GLY 25 N 3.90 1.17 0.15 0.27 0.00 -1.26 -4.90 105.19 104.51 3hpt n GLY 25 Ca 0.26 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 46.12 3hpt n GLY 25 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 3hpt h GLU 26 N 2.84 0.45 -1.94 1.61 4.81 -1.47 -3.38 114.58 117.49 3hpt h GLU 26 Ca 0.00 -0.57 -0.56 0.00 -0.13 0.00 0.00 59.36 58.11 3hpt h GLU 26 Cb 0.00 0.18 -0.42 0.00 0.63 0.00 0.00 28.75 29.14 3hpt h GLU 26 CO 0.00 1.21 -0.78 0.00 -0.73 0.00 0.00 179.01 178.71 3hpt h PRO 28 N 2.87 0.00 -0.01 0.00 0.13 -1.77 -2.77 132.00 130.45 3hpt h PRO 28 Ca 0.16 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.29 3hpt h PRO 28 Cb 0.73 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.86 3hpt h PRO 28 CO 0.76 0.00 -0.16 -2.67 -0.23 0.00 0.00 178.00 175.70 3hpt n TRP 29 N -2.78 0.00 -1.95 1.56 2.14 -1.07 -1.93 117.44 113.41 3hpt n TRP 29 Ca 0.02 0.00 -0.42 0.00 2.07 0.00 0.00 57.50 59.17 3hpt n TRP 29 Cb 0.32 -0.16 -0.02 0.00 -0.81 0.00 0.00 31.31 30.63 3hpt n TRP 29 CO 0.00 0.00 0.00 -1.14 2.07 0.00 0.00 177.69 178.62 3hpt s GLN 30 N -2.48 4.23 0.28 -2.67 2.00 -1.05 -0.35 119.66 119.61 3hpt s GLN 30 Ca 0.27 2.37 0.11 0.00 -2.00 0.00 0.00 55.36 56.11 3hpt s GLN 30 Cb 0.20 -3.11 -0.05 0.00 0.80 0.00 0.00 33.01 30.85 3hpt s GLN 30 CO 0.49 -0.52 -0.18 0.00 -0.50 0.00 0.00 175.29 174.58 3hpt s ALA 31 N 0.37 2.71 -0.07 1.58 0.00 0.19 -4.36 121.76 122.17 3hpt s ALA 31 Ca 0.63 -1.89 0.01 0.00 0.00 0.00 0.00 51.96 50.72 3hpt s ALA 31 Cb -0.43 -0.22 0.02 0.00 0.00 0.00 0.00 23.12 22.49 3hpt s ALA 31 CO 0.40 0.24 -0.09 -1.17 0.00 0.00 0.00 175.76 175.14 3hpt s LEU 32 N -3.51 1.39 -0.18 0.00 2.96 0.04 -1.39 118.68 118.00 3hpt s LEU 32 Ca 0.30 -0.25 -0.24 0.00 -0.22 0.00 0.00 54.13 53.72 3hpt s LEU 32 Cb -0.04 -0.73 -0.02 0.00 0.50 0.00 0.00 46.19 45.91 3hpt s LEU 32 CO 0.15 -0.04 0.77 -0.76 -1.32 0.00 0.00 176.35 175.14 3hpt s LEU 33 N 1.08 4.16 -0.11 -0.68 1.43 -0.13 -0.23 118.68 124.20 3hpt s LEU 33 Ca -0.07 1.05 0.01 0.00 -1.03 0.00 0.00 54.13 54.08 3hpt s LEU 33 Cb -0.14 -3.12 -0.02 0.00 0.03 0.00 0.00 46.19 42.94 3hpt s LEU 33 CO -0.01 -0.37 -0.12 0.27 0.23 0.00 0.00 176.35 176.35 3hpt s ILE 34 N 2.13 3.17 0.00 -0.59 -4.36 -0.39 -1.12 121.20 120.04 3hpt s ILE 34 Ca 0.35 -0.64 0.00 0.00 -0.26 0.00 0.00 60.65 60.10 3hpt s ILE 34 Cb -0.16 -2.31 0.00 0.00 1.25 0.00 0.00 42.46 41.24 3hpt s ILE 34 CO 0.11 0.54 0.00 -0.46 0.24 0.00 0.00 174.94 175.38 3hpt n ASN 35 N 3.12 0.00 -0.09 4.36 0.23 0.41 -1.37 115.26 121.91 3hpt n ASN 35 Ca -0.18 -0.54 0.07 0.00 -0.53 0.00 0.00 54.58 53.40 3hpt n ASN 35 Cb 0.53 0.00 0.41 0.00 -2.08 0.00 0.00 39.78 38.64 3hpt n ASN 35 CO 0.00 0.00 0.00 -0.33 -0.93 0.00 0.00 177.26 176.00 3hpt h GLU 36 N 0.00 0.58 -0.17 -3.83 3.07 -1.87 -0.11 114.58 112.25 3hpt h GLU 36 Ca 0.00 -0.04 0.00 0.00 -0.50 0.00 0.00 59.36 58.82 3hpt h GLU 36 Cb 0.00 -0.13 0.00 0.00 -0.84 0.00 0.00 28.75 27.78 3hpt h GLU 36 CO 0.00 0.39 0.00 0.39 -1.40 0.00 0.00 179.01 178.39 3hpt n GLU 37 N -4.47 1.50 -2.38 2.33 -0.58 -1.26 -4.89 120.64 110.88 3hpt n GLU 37 Ca 0.07 -0.77 -0.21 0.00 -0.42 0.00 0.00 57.16 55.84 3hpt n GLU 37 Cb 0.19 -1.26 -0.01 0.00 -0.57 0.00 0.00 31.44 29.79 3hpt n GLU 37 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 3hpt n ASN 38 N 0.06 -5.90 -4.88 1.62 3.02 -0.05 -5.01 115.26 104.11 3hpt n ASN 38 Ca 0.11 -0.00 -0.37 0.00 -0.03 0.00 0.00 54.58 54.29 3hpt n ASN 38 Cb 0.21 -4.92 -0.06 0.00 -0.61 0.00 0.00 39.78 34.40 3hpt n ASN 38 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 3hpt s GLU 39 N -5.02 3.47 0.17 3.52 0.41 -1.26 -4.79 118.70 115.20 3hpt s GLU 39 Ca 0.00 -0.12 -0.30 0.00 -0.41 0.00 0.00 54.97 54.14 3hpt s GLU 39 Cb 0.00 -3.18 -0.08 0.00 -1.78 0.00 0.00 34.13 29.09 3hpt s GLU 39 CO 0.00 0.76 1.30 0.20 -0.49 0.00 0.00 175.26 177.03 3hpt s GLY 40 N -1.13 2.40 0.00 -1.39 0.00 -1.26 -0.45 107.32 105.49 3hpt s GLY 40 Ca 0.17 1.06 0.00 0.00 0.00 0.00 0.00 44.72 45.95 3hpt s GLY 40 CO 0.06 2.08 0.00 1.97 0.00 0.00 0.00 173.10 177.21 3hpt n PHE 41 N 2.94 0.00 -3.71 1.90 1.16 -0.28 -4.93 117.46 114.55 3hpt n PHE 41 Ca 0.07 0.00 -0.10 0.00 -1.87 0.00 0.00 57.45 55.55 3hpt n PHE 41 Cb 0.43 0.00 -0.03 0.00 -1.61 0.00 0.00 39.48 38.27 3hpt n PHE 41 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 3hpt n GLY 43 N -0.37 2.03 3.77 0.00 0.00 0.19 -0.96 105.19 109.84 3hpt n GLY 43 Ca -0.10 -2.20 -0.05 0.00 0.00 0.00 0.00 46.02 43.66 3hpt n GLY 43 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3hpt s GLY 44 N -3.83 -0.21 -0.10 -0.02 0.00 -0.48 -3.67 107.32 99.00 3hpt s GLY 44 Ca 0.41 0.03 0.03 0.00 0.00 0.00 0.00 44.72 45.20 3hpt s GLY 44 CO 0.26 -0.01 -0.22 -1.59 0.00 0.00 0.00 173.10 171.55 3hpt s THR 45 N -3.53 1.90 0.02 0.90 2.01 0.79 -0.64 115.64 117.10 3hpt s THR 45 Ca 0.11 -0.92 -0.30 0.00 0.31 0.00 0.00 61.69 60.89 3hpt s THR 45 Cb -0.03 -1.66 -0.05 0.00 0.01 0.00 0.00 72.50 70.76 3hpt s THR 45 CO 0.03 0.52 1.30 -0.63 -0.69 0.00 0.00 174.62 175.15 3hpt s ILE 46 N 0.51 3.86 -0.08 1.82 1.01 0.52 0.08 121.20 128.92 3hpt s ILE 46 Ca -0.16 1.28 0.09 0.00 0.00 0.00 0.00 60.65 61.86 3hpt s ILE 46 Cb -0.17 -3.82 -0.13 0.00 0.01 0.00 0.00 42.46 38.35 3hpt s ILE 46 CO 0.06 0.04 0.07 0.18 0.00 0.00 0.00 174.94 175.28 3hpt n LEU 47 N 4.79 0.00 0.00 2.97 4.77 -0.21 -1.70 117.00 127.61 3hpt n LEU 47 Ca 0.11 0.00 -0.01 0.00 -0.03 0.00 0.00 56.01 56.08 3hpt n LEU 47 Cb 0.45 0.19 0.01 0.00 -2.33 0.00 0.00 43.42 41.74 3hpt n LEU 47 CO 0.57 0.19 0.34 -1.54 -1.33 0.00 0.00 177.39 175.63 3hpt n SER 48 N -2.27 -0.76 0.15 -1.43 3.41 -1.13 -4.72 113.62 106.87 3hpt n SER 48 Ca -0.13 -1.40 0.11 0.00 -0.26 0.00 0.00 58.87 57.18 3hpt n SER 48 Cb 0.71 1.23 0.63 0.00 -0.26 0.00 0.00 64.21 66.52 3hpt n SER 48 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 3hpt h GLU 49 N 0.00 0.07 0.00 4.33 3.07 -1.99 -3.12 114.58 116.94 3hpt h GLU 49 Ca -0.12 -0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.74 3hpt h GLU 49 Cb 0.51 -0.02 0.00 0.00 -0.84 0.00 0.00 28.75 28.41 3hpt h GLU 49 CO 0.16 0.05 -0.68 1.19 -1.40 0.00 0.00 179.01 178.32 3hpt n PHE 50 N -4.49 0.00 -5.14 4.33 3.72 -1.26 -0.09 117.46 114.53 3hpt n PHE 50 Ca 0.01 0.00 -0.31 0.00 -0.05 0.00 0.00 57.45 57.11 3hpt n PHE 50 Cb 0.23 -0.05 -0.17 0.00 -0.94 0.00 0.00 39.48 38.56 3hpt n PHE 50 CO 0.00 0.00 0.00 0.71 -0.05 0.00 0.00 176.76 177.42 3hpt s TYR 51 N -2.12 2.35 -0.08 1.38 2.02 -1.18 -0.59 117.35 119.12 3hpt s TYR 51 Ca 0.02 -0.87 0.02 0.00 -0.37 0.00 0.00 57.07 55.87 3hpt s TYR 51 Cb 0.08 -1.57 -0.02 0.00 -0.40 0.00 0.00 41.96 40.04 3hpt s TYR 51 CO 0.43 -0.33 -0.15 0.42 -1.57 0.00 0.00 175.55 174.35 3hpt s ILE 52 N 0.22 2.97 -0.15 2.71 -1.09 -0.39 -1.05 121.20 124.42 3hpt s ILE 52 Ca -0.13 -0.73 -0.13 0.00 -2.23 0.00 0.00 60.65 57.43 3hpt s ILE 52 Cb -0.16 -2.19 -0.05 0.00 -1.58 0.00 0.00 42.46 38.48 3hpt s ILE 52 CO 0.07 0.56 0.28 -0.22 -1.23 0.00 0.00 174.94 174.40 3hpt s LEU 53 N -0.22 4.26 0.00 2.97 2.96 0.11 -0.73 118.68 128.03 3hpt s LEU 53 Ca 0.01 0.51 0.00 0.00 -0.22 0.00 0.00 54.13 54.43 3hpt s LEU 53 Cb -0.13 -2.35 -0.00 0.00 0.50 0.00 0.00 46.19 44.21 3hpt s LEU 53 CO 0.03 0.14 0.11 1.07 -1.32 0.00 0.00 176.35 176.38 3hpt n THR 54 N 3.36 0.00 -3.67 3.68 5.66 -0.49 -0.15 114.28 122.68 3hpt n THR 54 Ca -0.13 -0.53 -0.38 0.00 -3.05 0.00 0.00 64.05 59.97 3hpt n THR 54 Cb 0.52 0.30 -0.06 0.00 -1.55 0.00 0.00 70.33 69.54 3hpt n THR 54 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 3hpt s ALA 55 N -2.06 3.78 0.28 1.79 0.00 -1.26 -1.25 121.76 123.04 3hpt s ALA 55 Ca 0.09 -0.41 0.00 0.00 0.00 0.00 0.00 51.96 51.64 3hpt s ALA 55 Cb 0.00 -2.20 0.51 0.00 0.00 0.00 0.00 23.12 21.43 3hpt s ALA 55 CO 0.06 0.54 1.84 0.00 0.00 0.00 0.00 175.76 178.20 3hpt h ALA 56 N 4.85 1.46 0.00 0.00 0.00 -1.70 -2.73 119.26 121.14 3hpt h ALA 56 Ca -0.53 0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.36 3hpt h ALA 56 Cb 1.22 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 18.79 3hpt h ALA 56 CO 0.60 0.25 -0.16 1.12 0.00 0.00 0.00 179.25 181.06 3hpt h HIS 57 N 1.00 0.00 -0.23 0.00 2.07 -1.92 -2.06 115.15 114.02 3hpt h HIS 57 Ca 0.48 0.00 -0.03 0.00 -2.85 0.00 0.00 60.37 57.97 3hpt h HIS 57 Cb 0.43 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 30.39 3hpt h HIS 57 CO -0.01 0.16 -0.00 0.00 -3.07 0.00 0.00 177.93 175.01 3hpt h LEU 59 N 0.33 0.17 -0.63 0.00 3.38 -1.48 -2.09 115.31 114.99 3hpt h LEU 59 Ca 0.08 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.04 3hpt h LEU 59 Cb 0.23 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 40.93 3hpt h LEU 59 CO 0.01 0.13 0.00 -1.22 0.09 0.00 0.00 178.44 177.44 3hpt n TYR 60 N -4.52 0.18 -0.42 1.13 4.01 -1.08 -4.04 117.16 112.42 3hpt n TYR 60 Ca -0.01 -0.09 0.05 0.00 -0.16 0.00 0.00 57.90 57.70 3hpt n TYR 60 Cb 0.08 0.00 0.12 0.00 -0.31 0.00 0.00 39.34 39.23 3hpt n TYR 60 CO 0.00 0.00 0.00 1.04 -0.46 0.00 0.00 176.86 177.44 3hpt n GLN 61 N -0.09 2.64 -3.69 -0.72 6.02 -0.79 -4.95 117.38 115.80 3hpt n GLN 61 Ca 0.11 -2.10 -0.13 0.00 -0.01 0.00 0.00 57.00 54.87 3hpt n GLN 61 Cb 0.18 -1.32 -0.09 0.00 1.02 0.00 0.00 30.24 30.03 3hpt n GLN 61 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3hpt s ALA 61 N -1.67 -1.28 0.07 -1.58 0.00 -1.26 -5.07 121.76 110.98 3hpt s ALA 61 Ca 0.20 1.52 -0.34 0.00 0.00 0.00 0.00 51.96 53.34 3hpt s ALA 61 Cb 0.15 -0.89 -0.19 0.00 0.00 0.00 0.00 23.12 22.20 3hpt s ALA 61 CO 0.07 -0.25 1.61 0.87 0.00 0.00 0.00 175.76 178.05 3hpt h LYS 62 N 5.62 -0.98 -5.90 0.00 6.56 -1.92 -3.44 116.57 116.51 3hpt h LYS 62 Ca -0.29 0.07 -0.51 0.00 -1.06 0.00 0.00 60.65 58.86 3hpt h LYS 62 Cb 1.18 0.22 -0.21 0.00 -0.57 0.00 0.00 32.23 32.85 3hpt h LYS 62 CO 0.19 -0.65 -0.81 1.03 -2.06 0.00 0.00 179.45 177.15 3hpt s ARG 63 N -6.02 1.04 0.09 3.15 0.52 -1.26 -5.09 118.95 111.38 3hpt s ARG 63 Ca -0.18 -1.11 -0.12 0.00 -0.52 0.00 0.00 55.73 53.80 3hpt s ARG 63 Cb 0.03 -1.21 0.01 0.00 0.52 0.00 0.00 34.95 34.31 3hpt s ARG 63 CO 0.62 0.28 0.27 -0.59 0.02 0.00 0.00 175.30 175.89 3hpt s PHE 64 N -1.24 -0.00 0.37 -0.53 -0.71 -1.26 -3.06 117.98 111.54 3hpt s PHE 64 Ca 0.04 -0.33 0.04 0.00 -1.04 0.00 0.00 56.93 55.64 3hpt s PHE 64 Cb -0.10 0.06 -0.03 0.00 -1.21 0.00 0.00 43.02 41.74 3hpt s PHE 64 CO 0.04 -0.58 0.13 0.15 -1.34 0.00 0.00 175.22 173.62 3hpt s LYS 65 N -3.54 1.79 -0.14 1.99 1.02 -0.47 -4.55 119.74 115.83 3hpt s LYS 65 Ca 0.02 -2.06 0.02 0.00 0.02 0.00 0.00 55.97 53.97 3hpt s LYS 65 Cb 0.03 -0.52 0.01 0.00 -0.52 0.00 0.00 37.83 36.83 3hpt s LYS 65 CO -0.10 -0.42 -0.20 0.08 -0.92 0.00 0.00 175.35 173.79 3hpt s VAL 66 N -3.33 1.94 -0.17 3.17 1.01 0.33 -1.26 120.40 122.09 3hpt s VAL 66 Ca 0.29 -0.90 -0.07 0.00 0.00 0.00 0.00 61.98 61.31 3hpt s VAL 66 Cb 0.04 -1.73 -0.04 0.00 0.00 0.00 0.00 36.38 34.65 3hpt s VAL 66 CO 0.16 0.52 0.07 -0.60 0.00 0.00 0.00 175.10 175.25 3hpt s ARG 67 N 0.95 3.83 0.12 2.72 3.52 0.68 0.46 118.95 131.24 3hpt s ARG 67 Ca -0.04 -0.31 0.10 0.00 -0.13 0.00 0.00 55.73 55.34 3hpt s ARG 67 Cb -0.15 -3.19 -0.04 0.00 -1.56 0.00 0.00 34.95 30.02 3hpt s ARG 67 CO -0.04 0.39 -0.24 0.14 -0.81 0.00 0.00 175.30 174.73 3hpt s VAL 68 N 0.06 2.02 -0.06 7.11 -7.23 0.27 -0.78 120.40 121.78 3hpt s VAL 68 Ca 0.06 -1.67 0.00 0.00 -1.81 0.00 0.00 61.98 58.56 3hpt s VAL 68 Cb -0.12 -1.80 0.00 0.00 0.56 0.00 0.00 36.38 35.02 3hpt s VAL 68 CO 0.01 0.02 0.00 0.61 -0.31 0.00 0.00 175.10 175.43 3hpt n GLY 69 N 0.98 0.47 3.73 2.32 0.00 -1.26 -1.29 105.19 110.15 3hpt n GLY 69 Ca -0.19 -0.24 -0.41 0.00 0.00 0.00 0.00 46.02 45.18 3hpt n GLY 69 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3hpt s ASP 70 N -2.24 7.35 0.00 1.61 2.15 -1.26 -4.22 116.67 120.06 3hpt s ASP 70 Ca 0.00 1.62 0.00 0.00 0.43 0.00 0.00 52.55 54.60 3hpt s ASP 70 Cb 0.00 -2.53 0.00 0.00 -0.30 0.00 0.00 42.92 40.09 3hpt s ASP 70 CO 0.00 -0.04 0.00 0.54 -0.17 0.00 0.00 175.17 175.50 3hpt n ARG 71 N 2.88 0.00 -4.17 4.34 5.12 -1.26 -4.79 116.66 118.78 3hpt n ARG 71 Ca 0.00 0.00 -0.27 0.00 -1.93 0.00 0.00 57.85 55.66 3hpt n ARG 71 Cb 0.50 -0.94 -0.17 0.00 -1.16 0.00 0.00 32.46 30.69 3hpt n ARG 71 CO 0.00 0.00 0.00 1.21 -1.93 0.00 0.00 177.63 176.91 3hpt s ASN 72 N -4.08 2.13 0.42 0.55 3.84 -1.24 -1.29 114.94 115.28 3hpt s ASN 72 Ca 0.00 -0.33 0.23 0.00 0.21 0.00 0.00 52.86 52.96 3hpt s ASN 72 Cb 0.00 -0.90 0.43 0.00 -0.55 0.00 0.00 41.25 40.23 3hpt s ASN 72 CO 0.00 -0.05 1.63 0.71 -2.79 0.00 0.00 177.10 176.59 3hpt h THR 73 N 6.08 0.22 0.00 -5.21 1.35 -0.72 -3.29 112.91 111.33 3hpt h THR 73 Ca -0.31 -1.21 -0.05 0.00 -0.55 0.00 0.00 66.41 64.28 3hpt h THR 73 Cb 1.15 2.02 -0.01 0.00 -1.73 0.00 0.00 68.15 69.59 3hpt h THR 73 CO 0.45 0.12 -0.26 -0.33 -0.25 0.00 0.00 175.52 175.25 3hpt h GLU 74 N 0.00 0.00 -5.91 4.72 3.07 -1.97 -3.44 114.58 111.05 3hpt h GLU 74 Ca -0.00 0.00 -0.53 0.00 -0.50 0.00 0.00 59.36 58.32 3hpt h GLU 74 Cb 1.01 0.00 -0.24 0.00 -0.84 0.00 0.00 28.75 28.69 3hpt h GLU 74 CO 0.02 0.26 -0.82 1.14 -1.40 0.00 0.00 179.01 178.20 3hpt s GLN 75 N -3.60 1.17 -1.16 2.33 -2.07 -1.24 -5.07 119.66 110.01 3hpt s GLN 75 Ca 0.01 -0.98 -0.18 0.00 -1.82 0.00 0.00 55.36 52.39 3hpt s GLN 75 Cb 0.10 -1.31 0.11 0.00 -1.09 0.00 0.00 33.01 30.82 3hpt s GLN 75 CO 0.65 0.32 1.49 -1.21 -1.32 0.00 0.00 175.29 175.22 3hpt s GLU 76 N -1.47 3.89 0.00 9.60 8.01 -1.26 -4.80 118.70 132.67 3hpt s GLU 76 Ca 0.05 -1.99 0.11 0.00 0.01 0.00 0.00 54.97 53.16 3hpt s GLU 76 Cb -0.09 -5.26 0.48 0.00 -4.31 0.00 0.00 34.13 24.95 3hpt s GLU 76 CO 0.03 -2.02 1.35 0.39 0.01 0.00 0.00 175.26 175.02 3hpt n GLU 77 N 7.33 0.01 -0.03 1.61 1.02 -1.26 -5.00 120.64 124.32 3hpt n GLU 77 Ca 0.38 0.30 0.00 0.00 -0.02 0.00 0.00 57.16 57.83 3hpt n GLU 77 Cb 0.46 -1.50 -0.00 0.00 -0.02 0.00 0.00 31.44 30.38 3hpt n GLU 77 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3hpt n GLY 78 N -0.35 -2.21 3.61 0.62 0.00 -1.26 -4.92 105.19 100.69 3hpt n GLY 78 Ca 0.03 -1.47 0.00 0.00 0.00 0.00 0.00 46.02 44.58 3hpt n GLY 78 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hpt n GLY 79 N -2.36 2.54 3.80 -0.02 0.00 -1.26 -5.00 105.19 102.90 3hpt n GLY 79 Ca -0.00 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.67 3hpt n GLY 79 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3hpt s GLU 80 N 0.00 4.16 0.00 1.61 8.01 -1.26 -4.64 118.70 126.59 3hpt s GLU 80 Ca 0.00 1.28 0.00 0.00 0.01 0.00 0.00 54.97 56.26 3hpt s GLU 80 Cb 0.00 -2.30 -0.00 0.00 -4.31 0.00 0.00 34.13 27.51 3hpt s GLU 80 CO 0.00 -0.11 -0.01 0.00 0.01 0.00 0.00 175.26 175.15 3hpt s ALA 81 N -1.96 0.05 -0.17 5.21 0.00 -0.41 -4.99 121.76 119.48 3hpt s ALA 81 Ca 0.61 -0.10 -0.03 0.00 0.00 0.00 0.00 51.96 52.44 3hpt s ALA 81 Cb -0.14 0.01 -0.02 0.00 0.00 0.00 0.00 23.12 22.97 3hpt s ALA 81 CO 0.19 -0.01 -0.05 0.08 0.00 0.00 0.00 175.76 175.97 3hpt s VAL 82 N -0.20 3.66 -0.05 0.00 1.01 -1.26 -0.57 120.40 122.99 3hpt s VAL 82 Ca -0.02 -0.43 0.05 0.00 0.00 0.00 0.00 61.98 61.58 3hpt s VAL 82 Cb -0.01 -2.61 -0.02 0.00 0.00 0.00 0.00 36.38 33.73 3hpt s VAL 82 CO -0.00 0.47 -0.20 -1.00 0.00 0.00 0.00 175.10 174.37 3hpt s HIS 83 N 0.67 2.54 0.38 5.22 3.76 0.17 -4.95 115.29 123.09 3hpt s HIS 83 Ca -0.03 -0.45 -0.21 0.00 -0.15 0.00 0.00 55.06 54.22 3hpt s HIS 83 Cb -0.15 -1.61 -0.10 0.00 1.11 0.00 0.00 32.58 31.83 3hpt s HIS 83 CO 0.02 -0.04 0.90 -1.21 -0.85 0.00 0.00 174.74 173.56 3hpt s GLU 84 N -0.41 4.25 -0.16 1.40 2.02 -1.26 -0.52 118.70 124.02 3hpt s GLU 84 Ca 0.04 1.06 -0.22 0.00 0.02 0.00 0.00 54.97 55.87 3hpt s GLU 84 Cb -0.12 -2.37 -0.03 0.00 0.10 0.00 0.00 34.13 31.71 3hpt s GLU 84 CO 0.02 0.08 0.66 0.08 0.02 0.00 0.00 175.26 176.12 3hpt s VAL 85 N -2.01 5.02 -0.16 2.63 1.01 -1.26 -0.98 120.40 124.65 3hpt s VAL 85 Ca 0.57 1.29 -0.25 0.00 0.00 0.00 0.00 61.98 63.59 3hpt s VAL 85 Cb -0.11 -3.98 -0.23 0.00 0.00 0.00 0.00 36.38 32.05 3hpt s VAL 85 CO 0.16 0.15 0.54 -0.08 0.00 0.00 0.00 175.10 175.87 3hpt h GLU 86 N 7.25 0.02 -3.96 2.72 4.81 -0.15 -3.43 114.58 121.83 3hpt h GLU 86 Ca -0.34 -0.04 -0.39 0.00 -0.13 0.00 0.00 59.36 58.46 3hpt h GLU 86 Cb 1.16 0.01 -0.34 0.00 0.63 0.00 0.00 28.75 30.21 3hpt h GLU 86 CO 0.78 1.02 -0.77 0.08 -0.73 0.00 0.00 179.01 179.39 3hpt s VAL 87 N -2.30 0.46 -0.25 0.32 1.01 -0.70 -5.00 120.40 113.94 3hpt s VAL 87 Ca -0.23 -0.08 -0.10 0.00 0.00 0.00 0.00 61.98 61.57 3hpt s VAL 87 Cb 0.01 -0.50 -0.05 0.00 0.00 0.00 0.00 36.38 35.85 3hpt s VAL 87 CO 0.66 0.21 0.16 0.68 0.00 0.00 0.00 175.10 176.81 3hpt s VAL 88 N 0.92 5.30 -0.73 2.92 -7.23 -1.26 -1.03 120.40 119.30 3hpt s VAL 88 Ca -0.11 0.16 -0.02 0.00 -1.81 0.00 0.00 61.98 60.20 3hpt s VAL 88 Cb -0.14 -3.49 0.18 0.00 0.56 0.00 0.00 36.38 33.50 3hpt s VAL 88 CO -0.00 0.32 0.56 -0.63 -0.31 0.00 0.00 175.10 175.04 3hpt s ILE 89 N 1.25 3.88 0.26 -0.62 1.01 0.14 -5.02 121.20 122.10 3hpt s ILE 89 Ca 0.07 -3.39 -0.29 0.00 0.00 0.00 0.00 60.65 57.05 3hpt s ILE 89 Cb -0.14 -3.48 -0.09 0.00 0.01 0.00 0.00 42.46 38.75 3hpt s ILE 89 CO 0.06 -0.96 0.94 -0.75 0.00 0.00 0.00 174.94 174.23 3hpt s LYS 90 N -0.63 4.78 -0.03 2.79 2.20 -1.26 -0.82 119.74 126.77 3hpt s LYS 90 Ca 0.21 1.45 -0.30 0.00 -0.36 0.00 0.00 55.97 56.98 3hpt s LYS 90 Cb -0.15 -3.15 -0.07 0.00 -1.51 0.00 0.00 37.83 32.96 3hpt s LYS 90 CO -0.07 0.45 1.77 -1.58 -0.36 0.00 0.00 175.35 175.55 3hpt s HIS 91 N -1.30 1.73 0.63 4.03 5.65 -0.89 -4.85 115.29 120.30 3hpt s HIS 91 Ca 0.44 -0.01 0.36 0.00 0.25 0.00 0.00 55.06 56.09 3hpt s HIS 91 Cb -0.24 -4.03 2.01 0.00 -1.18 0.00 0.00 32.58 29.14 3hpt s HIS 91 CO 0.30 -4.41 2.22 -0.91 -0.65 0.00 0.00 174.74 171.29 3hpt h ASN 92 N 10.02 0.00 -0.08 9.88 2.35 -1.93 -0.45 115.58 135.37 3hpt h ASN 92 Ca -0.43 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.32 3hpt h ASN 92 Cb 1.20 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.57 3hpt h ASN 92 CO 0.95 0.00 0.00 0.54 -1.65 0.00 0.00 177.43 177.27 3hpt n ARG 93 N -3.38 1.66 -1.65 0.81 1.74 -1.26 -4.93 116.66 109.66 3hpt n ARG 93 Ca -0.02 -0.98 -0.50 0.00 -0.77 0.00 0.00 57.85 55.58 3hpt n ARG 93 Cb 0.18 -1.44 -0.05 0.00 -1.02 0.00 0.00 32.46 30.13 3hpt n ARG 93 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 3hpt n PHE 94 N 0.19 1.95 -4.06 -1.55 7.35 -0.18 -4.62 117.46 116.55 3hpt n PHE 94 Ca 0.18 0.41 -0.33 0.00 -0.76 0.00 0.00 57.45 56.95 3hpt n PHE 94 Cb 0.33 -2.46 -0.15 0.00 0.35 0.00 0.00 39.48 37.54 3hpt n PHE 94 CO 0.00 0.00 0.00 0.99 -0.76 0.00 0.00 176.76 176.99 3hpt s THR 95 N 1.49 2.35 0.26 -2.13 2.01 -0.43 -5.01 115.64 114.17 3hpt s THR 95 Ca 0.85 -1.12 -0.03 0.00 0.31 0.00 0.00 61.69 61.71 3hpt s THR 95 Cb -0.84 -2.15 0.13 0.00 0.01 0.00 0.00 72.50 69.65 3hpt s THR 95 CO 0.47 0.30 1.78 0.11 -0.69 0.00 0.00 174.62 176.59 3hpt h LYS 96 N 7.92 0.86 0.00 4.92 1.57 -1.92 0.53 116.57 130.45 3hpt h LYS 96 Ca -0.35 -0.21 -0.03 0.00 -1.87 0.00 0.00 60.65 58.19 3hpt h LYS 96 Cb 1.11 -0.11 -0.00 0.00 0.08 0.00 0.00 32.23 33.30 3hpt h LYS 96 CO 0.58 0.81 -0.15 1.05 -0.57 0.00 0.00 179.45 181.16 3hpt h GLU 97 N 0.81 0.00 0.00 3.15 9.09 -1.98 -3.33 114.58 122.32 3hpt h GLU 97 Ca 0.17 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.58 3hpt h GLU 97 Cb 0.38 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.48 3hpt h GLU 97 CO 0.01 0.15 -1.27 0.25 0.05 0.00 0.00 179.01 178.20 3hpt n THR 98 N -3.18 0.00 -1.65 -1.06 -2.24 -1.08 -5.00 114.28 100.07 3hpt n THR 98 Ca 0.02 -0.15 -0.15 0.00 -2.27 0.00 0.00 64.05 61.51 3hpt n THR 98 Cb 0.51 0.37 -0.05 0.00 -2.10 0.00 0.00 70.33 69.06 3hpt n THR 98 CO 0.00 0.00 0.00 -1.22 -0.57 0.00 0.00 175.07 173.28 3hpt n TYR 99 N -1.71 -0.18 -2.33 4.78 4.02 0.18 -4.98 117.16 116.95 3hpt n TYR 99 Ca -0.01 0.00 -0.37 0.00 -0.01 0.00 0.00 57.90 57.51 3hpt n TYR 99 Cb 0.16 -2.74 -0.02 0.00 -0.02 0.00 0.00 39.34 36.73 3hpt n TYR 99 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 176.86 176.19 3hpt s ASP 100 N -2.71 6.24 -1.37 7.72 2.15 -1.22 -3.05 116.67 124.43 3hpt s ASP 100 Ca 0.00 2.22 -0.08 0.00 0.43 0.00 0.00 52.55 55.12 3hpt s ASP 100 Cb 0.00 -2.59 0.03 0.00 -0.30 0.00 0.00 42.92 40.05 3hpt s ASP 100 CO 0.00 -0.86 1.08 0.49 -0.17 0.00 0.00 175.17 175.71 3hpt n PHE 101 N -0.52 -2.59 -2.44 -5.34 3.01 -1.26 -1.32 117.46 106.99 3hpt n PHE 101 Ca 0.07 0.97 -0.43 0.00 1.01 0.00 0.00 57.45 59.08 3hpt n PHE 101 Cb 0.49 -4.77 0.00 0.00 -0.01 0.00 0.00 39.48 35.19 3hpt n PHE 101 CO 0.00 0.00 0.00 -3.47 1.01 0.00 0.00 176.76 174.30 3hpt n ASP 102 N -3.00 4.77 -3.67 4.37 4.64 -1.17 -3.92 116.55 118.56 3hpt n ASP 102 Ca -0.05 -2.92 -0.15 0.00 -1.38 0.00 0.00 54.79 50.29 3hpt n ASP 102 Cb 0.58 -1.69 -0.08 0.00 -1.04 0.00 0.00 41.12 38.89 3hpt n ASP 102 CO 0.00 0.00 0.00 -0.51 -0.82 0.00 0.00 177.20 175.87 3hpt s ILE 103 N 3.38 0.02 0.02 5.18 2.07 -1.26 -4.04 121.20 126.57 3hpt s ILE 103 Ca 0.50 -0.15 -0.19 0.00 -1.41 0.00 0.00 60.65 59.40 3hpt s ILE 103 Cb 0.05 -0.75 0.04 0.00 0.13 0.00 0.00 42.46 41.93 3hpt s ILE 103 CO 0.03 -0.08 0.41 0.00 -1.91 0.00 0.00 174.94 173.39 3hpt s ALA 104 N -0.61 -1.02 0.04 1.50 0.00 -0.38 -2.10 121.76 119.19 3hpt s ALA 104 Ca -0.07 0.42 0.09 0.00 0.00 0.00 0.00 51.96 52.40 3hpt s ALA 104 Cb -0.03 0.22 -0.03 0.00 0.00 0.00 0.00 23.12 23.28 3hpt s ALA 104 CO 0.04 -0.39 -0.26 0.08 0.00 0.00 0.00 175.76 175.24 3hpt s VAL 105 N -1.99 2.09 -0.15 0.00 1.01 0.00 -1.40 120.40 119.98 3hpt s VAL 105 Ca -0.08 -1.34 0.02 0.00 0.00 0.00 0.00 61.98 60.58 3hpt s VAL 105 Cb -0.02 -1.78 0.01 0.00 0.00 0.00 0.00 36.38 34.58 3hpt s VAL 105 CO 0.01 0.39 -0.20 -0.76 0.00 0.00 0.00 175.10 174.54 3hpt s LEU 106 N -1.14 2.23 -0.11 3.92 1.43 0.09 -0.69 118.68 124.41 3hpt s LEU 106 Ca 0.11 -0.56 -0.19 0.00 -1.03 0.00 0.00 54.13 52.46 3hpt s LEU 106 Cb -0.10 -1.49 -0.04 0.00 0.03 0.00 0.00 46.19 44.60 3hpt s LEU 106 CO 0.02 0.08 0.53 -0.60 0.23 0.00 0.00 176.35 176.61 3hpt s ARG 107 N 0.83 4.36 0.19 1.70 3.52 -0.20 -1.26 118.95 128.08 3hpt s ARG 107 Ca -0.06 0.55 -0.13 0.00 -0.13 0.00 0.00 55.73 55.95 3hpt s ARG 107 Cb -0.15 -3.44 -0.07 0.00 -1.56 0.00 0.00 34.95 29.72 3hpt s ARG 107 CO -0.02 0.13 0.57 -0.51 -0.81 0.00 0.00 175.30 174.67 3hpt s LEU 108 N 0.68 4.28 0.18 -0.88 1.43 0.24 0.54 118.68 125.15 3hpt s LEU 108 Ca 0.29 1.08 -0.12 0.00 -1.03 0.00 0.00 54.13 54.34 3hpt s LEU 108 Cb -0.16 -3.45 0.10 0.00 0.03 0.00 0.00 46.19 42.71 3hpt s LEU 108 CO 0.12 0.03 1.83 0.11 0.23 0.00 0.00 176.35 178.67 3hpt h LYS 109 N 3.20 0.84 -6.43 1.70 1.57 -1.34 -3.42 116.57 112.69 3hpt h LYS 109 Ca -0.48 -0.07 -0.67 0.00 -1.87 0.00 0.00 60.65 57.56 3hpt h LYS 109 Cb 1.19 -0.18 -0.30 0.00 0.08 0.00 0.00 32.23 33.02 3hpt h LYS 109 CO 0.67 0.60 -0.88 0.95 -0.57 0.00 0.00 179.45 180.21 3hpt s THR 110 N -6.00 1.92 0.54 -0.16 -4.23 -1.26 -5.02 115.64 101.44 3hpt s THR 110 Ca -0.13 -1.04 -0.20 0.00 -1.18 0.00 0.00 61.69 59.14 3hpt s THR 110 Cb 0.13 -1.60 -0.05 0.00 1.34 0.00 0.00 72.50 72.32 3hpt s THR 110 CO 0.77 0.54 1.17 -2.16 -0.54 0.00 0.00 174.62 174.41 3hpt s PRO 111 N -0.57 3.31 0.09 3.99 0.04 -1.26 -4.90 135.00 135.70 3hpt s PRO 111 Ca 0.09 1.75 -0.30 0.00 0.04 0.00 0.00 61.00 62.58 3hpt s PRO 111 Cb -0.09 -2.08 -0.06 0.00 0.04 0.00 0.00 34.50 32.31 3hpt s PRO 111 CO -0.01 -0.92 1.21 0.42 0.04 0.00 0.00 177.00 177.74 3hpt s ILE 112 N -1.64 3.89 -0.49 0.56 1.01 0.87 -5.00 121.20 120.40 3hpt s ILE 112 Ca 0.72 1.41 -0.25 0.00 0.00 0.00 0.00 60.65 62.53 3hpt s ILE 112 Cb -0.28 -3.90 0.03 0.00 0.01 0.00 0.00 42.46 38.32 3hpt s ILE 112 CO 0.32 0.14 0.95 -0.89 0.00 0.00 0.00 174.94 175.45 3hpt s THR 113 N 0.81 4.42 0.26 2.92 2.01 -1.26 -4.73 115.64 120.06 3hpt s THR 113 Ca 0.58 0.65 -0.30 0.00 0.31 0.00 0.00 61.69 62.94 3hpt s THR 113 Cb -0.31 -4.48 -0.10 0.00 0.01 0.00 0.00 72.50 67.62 3hpt s THR 113 CO 0.31 -0.94 1.35 -0.36 -0.69 0.00 0.00 174.62 174.28 3hpt s PHE 114 N 3.90 3.12 0.32 4.92 0.08 -1.26 -4.95 117.98 124.11 3hpt s PHE 114 Ca 0.36 1.24 -0.11 0.00 0.12 0.00 0.00 56.93 58.53 3hpt s PHE 114 Cb -0.10 -3.69 0.05 0.00 -0.57 0.00 0.00 43.02 38.70 3hpt s PHE 114 CO 0.25 -2.09 0.63 2.89 -0.10 0.00 0.00 175.22 176.80 3hpt n ARG 115 N 1.87 0.91 -1.60 0.44 1.85 -0.55 -5.02 116.66 114.56 3hpt n ARG 115 Ca 0.04 -1.85 -0.53 0.00 -1.00 0.00 0.00 57.85 54.51 3hpt n ARG 115 Cb 0.42 2.27 -0.06 0.00 -1.05 0.00 0.00 32.46 34.04 3hpt n ARG 115 CO 0.00 0.00 0.00 -0.12 -0.01 0.00 0.00 177.63 177.50 3hpt n MET 116 N -0.44 1.12 -1.09 2.89 0.00 -1.26 -1.11 117.12 117.24 3hpt n MET 116 Ca -0.07 0.41 -0.03 0.00 -0.00 0.00 0.00 57.70 58.01 3hpt n MET 116 Cb 0.49 -2.05 -0.01 0.00 0.00 0.00 0.00 33.22 31.64 3hpt n MET 116 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 175.97 176.06 3hpt n ASN 117 N 2.77 -4.32 -3.41 6.12 3.02 -1.26 -4.96 115.26 113.22 3hpt n ASN 117 Ca 0.19 0.07 -0.18 0.00 -0.03 0.00 0.00 54.58 54.63 3hpt n ASN 117 Cb 0.18 -2.08 -0.10 0.00 -0.61 0.00 0.00 39.78 37.17 3hpt n ASN 117 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 3hpt s VAL 118 N -1.79 -0.37 -0.07 2.41 1.01 -0.27 -4.12 120.40 117.21 3hpt s VAL 118 Ca 0.00 -0.54 -0.28 0.00 0.00 0.00 0.00 61.98 61.16 3hpt s VAL 118 Cb 0.00 -0.98 0.06 0.00 0.00 0.00 0.00 36.38 35.47 3hpt s VAL 118 CO 0.00 -0.50 0.64 0.00 0.00 0.00 0.00 175.10 175.24 3hpt s ALA 119 N 2.30 -1.64 0.43 5.51 0.00 -0.81 -1.48 121.76 126.07 3hpt s ALA 119 Ca 0.10 1.27 -0.22 0.00 0.00 0.00 0.00 51.96 53.10 3hpt s ALA 119 Cb -0.14 -0.11 -0.09 0.00 0.00 0.00 0.00 23.12 22.77 3hpt s ALA 119 CO -0.32 -0.35 1.01 -1.25 0.00 0.00 0.00 175.76 174.85 3hpt s PRO 120 N -1.04 4.08 0.42 0.00 0.04 -1.26 -2.59 135.00 134.65 3hpt s PRO 120 Ca -0.10 1.35 -0.09 0.00 0.04 0.00 0.00 61.00 62.20 3hpt s PRO 120 Cb -0.01 -2.31 -0.05 0.00 0.04 0.00 0.00 34.50 32.16 3hpt s PRO 120 CO 0.08 -0.19 0.76 0.00 0.04 0.00 0.00 177.00 177.70 3hpt s ALA 121 N -1.90 3.38 0.14 8.56 0.00 -0.69 -4.90 121.76 126.35 3hpt s ALA 121 Ca 0.62 -0.31 -0.25 0.00 0.00 0.00 0.00 51.96 52.01 3hpt s ALA 121 Cb -0.17 -2.65 -0.07 0.00 0.00 0.00 0.00 23.12 20.23 3hpt s ALA 121 CO 0.21 -0.11 0.76 0.00 0.00 0.00 0.00 175.76 176.62 3hpt s LEU 123 N -0.95 4.15 0.66 0.00 1.43 -1.26 -0.32 118.68 122.38 3hpt s LEU 123 Ca 0.36 0.99 -0.11 0.00 -1.03 0.00 0.00 54.13 54.33 3hpt s LEU 123 Cb -0.22 -3.06 -0.02 0.00 0.03 0.00 0.00 46.19 42.92 3hpt s LEU 123 CO 0.25 -0.35 1.05 -2.16 0.23 0.00 0.00 176.35 175.37 3hpt s PRO 124 N 2.13 3.28 0.25 1.29 0.04 -1.26 -4.98 135.00 135.75 3hpt s PRO 124 Ca 0.33 0.70 -0.30 0.00 0.04 0.00 0.00 61.00 61.78 3hpt s PRO 124 Cb -0.16 -2.05 -0.09 0.00 0.04 0.00 0.00 34.50 32.24 3hpt s PRO 124 CO 0.11 -0.79 1.27 -1.21 0.04 0.00 0.00 177.00 176.42 3hpt s GLU 124 N -5.21 4.42 0.08 4.56 2.02 -1.26 -4.92 118.70 118.39 3hpt s GLU 124 Ca 0.56 2.06 -0.30 0.00 0.02 0.00 0.00 54.97 57.31 3hpt s GLU 124 Cb -0.12 -3.15 -0.14 0.00 0.10 0.00 0.00 34.13 30.82 3hpt s GLU 124 CO 0.54 -0.15 1.48 -0.09 0.02 0.00 0.00 175.26 177.05 3hpt h ARG 125 N 4.47 -0.72 -0.59 1.61 2.43 -1.96 0.20 114.38 119.83 3hpt h ARG 125 Ca -0.46 0.05 0.01 0.00 -0.81 0.00 0.00 59.98 58.77 3hpt h ARG 125 Cb 1.22 0.16 -0.03 0.00 -0.42 0.00 0.00 29.97 30.90 3hpt h ARG 125 CO 0.72 -0.48 0.38 -0.44 -1.51 0.00 0.00 179.97 178.63 3hpt h ASP 126 N -0.75 0.64 -0.68 -3.80 3.32 -1.95 -1.35 116.42 111.86 3hpt h ASP 126 Ca -0.03 -0.01 -0.07 0.00 0.02 0.00 0.00 57.03 56.94 3hpt h ASP 126 Cb 0.70 -0.15 -0.03 0.00 0.22 0.00 0.00 39.33 40.07 3hpt h ASP 126 CO -0.16 0.46 0.15 -0.25 -1.72 0.00 0.00 179.24 177.72 3hpt h TRP 127 N 0.76 1.15 -0.46 4.55 7.01 -1.95 -2.33 115.95 124.68 3hpt h TRP 127 Ca 0.22 -0.14 0.00 0.00 2.11 0.00 0.00 58.89 61.08 3hpt h TRP 127 Cb -0.05 -0.32 -0.02 0.00 -2.10 0.00 0.00 29.16 26.66 3hpt h TRP 127 CO -0.04 0.95 0.30 0.00 -2.79 0.00 0.00 178.44 176.85 3hpt h ALA 128 N 1.07 0.59 -0.20 2.65 0.00 -0.46 0.21 119.26 123.12 3hpt h ALA 128 Ca 0.21 -0.04 0.04 0.00 0.00 0.00 0.00 54.91 55.11 3hpt h ALA 128 Cb 0.38 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.95 3hpt h ALA 128 CO 0.00 0.05 -0.02 0.93 0.00 0.00 0.00 179.25 180.21 3hpt h GLU 129 N 0.62 0.03 0.00 0.00 5.08 -1.02 0.96 114.58 120.26 3hpt h GLU 129 Ca 0.17 -0.00 -0.11 0.00 -1.00 0.00 0.00 59.36 58.42 3hpt h GLU 129 Cb -0.05 -0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.18 3hpt h GLU 129 CO -0.03 0.02 -0.70 0.66 -1.00 0.00 0.00 179.01 177.95 3hpt h SER 130 N 0.03 0.00 0.00 1.42 4.64 -1.29 -3.32 113.55 115.03 3hpt h SER 130 Ca 0.09 0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 61.33 3hpt h SER 130 Cb 0.13 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.20 3hpt h SER 130 CO -0.18 0.48 -1.39 0.41 -0.87 0.00 0.00 176.83 175.28 3hpt n THR 131 N -3.13 0.32 -0.13 2.95 -1.04 0.73 -4.52 114.28 109.47 3hpt n THR 131 Ca -0.01 -0.24 -0.28 0.00 -2.04 0.00 0.00 64.05 61.49 3hpt n THR 131 Cb 0.74 -0.56 -0.10 0.00 -1.82 0.00 0.00 70.33 68.59 3hpt n THR 131 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 3hpt n LEU 131 N -2.11 1.94 0.13 -4.42 4.77 0.20 -4.43 117.00 113.07 3hpt n LEU 131 Ca -0.08 0.29 0.11 0.00 -0.03 0.00 0.00 56.01 56.30 3hpt n LEU 131 Cb 0.58 -0.78 0.49 0.00 -2.33 0.00 0.00 43.42 41.37 3hpt n LEU 131 CO 0.13 0.57 0.82 0.23 -1.33 0.00 0.00 177.39 177.82 3hpt n MET 131 N -4.13 0.16 -0.37 3.23 2.81 -0.41 -1.88 117.12 116.52 3hpt n MET 131 Ca -0.52 0.49 0.09 0.00 -1.81 0.00 0.00 57.70 55.95 3hpt n MET 131 Cb 0.88 -1.86 0.28 0.00 -0.71 0.00 0.00 33.22 31.81 3hpt n MET 131 CO 0.00 0.00 0.00 0.25 1.51 0.00 0.00 175.97 177.73 3hpt n THR 132 N -2.17 1.03 -2.28 2.03 -2.24 -1.26 -4.94 114.28 104.46 3hpt n THR 132 Ca 0.01 -0.88 -0.28 0.00 -2.27 0.00 0.00 64.05 60.64 3hpt n THR 132 Cb 0.15 0.32 0.03 0.00 -2.10 0.00 0.00 70.33 68.73 3hpt n THR 132 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 3hpt s GLN 133 N -1.34 2.98 0.15 -0.78 -1.52 -0.79 -5.00 119.66 113.35 3hpt s GLN 133 Ca 0.42 0.14 -0.11 0.00 -1.95 0.00 0.00 55.36 53.86 3hpt s GLN 133 Cb 0.23 -2.22 0.02 0.00 -0.22 0.00 0.00 33.01 30.82 3hpt s GLN 133 CO 0.26 -0.73 1.58 0.87 -0.25 0.00 0.00 175.29 177.02 3hpt h LYS 134 N -0.26 0.93 -4.21 2.91 1.57 -1.92 -3.42 116.57 112.16 3hpt h LYS 134 Ca -0.45 -0.33 -0.12 0.00 -1.87 0.00 0.00 60.65 57.87 3hpt h LYS 134 Cb 1.25 -0.06 -0.15 0.00 0.08 0.00 0.00 32.23 33.35 3hpt h LYS 134 CO 0.61 0.99 -0.64 0.95 -0.57 0.00 0.00 179.45 180.80 3hpt s THR 135 N -4.88 0.19 0.38 -0.16 -4.23 -1.26 -1.25 115.64 104.44 3hpt s THR 135 Ca -0.12 -1.75 0.04 0.00 -1.18 0.00 0.00 61.69 58.68 3hpt s THR 135 Cb 0.12 -1.58 -0.03 0.00 1.34 0.00 0.00 72.50 72.34 3hpt s THR 135 CO 0.84 -0.88 0.11 -0.83 -0.54 0.00 0.00 174.62 173.32 3hpt s GLY 136 N -2.93 2.44 -0.13 3.99 0.00 -0.10 -4.75 107.32 105.84 3hpt s GLY 136 Ca 0.09 -1.45 0.02 0.00 0.00 0.00 0.00 44.72 43.38 3hpt s GLY 136 CO -0.08 -1.82 -0.18 -0.42 0.00 0.00 0.00 173.10 170.59 3hpt s ILE 137 N -3.25 2.45 -0.01 0.90 1.09 0.10 -0.14 121.20 122.35 3hpt s ILE 137 Ca 0.27 -0.86 0.00 0.00 -1.10 0.00 0.00 60.65 58.97 3hpt s ILE 137 Cb 0.04 -2.00 -0.04 0.00 -1.06 0.00 0.00 42.46 39.41 3hpt s ILE 137 CO 0.14 0.54 0.04 0.54 -0.10 0.00 0.00 174.94 176.10 3hpt s VAL 138 N 0.61 4.45 0.15 2.92 0.11 -0.26 -0.74 120.40 127.65 3hpt s VAL 138 Ca -0.10 -0.49 -0.03 0.00 -2.93 0.00 0.00 61.98 58.43 3hpt s VAL 138 Cb -0.16 -3.01 -0.03 0.00 -1.53 0.00 0.00 36.38 31.65 3hpt s VAL 138 CO 0.03 0.38 0.13 -0.94 -3.33 0.00 0.00 175.10 171.37 3hpt s SER 139 N -1.61 0.21 0.00 3.54 1.04 -1.14 -1.01 113.70 114.74 3hpt s SER 139 Ca 0.21 -1.12 0.00 0.00 0.48 0.00 0.00 55.95 55.52 3hpt s SER 139 Cb -0.12 0.35 0.00 0.00 0.10 0.00 0.00 66.02 66.35 3hpt s SER 139 CO 0.12 -0.79 0.00 0.61 0.98 0.00 0.00 173.24 174.15 3hpt n GLY 140 N -0.15 -0.43 1.43 7.32 0.00 -0.50 -4.29 105.19 108.57 3hpt n GLY 140 Ca -0.05 -1.28 0.10 0.00 0.00 0.00 0.00 46.02 44.79 3hpt n GLY 140 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3hpt n PHE 141 N -0.98 1.18 -0.95 1.61 3.72 -1.26 -1.98 117.46 118.80 3hpt n PHE 141 Ca 0.00 -0.52 -0.30 0.00 -0.05 0.00 0.00 57.45 56.58 3hpt n PHE 141 Cb 0.00 -0.11 0.25 0.00 -0.94 0.00 0.00 39.48 38.68 3hpt n PHE 141 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 176.76 176.91 3hpt s GLY 142 N -0.94 1.55 0.23 1.37 0.00 -1.26 -1.62 107.32 106.64 3hpt s GLY 142 Ca 0.49 -0.89 -0.32 0.00 0.00 0.00 0.00 44.72 44.00 3hpt s GLY 142 CO 0.29 0.00 1.38 0.54 0.00 0.00 0.00 173.10 175.31 3hpt n ARG 143 N -4.91 1.91 0.00 2.90 1.74 -0.34 -2.11 116.66 115.86 3hpt n ARG 143 Ca 0.13 0.68 0.14 0.00 -0.77 0.00 0.00 57.85 58.03 3hpt n ARG 143 Cb 0.59 -2.32 0.61 0.00 -1.02 0.00 0.00 32.46 30.32 3hpt n ARG 143 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 3hpt n THR 144 N 1.89 0.00 -3.75 0.55 -2.24 -0.93 -1.03 114.28 108.76 3hpt n THR 144 Ca 0.12 -0.09 -0.13 0.00 -2.27 0.00 0.00 64.05 61.67 3hpt n THR 144 Cb 0.30 0.02 -0.09 0.00 -2.10 0.00 0.00 70.33 68.46 3hpt n THR 144 CO 0.00 0.00 0.00 -2.28 -0.57 0.00 0.00 175.07 172.22 3hpt s HIS 145 N -2.33 -0.26 0.36 4.78 5.65 -1.26 -4.15 115.29 118.08 3hpt s HIS 145 Ca 0.32 0.51 0.13 0.00 0.25 0.00 0.00 55.06 56.28 3hpt s HIS 145 Cb 0.20 0.12 0.96 0.00 -1.18 0.00 0.00 32.58 32.68 3hpt s HIS 145 CO 0.44 -0.33 1.77 1.49 -0.65 0.00 0.00 174.74 177.47 3hpt h GLU 147 N 4.41 0.52 -0.27 2.88 4.81 -1.90 -0.83 114.58 124.20 3hpt h GLU 147 Ca -0.29 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 58.91 3hpt h GLU 147 Cb 1.18 -0.12 0.00 0.00 0.63 0.00 0.00 28.75 30.44 3hpt h GLU 147 CO 0.36 0.34 0.00 1.63 -0.73 0.00 0.00 179.01 180.61 3hpt n LYS 148 N -4.70 2.42 0.00 1.92 5.02 -1.26 -4.91 118.16 116.64 3hpt n LYS 148 Ca 0.24 -2.11 0.00 0.00 -2.02 0.00 0.00 58.31 54.42 3hpt n LYS 148 Cb 0.75 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 34.26 3hpt n LYS 148 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3hpt n GLY 149 N 1.44 1.81 3.35 0.72 0.00 -0.32 -5.14 105.19 107.07 3hpt n GLY 149 Ca 0.18 -1.88 -0.25 0.00 0.00 0.00 0.00 46.02 44.07 3hpt n GLY 149 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3hpt s ARG 150 N 3.57 1.32 0.30 1.61 0.52 -1.26 -4.85 118.95 120.17 3hpt s ARG 150 Ca 0.00 -1.37 -0.29 0.00 -0.52 0.00 0.00 55.73 53.54 3hpt s ARG 150 Cb 0.00 -1.57 -0.12 0.00 0.52 0.00 0.00 34.95 33.78 3hpt s ARG 150 CO 0.00 0.34 1.41 1.04 0.02 0.00 0.00 175.30 178.11 3hpt n GLN 151 N 0.56 2.27 -2.17 3.54 6.02 -1.26 -2.20 117.38 124.14 3hpt n GLN 151 Ca -0.15 0.80 -0.41 0.00 -0.01 0.00 0.00 57.00 57.23 3hpt n GLN 151 Cb 0.55 -2.46 -0.03 0.00 1.02 0.00 0.00 30.24 29.32 3hpt n GLN 151 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.06 176.50 3hpt s SER 152 N 0.06 6.84 0.07 1.08 0.15 -0.64 -4.85 113.70 116.41 3hpt s SER 152 Ca 0.61 2.58 0.26 0.00 0.70 0.00 0.00 55.95 60.10 3hpt s SER 152 Cb -0.57 -2.63 0.78 0.00 -1.71 0.00 0.00 66.02 61.89 3hpt s SER 152 CO 0.56 -0.51 1.64 0.35 1.20 0.00 0.00 173.24 176.48 3hpt n THR 153 N 1.43 0.19 -5.02 6.45 -2.24 -1.26 -4.71 114.28 109.13 3hpt n THR 153 Ca 0.02 -0.11 -0.32 0.00 -2.27 0.00 0.00 64.05 61.36 3hpt n THR 153 Cb 0.42 -0.25 -0.14 0.00 -2.10 0.00 0.00 70.33 68.26 3hpt n THR 153 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 3hpt s ARG 154 N -3.05 2.52 0.04 -0.78 3.00 -1.25 0.05 118.95 119.47 3hpt s ARG 154 Ca 0.11 -0.77 -0.30 0.00 0.00 0.00 0.00 55.73 54.76 3hpt s ARG 154 Cb 0.16 -2.31 -0.07 0.00 0.00 0.00 0.00 34.95 32.73 3hpt s ARG 154 CO 0.63 0.54 1.57 -1.17 0.00 0.00 0.00 175.30 176.86 3hpt s LEU 155 N -0.52 4.35 0.26 2.53 2.96 -0.41 -4.72 118.68 123.13 3hpt s LEU 155 Ca 0.07 2.34 0.10 0.00 -0.22 0.00 0.00 54.13 56.42 3hpt s LEU 155 Cb -0.11 -3.56 -0.04 0.00 0.50 0.00 0.00 46.19 42.97 3hpt s LEU 155 CO 0.01 -0.83 -0.05 -0.54 -1.32 0.00 0.00 176.35 173.62 3hpt s LYS 156 N 2.66 2.15 0.19 1.98 1.02 -0.83 -0.69 119.74 126.21 3hpt s LYS 156 Ca 0.70 -1.47 0.04 0.00 0.02 0.00 0.00 55.97 55.26 3hpt s LYS 156 Cb -0.37 -2.09 -0.05 0.00 -0.52 0.00 0.00 37.83 34.81 3hpt s LYS 156 CO 0.30 0.37 -0.05 0.00 -0.92 0.00 0.00 175.35 175.05 3hpt s MET 157 N -3.56 1.18 -0.24 1.68 0.23 0.26 -1.41 119.30 117.45 3hpt s MET 157 Ca 0.30 -1.56 -0.12 0.00 -1.03 0.00 0.00 55.69 53.28 3hpt s MET 157 Cb -0.06 -0.57 0.08 0.00 -1.53 0.00 0.00 34.83 32.75 3hpt s MET 157 CO 0.18 -0.02 0.58 -1.17 -2.03 0.00 0.00 175.02 172.56 3hpt s LEU 158 N -3.23 -0.71 -0.08 0.18 0.20 -0.18 -1.37 118.68 113.50 3hpt s LEU 158 Ca 0.23 1.30 -0.30 0.00 0.69 0.00 0.00 54.13 56.05 3hpt s LEU 158 Cb 0.04 1.99 -0.02 0.00 -0.43 0.00 0.00 46.19 47.77 3hpt s LEU 158 CO 0.04 -0.22 1.06 -0.70 -0.29 0.00 0.00 176.35 176.24 3hpt s GLU 159 N 1.86 4.41 -0.12 1.98 2.12 -1.26 -1.10 118.70 126.60 3hpt s GLU 159 Ca -0.08 1.47 0.01 0.00 0.36 0.00 0.00 54.97 56.73 3hpt s GLU 159 Cb -0.08 -3.54 0.02 0.00 0.26 0.00 0.00 34.13 30.79 3hpt s GLU 159 CO -0.17 -0.33 -0.14 0.14 -0.54 0.00 0.00 175.26 174.22 3hpt s VAL 160 N 1.97 1.47 0.32 3.70 -7.23 0.80 -4.98 120.40 116.46 3hpt s VAL 160 Ca 0.51 -0.61 -0.29 0.00 -1.81 0.00 0.00 61.98 59.77 3hpt s VAL 160 Cb -0.20 -1.36 -0.11 0.00 0.56 0.00 0.00 36.38 35.26 3hpt s VAL 160 CO 0.20 0.44 1.57 -2.84 -0.31 0.00 0.00 175.10 174.16 3hpt s PRO 161 N 1.14 4.10 0.35 4.82 0.02 -1.26 -0.92 135.00 143.25 3hpt s PRO 161 Ca -0.04 2.60 -0.28 0.00 0.02 0.00 0.00 61.00 63.30 3hpt s PRO 161 Cb -0.14 -3.00 -0.10 0.00 0.02 0.00 0.00 34.50 31.28 3hpt s PRO 161 CO -0.04 -0.62 1.36 0.71 -0.33 0.00 0.00 177.00 178.08 3hpt s TYR 162 N -0.38 2.91 -0.09 6.54 2.02 -0.38 -0.04 117.35 127.93 3hpt s TYR 162 Ca 0.60 1.34 0.02 0.00 -0.37 0.00 0.00 57.07 58.66 3hpt s TYR 162 Cb -0.48 -3.78 -0.02 0.00 -0.40 0.00 0.00 41.96 37.28 3hpt s TYR 162 CO 0.54 -2.19 -0.15 0.08 -1.57 0.00 0.00 175.55 172.25 3hpt s VAL 163 N -1.14 2.93 0.61 0.71 1.01 -0.68 -4.87 120.40 118.98 3hpt s VAL 163 Ca 0.50 -0.73 -0.19 0.00 0.00 0.00 0.00 61.98 61.56 3hpt s VAL 163 Cb -0.42 -2.18 -0.03 0.00 0.00 0.00 0.00 36.38 33.75 3hpt s VAL 163 CO 0.56 0.56 1.27 1.51 0.00 0.00 0.00 175.10 179.00 3hpt s ASP 164 N -0.11 4.93 0.32 3.32 1.47 -1.26 -4.37 116.67 120.97 3hpt s ASP 164 Ca -0.02 2.57 0.01 0.00 1.18 0.00 0.00 52.55 56.29 3hpt s ASP 164 Cb -0.14 -2.61 0.56 0.00 -0.34 0.00 0.00 42.92 40.38 3hpt s ASP 164 CO 0.04 -1.78 1.94 -0.09 0.68 0.00 0.00 175.17 175.96 3hpt h ARG 165 N 0.84 0.96 -0.15 2.11 2.43 -1.98 -0.37 114.38 118.22 3hpt h ARG 165 Ca -0.51 -0.06 -0.02 0.00 -0.81 0.00 0.00 59.98 58.59 3hpt h ARG 165 Cb 1.32 -0.22 -0.01 0.00 -0.42 0.00 0.00 29.97 30.64 3hpt h ARG 165 CO 0.55 0.64 0.02 -0.91 -1.51 0.00 0.00 179.97 178.75 3hpt h ASN 166 N 0.99 0.24 -0.69 -3.80 -0.26 -1.99 -0.15 115.58 109.91 3hpt h ASN 166 Ca 0.35 -0.27 -0.02 0.00 -0.56 0.00 0.00 56.30 55.80 3hpt h ASN 166 Cb 0.12 -0.06 -0.03 0.00 -1.06 0.00 0.00 38.32 37.28 3hpt h ASN 166 CO -0.11 0.45 0.37 0.28 -1.06 0.00 0.00 177.43 177.36 3hpt h SER 167 N 0.02 0.89 0.42 5.81 0.02 -1.87 -1.53 113.55 117.31 3hpt h SER 167 Ca 0.04 -0.08 -0.01 0.00 -0.84 0.00 0.00 61.79 60.91 3hpt h SER 167 Cb 0.32 -0.23 -0.02 0.00 0.14 0.00 0.00 62.40 62.61 3hpt h SER 167 CO 0.00 0.73 -0.41 0.00 -1.14 0.00 0.00 176.83 176.02 3hpt h LYS 169 N -0.84 0.40 0.00 0.00 1.57 -0.79 -2.62 116.57 114.29 3hpt h LYS 169 Ca -0.04 -0.02 -0.02 0.00 -1.87 0.00 0.00 60.65 58.70 3hpt h LYS 169 Cb 0.74 -0.09 -0.00 0.00 0.08 0.00 0.00 32.23 32.96 3hpt h LYS 169 CO -0.06 0.26 -0.10 1.37 -0.57 0.00 0.00 179.45 180.35 3hpt h LEU 170 N 0.41 0.00 -0.87 2.94 -0.00 -1.29 -2.75 115.31 113.75 3hpt h LEU 170 Ca 0.14 0.00 -0.06 0.00 -0.00 0.00 0.00 57.88 57.96 3hpt h LEU 170 Cb 0.01 0.00 -0.01 0.00 -0.00 0.00 0.00 40.66 40.66 3hpt h LEU 170 CO -0.07 0.10 -0.30 0.77 -0.00 0.00 0.00 178.44 178.94 3hpt h SER 171 N 0.00 0.00 -2.83 0.17 4.64 -0.96 -3.47 113.55 111.11 3hpt h SER 171 Ca -0.00 0.00 -0.64 0.00 -0.47 0.00 0.00 61.79 60.68 3hpt h SER 171 Cb 0.72 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 62.75 3hpt h SER 171 CO 0.01 0.30 -0.36 -0.55 -0.87 0.00 0.00 176.83 175.36 3hpt s SER 172 N -6.30 6.56 0.43 4.97 0.15 -1.04 -4.78 113.70 113.69 3hpt s SER 172 Ca 0.01 0.66 0.24 0.00 0.70 0.00 0.00 55.95 57.56 3hpt s SER 172 Cb 0.10 -2.14 0.76 0.00 -1.71 0.00 0.00 66.02 63.04 3hpt s SER 172 CO 0.67 0.35 1.76 0.28 1.20 0.00 0.00 173.24 177.49 3hpt h SER 173 N 4.66 0.00 -2.19 5.45 0.02 -1.90 -3.46 113.55 116.13 3hpt h SER 173 Ca -0.53 0.00 -0.59 0.00 -0.84 0.00 0.00 61.79 59.83 3hpt h SER 173 Cb 1.22 0.00 -0.12 0.00 0.14 0.00 0.00 62.40 63.63 3hpt h SER 173 CO 0.61 0.20 -0.72 -0.36 -1.14 0.00 0.00 176.83 175.43 3hpt s PHE 174 N -3.48 2.43 0.09 3.45 0.08 -1.26 -5.09 117.98 114.21 3hpt s PHE 174 Ca 0.02 -0.30 -0.33 0.00 0.12 0.00 0.00 56.93 56.43 3hpt s PHE 174 Cb 0.09 -1.08 -0.12 0.00 -0.57 0.00 0.00 43.02 41.33 3hpt s PHE 174 CO 0.65 0.68 1.72 -0.89 -0.10 0.00 0.00 175.22 177.27 3hpt n ILE 175 N -0.72 0.23 -3.34 0.64 2.08 -1.26 -4.98 119.36 112.00 3hpt n ILE 175 Ca -0.05 -0.04 -0.45 0.00 0.56 0.00 0.00 62.75 62.76 3hpt n ILE 175 Cb 0.60 -1.78 -0.06 0.00 -0.75 0.00 0.00 39.64 37.64 3hpt n ILE 175 CO 0.00 0.00 0.00 -0.63 0.56 0.00 0.00 176.55 176.48 3hpt s ILE 176 N 2.12 5.21 1.00 1.39 -1.09 -1.26 -5.04 121.20 123.52 3hpt s ILE 176 Ca 0.83 -1.24 -0.13 0.00 -2.23 0.00 0.00 60.65 57.88 3hpt s ILE 176 Cb -0.63 -4.23 0.19 0.00 -1.58 0.00 0.00 42.46 36.21 3hpt s ILE 176 CO 0.41 -0.72 1.11 0.42 -1.23 0.00 0.00 174.94 174.92 3hpt s THR 177 N 1.67 1.98 -1.48 2.92 -4.23 -1.26 -4.92 115.64 110.31 3hpt s THR 177 Ca 0.04 0.00 0.13 0.00 -1.18 0.00 0.00 61.69 60.68 3hpt s THR 177 Cb -0.27 -2.56 0.24 0.00 1.34 0.00 0.00 72.50 71.25 3hpt s THR 177 CO 0.05 0.00 1.31 0.00 -0.54 0.00 0.00 174.62 175.44 3hpt n GLN 178 N -4.14 0.20 -0.76 3.99 10.64 -1.26 -2.36 117.38 123.70 3hpt n GLN 178 Ca 0.06 0.15 0.08 0.00 -1.83 0.00 0.00 57.00 55.46 3hpt n GLN 178 Cb 0.58 -1.50 0.38 0.00 -0.86 0.00 0.00 30.24 28.84 3hpt n GLN 178 CO 0.00 0.00 0.00 0.09 -1.83 0.00 0.00 177.06 175.32 3hpt n ASN 179 N -1.26 5.25 -4.07 2.61 3.02 -1.26 -4.91 115.26 114.65 3hpt n ASN 179 Ca 0.06 -2.75 -0.12 0.00 -0.03 0.00 0.00 54.58 51.74 3hpt n ASN 179 Cb 0.10 -0.63 -0.11 0.00 -0.61 0.00 0.00 39.78 38.52 3hpt n ASN 179 CO 0.00 0.00 0.00 -0.04 -2.62 0.00 0.00 177.26 174.60 3hpt s MET 180 N -2.42 0.54 0.09 3.52 -1.94 -0.99 -0.59 119.30 117.51 3hpt s MET 180 Ca 0.52 -0.83 -0.00 0.00 -1.71 0.00 0.00 55.69 53.68 3hpt s MET 180 Cb 0.38 -0.21 -0.04 0.00 2.01 0.00 0.00 34.83 36.96 3hpt s MET 180 CO 0.19 0.02 -0.02 -0.59 -0.01 0.00 0.00 175.02 174.61 3hpt s PHE 181 N -1.75 0.73 -0.03 -0.03 -0.12 -0.46 -4.77 117.98 111.56 3hpt s PHE 181 Ca -0.08 -1.05 -0.05 0.00 -0.05 0.00 0.00 56.93 55.70 3hpt s PHE 181 Cb -0.08 -0.46 -0.04 0.00 -0.63 0.00 0.00 43.02 41.81 3hpt s PHE 181 CO -0.01 -0.33 0.21 0.00 -0.05 0.00 0.00 175.22 175.05 3hpt s ALA 183 N -1.24 -0.80 0.00 0.00 0.00 -0.74 -1.68 121.76 117.30 3hpt s ALA 183 Ca 0.24 0.67 0.00 0.00 0.00 0.00 0.00 51.96 52.87 3hpt s ALA 183 Cb -0.13 -0.28 0.00 0.00 0.00 0.00 0.00 23.12 22.71 3hpt s ALA 183 CO 0.14 -0.20 0.00 0.41 0.00 0.00 0.00 175.76 176.11 3hpt n GLY 184 N 2.21 0.50 3.28 0.00 0.00 0.95 -1.82 105.19 110.30 3hpt n GLY 184 Ca -0.17 -1.76 -0.24 0.00 0.00 0.00 0.00 46.02 43.85 3hpt n GLY 184 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3hpt s TYR 185 N -2.30 1.78 0.02 1.61 1.51 -1.26 -4.17 117.35 114.55 3hpt s TYR 185 Ca 0.00 -0.41 -0.24 0.00 -1.01 0.00 0.00 57.07 55.41 3hpt s TYR 185 Cb 0.00 -0.99 -0.13 0.00 -0.11 0.00 0.00 41.96 40.73 3hpt s TYR 185 CO 0.00 0.19 1.10 0.22 -1.11 0.00 0.00 175.55 175.95 3hpt h ASP 185 N 4.21 -0.73 0.00 2.29 -0.00 -1.91 -3.43 116.42 116.85 3hpt h ASP 185 Ca -0.46 0.03 0.00 0.00 -0.00 0.00 0.00 57.03 56.60 3hpt h ASP 185 Cb 1.18 0.19 0.00 0.00 -0.00 0.00 0.00 39.33 40.70 3hpt h ASP 185 CO 0.40 -0.41 -0.98 0.35 -0.00 0.00 0.00 179.24 178.60 3hpt n THR 185 N -4.92 0.00 -1.70 2.25 -2.24 -1.26 -1.07 114.28 105.34 3hpt n THR 185 Ca -0.11 0.00 -0.43 0.00 -2.27 0.00 0.00 64.05 61.25 3hpt n THR 185 Cb 0.34 0.14 -0.01 0.00 -2.10 0.00 0.00 70.33 68.70 3hpt n THR 185 CO 0.00 0.00 0.00 1.17 -0.57 0.00 0.00 175.07 175.67 3hpt n LYS 186 N -1.59 2.14 -1.95 -0.78 4.81 -1.26 -4.82 118.16 114.70 3hpt n LYS 186 Ca 0.00 0.75 -0.40 0.00 -0.87 0.00 0.00 58.31 57.79 3hpt n LYS 186 Cb 0.12 -2.35 -0.01 0.00 0.02 0.00 0.00 35.03 32.81 3hpt n LYS 186 CO 0.00 0.00 0.00 1.04 1.17 0.00 0.00 177.40 179.61 3hpt n GLN 187 N 0.77 4.21 -3.77 1.64 1.13 -1.26 -4.75 117.38 115.34 3hpt n GLN 187 Ca 0.06 -3.26 -0.15 0.00 -1.94 0.00 0.00 57.00 51.71 3hpt n GLN 187 Cb 0.36 -2.74 -0.16 0.00 0.11 0.00 0.00 30.24 27.81 3hpt n GLN 187 CO 0.00 0.00 0.00 -1.21 -1.44 0.00 0.00 177.06 174.41 3hpt s GLU 188 N -0.20 -0.02 0.16 -1.09 2.02 -1.26 -4.15 118.70 114.16 3hpt s GLU 188 Ca 0.53 0.21 -0.25 0.00 0.02 0.00 0.00 54.97 55.48 3hpt s GLU 188 Cb 0.16 -0.24 0.06 0.00 0.10 0.00 0.00 34.13 34.22 3hpt s GLU 188 CO -0.07 -0.17 0.90 0.34 0.02 0.00 0.00 175.26 176.29 3hpt s ASP 189 N 1.07 -0.22 0.85 -0.19 3.68 -0.72 -4.37 116.67 116.77 3hpt s ASP 189 Ca -0.09 -0.39 -0.12 0.00 2.13 0.00 0.00 52.55 54.08 3hpt s ASP 189 Cb -0.13 0.52 0.10 0.00 -1.45 0.00 0.00 42.92 41.97 3hpt s ASP 189 CO -0.03 -0.95 1.15 0.00 0.13 0.00 0.00 175.17 175.47 3hpt s ALA 190 N -3.39 2.26 0.00 3.66 0.00 -1.26 -0.03 121.76 123.00 3hpt s ALA 190 Ca 0.11 -0.55 -0.00 0.00 0.00 0.00 0.00 51.96 51.52 3hpt s ALA 190 Cb -0.02 -3.00 0.00 0.00 0.00 0.00 0.00 23.12 20.09 3hpt s ALA 190 CO 0.02 -1.91 0.01 0.00 0.00 0.00 0.00 175.76 173.87 3hpt s GLN 192 N -2.01 4.15 0.00 0.00 -0.21 -1.26 -2.12 119.66 118.21 3hpt s GLN 192 Ca 0.00 2.53 0.00 0.00 0.02 0.00 0.00 55.36 57.91 3hpt s GLN 192 Cb -0.00 -3.10 0.00 0.00 1.00 0.00 0.00 33.01 30.91 3hpt s GLN 192 CO 0.00 -0.71 0.00 0.41 -2.12 0.00 0.00 175.29 172.88 3hpt n GLY 193 N 3.90 3.04 0.16 3.09 0.00 -1.26 -1.20 105.19 112.92 3hpt n GLY 193 Ca 0.15 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.28 3hpt n GLY 193 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3hpt h ASP 194 N 0.07 0.00 -1.62 1.61 3.45 -1.74 -3.31 116.42 114.87 3hpt h ASP 194 Ca 0.00 0.00 -0.68 0.00 0.43 0.00 0.00 57.03 56.78 3hpt h ASP 194 Cb 0.00 0.00 0.08 0.00 -0.56 0.00 0.00 39.33 38.85 3hpt h ASP 194 CO 0.00 0.05 0.07 -1.20 -1.57 0.00 0.00 179.24 176.59 3hpt n SER 195 N -2.89 0.60 0.00 6.45 7.64 -1.26 -1.10 113.62 123.07 3hpt n SER 195 Ca 0.01 1.15 0.00 0.00 1.01 0.00 0.00 58.87 61.04 3hpt n SER 195 Cb 0.56 -1.12 0.00 0.00 -1.01 0.00 0.00 64.21 62.65 3hpt n SER 195 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3hpt n GLY 196 N 1.87 3.27 3.75 0.23 0.00 0.56 0.54 105.19 115.41 3hpt n GLY 196 Ca 0.16 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.89 3hpt n GLY 196 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3hpt s GLY 197 N -2.28 1.64 0.31 -0.02 0.00 -0.26 -3.40 107.32 103.31 3hpt s GLY 197 Ca 0.00 -0.91 -0.28 0.00 0.00 0.00 0.00 44.72 43.53 3hpt s GLY 197 CO 0.00 -0.15 1.06 -4.14 0.00 0.00 0.00 173.10 169.87 3hpt s PRO 198 N -5.52 4.55 -0.18 2.90 0.02 -1.26 -1.95 135.00 133.55 3hpt s PRO 198 Ca 0.70 1.68 0.01 0.00 0.02 0.00 0.00 61.00 63.40 3hpt s PRO 198 Cb -0.09 -3.03 0.03 0.00 0.02 0.00 0.00 34.50 31.43 3hpt s PRO 198 CO 0.54 0.17 -0.14 -1.58 -0.33 0.00 0.00 177.00 175.66 3hpt s HIS 199 N -1.30 2.44 0.14 6.54 2.46 -0.57 -2.89 115.29 122.11 3hpt s HIS 199 Ca 0.47 -1.51 0.10 0.00 0.47 0.00 0.00 55.06 54.60 3hpt s HIS 199 Cb -0.28 -1.69 -0.04 0.00 -0.13 0.00 0.00 32.58 30.43 3hpt s HIS 199 CO 0.36 -0.74 -0.23 0.14 -2.47 0.00 0.00 174.74 171.80 3hpt s VAL 200 N 1.39 2.02 -0.10 0.89 -7.23 0.08 -0.65 120.40 116.81 3hpt s VAL 200 Ca 0.02 -1.77 0.03 0.00 -1.81 0.00 0.00 61.98 58.45 3hpt s VAL 200 Cb -0.15 -1.85 0.01 0.00 0.56 0.00 0.00 36.38 34.95 3hpt s VAL 200 CO -0.10 -0.07 -0.18 -0.89 -0.31 0.00 0.00 175.10 173.55 3hpt s THR 201 N -1.37 1.67 0.02 5.32 2.01 0.22 0.02 115.64 123.53 3hpt s THR 201 Ca 0.13 -0.77 -0.28 0.00 0.31 0.00 0.00 61.69 61.08 3hpt s THR 201 Cb -0.09 -1.49 -0.04 0.00 0.01 0.00 0.00 72.50 70.89 3hpt s THR 201 CO 0.06 0.47 0.88 -0.60 -0.69 0.00 0.00 174.62 174.75 3hpt s ARG 202 N 0.72 4.55 -0.07 4.92 3.52 -1.26 -1.36 118.95 129.97 3hpt s ARG 202 Ca -0.12 1.25 -0.01 0.00 -0.13 0.00 0.00 55.73 56.72 3hpt s ARG 202 Cb -0.16 -3.42 0.03 0.00 -1.56 0.00 0.00 34.95 29.83 3hpt s ARG 202 CO 0.02 0.09 0.01 0.12 -0.81 0.00 0.00 175.30 174.73 3hpt s PHE 203 N 0.57 0.61 -0.99 5.12 5.36 0.33 -4.92 117.98 124.07 3hpt s PHE 203 Ca 0.46 -0.13 -0.14 0.00 -0.96 0.00 0.00 56.93 56.16 3hpt s PHE 203 Cb -0.21 -0.77 0.01 0.00 -0.34 0.00 0.00 43.02 41.72 3hpt s PHE 203 CO 0.25 -0.31 0.67 1.63 -1.46 0.00 0.00 175.22 176.00 3hpt n LYS 204 N 5.15 -1.07 -1.62 10.12 5.02 -1.26 -2.30 118.16 132.20 3hpt n LYS 204 Ca -0.07 0.57 -0.21 0.00 -2.02 0.00 0.00 58.31 56.58 3hpt n LYS 204 Cb 0.50 -2.96 -0.09 0.00 -0.02 0.00 0.00 35.03 32.46 3hpt n LYS 204 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 3hpt n ASP 205 N -2.41 -5.50 -3.94 4.39 8.00 -1.26 -4.97 116.55 110.86 3hpt n ASP 205 Ca -0.19 0.51 -0.20 0.00 0.71 0.00 0.00 54.79 55.62 3hpt n ASP 205 Cb 0.62 -4.85 -0.16 0.00 -0.02 0.00 0.00 41.12 36.71 3hpt n ASP 205 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 3hpt s THR 206 N -2.77 0.61 -0.19 -3.53 2.01 -0.97 -5.13 115.64 105.66 3hpt s THR 206 Ca 0.00 -0.22 -0.09 0.00 0.31 0.00 0.00 61.69 61.70 3hpt s THR 206 Cb 0.00 -0.59 -0.04 0.00 0.01 0.00 0.00 72.50 71.88 3hpt s THR 206 CO 0.00 0.22 0.09 -0.31 -0.69 0.00 0.00 174.62 173.93 3hpt s TYR 207 N 0.54 3.32 -0.02 4.92 1.51 -1.26 -0.51 117.35 125.85 3hpt s TYR 207 Ca -0.08 0.19 0.07 0.00 -1.01 0.00 0.00 57.07 56.24 3hpt s TYR 207 Cb -0.11 -2.12 -0.02 0.00 -0.11 0.00 0.00 41.96 39.60 3hpt s TYR 207 CO 0.00 0.21 -0.23 -0.06 -1.11 0.00 0.00 175.55 174.37 3hpt s PHE 208 N 0.37 2.42 -0.02 2.71 0.08 -0.46 -1.99 117.98 121.09 3hpt s PHE 208 Ca 0.05 -0.37 -0.30 0.00 0.12 0.00 0.00 56.93 56.43 3hpt s PHE 208 Cb -0.12 -1.52 -0.06 0.00 -0.57 0.00 0.00 43.02 40.75 3hpt s PHE 208 CO -0.01 0.03 1.51 0.08 -0.10 0.00 0.00 175.22 176.72 3hpt s VAL 209 N -0.65 3.60 0.00 -0.44 1.01 0.57 -0.61 120.40 123.88 3hpt s VAL 209 Ca 0.11 0.91 0.00 0.00 0.00 0.00 0.00 61.98 63.00 3hpt s VAL 209 Cb -0.10 -3.59 0.00 0.00 0.00 0.00 0.00 36.38 32.69 3hpt s VAL 209 CO -0.00 -0.03 0.00 0.35 0.00 0.00 0.00 175.10 175.42 3hpt n THR 210 N 4.96 0.00 -3.80 3.92 -2.24 0.18 -4.51 114.28 112.78 3hpt n THR 210 Ca 0.15 -0.04 -0.09 0.00 -2.27 0.00 0.00 64.05 61.80 3hpt n THR 210 Cb 0.43 0.50 -0.03 0.00 -2.10 0.00 0.00 70.33 69.12 3hpt n THR 210 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 3hpt s GLY 211 N -1.70 -0.02 -0.06 3.38 0.00 -0.57 -2.52 107.32 105.84 3hpt s GLY 211 Ca 0.00 -0.32 0.05 0.00 0.00 0.00 0.00 44.72 44.45 3hpt s GLY 211 CO 0.00 -0.24 -0.20 -0.42 0.00 0.00 0.00 173.10 172.24 3hpt s ILE 212 N -3.91 1.71 -0.01 0.90 1.01 -1.00 -1.51 121.20 118.39 3hpt s ILE 212 Ca 0.12 -0.86 -0.30 0.00 0.00 0.00 0.00 60.65 59.61 3hpt s ILE 212 Cb -0.03 -1.47 -0.07 0.00 0.01 0.00 0.00 42.46 40.90 3hpt s ILE 212 CO 0.02 0.48 1.88 -0.69 0.00 0.00 0.00 174.94 176.63 3hpt s VAL 213 N 0.08 3.20 -0.00 2.92 1.01 -0.82 -0.75 120.40 126.03 3hpt s VAL 213 Ca -0.07 0.24 -0.02 0.00 0.00 0.00 0.00 61.98 62.14 3hpt s VAL 213 Cb -0.14 -3.17 -0.01 0.00 0.00 0.00 0.00 36.38 33.07 3hpt s VAL 213 CO 0.04 -0.03 -0.03 -0.24 0.00 0.00 0.00 175.10 174.84 3hpt n SER 214 N 7.71 0.35 -3.62 3.32 2.88 -0.78 -0.32 113.62 123.16 3hpt n SER 214 Ca 0.20 0.05 -0.08 0.00 -1.33 0.00 0.00 58.87 57.71 3hpt n SER 214 Cb 0.42 -0.26 -0.01 0.00 -0.75 0.00 0.00 64.21 63.61 3hpt n SER 214 CO 0.00 0.00 0.00 -1.66 -1.23 0.00 0.00 175.04 172.15 3hpt s TRP 215 N -1.33 -0.00 -0.23 0.66 1.48 -0.84 -4.87 118.94 113.81 3hpt s TRP 215 Ca -0.03 -0.49 -0.34 0.00 -1.06 0.00 0.00 56.10 54.18 3hpt s TRP 215 Cb 0.00 0.65 0.15 0.00 -1.16 0.00 0.00 33.47 33.12 3hpt s TRP 215 CO 0.04 -1.29 1.26 0.20 -4.06 0.00 0.00 176.95 173.10 3hpt s GLY 216 N -2.98 -0.19 -0.60 3.67 0.00 -1.26 -0.47 107.32 105.49 3hpt s GLY 216 Ca 0.14 1.95 -0.21 0.00 0.00 0.00 0.00 44.72 46.61 3hpt s GLY 216 CO 0.09 0.71 0.81 -0.54 0.00 0.00 0.00 173.10 174.17 3hpt s GLU 217 N -1.96 3.11 2.05 2.90 2.02 -1.26 -4.95 118.70 120.61 3hpt s GLU 217 Ca 0.09 -0.95 0.00 0.00 0.02 0.00 0.00 54.97 54.13 3hpt s GLU 217 Cb -0.01 -4.20 0.00 0.00 0.10 0.00 0.00 34.13 30.02 3hpt s GLU 217 CO -0.04 -1.59 0.00 0.41 0.02 0.00 0.00 175.26 174.06 3hpt n GLY 218 N 5.26 -0.27 2.84 -1.39 0.00 -1.26 -4.58 105.19 105.79 3hpt n GLY 218 Ca -0.06 -1.34 -0.14 0.00 0.00 0.00 0.00 46.02 44.48 3hpt n GLY 218 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hpt n ALA 221 N 3.76 -0.55 -1.75 0.00 0.00 -1.26 -4.33 120.51 116.38 3hpt n ALA 221 Ca -0.22 0.20 -0.38 0.00 0.00 0.00 0.00 53.44 53.04 3hpt n ALA 221 Cb 0.54 -2.05 0.05 0.00 0.00 0.00 0.00 19.45 17.99 3hpt n ALA 221 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 3hpt s ARG 222 N -4.67 3.07 0.18 0.00 1.81 -1.26 -4.73 118.95 113.36 3hpt s ARG 222 Ca 0.00 2.25 -0.30 0.00 -1.72 0.00 0.00 55.73 55.96 3hpt s ARG 222 Cb 0.00 -2.23 -0.08 0.00 -0.45 0.00 0.00 34.95 32.19 3hpt s ARG 222 CO 0.00 -1.25 1.28 0.15 -0.68 0.00 0.00 175.30 174.81 3hpt s LYS 223 N -2.94 4.41 0.00 3.54 1.02 -1.26 -2.76 119.74 121.74 3hpt s LYS 223 Ca 0.73 2.00 0.00 0.00 0.02 0.00 0.00 55.97 58.71 3hpt s LYS 223 Cb -0.41 -3.22 0.00 0.00 -0.52 0.00 0.00 37.83 33.68 3hpt s LYS 223 CO 0.48 -0.23 0.00 0.41 -0.92 0.00 0.00 175.35 175.09 3hpt n GLY 223 N 2.47 0.93 3.36 -3.33 0.00 -0.23 -5.01 105.19 103.38 3hpt n GLY 223 Ca 0.06 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.84 3hpt n GLY 223 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3hpt s LYS 224 N -0.05 1.35 0.41 1.61 -0.14 -1.11 -4.78 119.74 117.02 3hpt s LYS 224 Ca 0.00 -1.41 0.05 0.00 -1.36 0.00 0.00 55.97 53.25 3hpt s LYS 224 Cb 0.00 -1.58 -0.06 0.00 -1.68 0.00 0.00 37.83 34.52 3hpt s LYS 224 CO 0.00 0.34 0.03 0.71 -0.76 0.00 0.00 175.35 175.67 3hpt s TYR 225 N -1.69 2.15 0.14 3.18 2.02 -1.26 -4.65 117.35 117.25 3hpt s TYR 225 Ca 0.16 -0.87 -0.23 0.00 -0.37 0.00 0.00 57.07 55.75 3hpt s TYR 225 Cb -0.08 -1.55 -0.08 0.00 -0.40 0.00 0.00 41.96 39.86 3hpt s TYR 225 CO 0.07 0.21 0.71 0.20 -1.57 0.00 0.00 175.55 175.18 3hpt s GLY 226 N -3.68 2.84 -0.17 0.71 0.00 -0.76 -4.54 107.32 101.73 3hpt s GLY 226 Ca 0.28 0.26 -0.06 0.00 0.00 0.00 0.00 44.72 45.20 3hpt s GLY 226 CO 0.14 0.74 0.01 -0.42 0.00 0.00 0.00 173.10 173.57 3hpt s ILE 227 N -1.15 4.34 0.03 0.90 -1.09 0.38 -1.79 121.20 122.82 3hpt s ILE 227 Ca 0.34 -0.20 0.09 0.00 -2.23 0.00 0.00 60.65 58.65 3hpt s ILE 227 Cb -0.22 -2.93 -0.03 0.00 -1.58 0.00 0.00 42.46 37.70 3hpt s ILE 227 CO 0.24 0.48 -0.25 -0.31 -1.23 0.00 0.00 174.94 173.87 3hpt s TYR 228 N 0.36 2.19 0.12 3.97 1.51 -0.39 -1.86 117.35 123.25 3hpt s TYR 228 Ca -0.01 -0.41 -0.31 0.00 -1.01 0.00 0.00 57.07 55.34 3hpt s TYR 228 Cb -0.13 -1.33 -0.08 0.00 -0.11 0.00 0.00 41.96 40.30 3hpt s TYR 228 CO 0.02 0.08 1.47 0.99 -1.11 0.00 0.00 175.55 177.00 3hpt s THR 229 N -0.75 3.08 -0.63 -0.71 2.01 0.07 -1.36 115.64 117.35 3hpt s THR 229 Ca 0.10 0.75 -0.28 0.00 0.31 0.00 0.00 61.69 62.58 3hpt s THR 229 Cb -0.10 -3.48 0.03 0.00 0.01 0.00 0.00 72.50 68.96 3hpt s THR 229 CO 0.01 0.05 1.22 -0.75 -0.69 0.00 0.00 174.62 174.46 3hpt s LYS 230 N 1.31 3.41 0.35 4.92 2.20 0.24 -2.37 119.74 129.79 3hpt s LYS 230 Ca 0.67 0.08 0.06 0.00 -0.36 0.00 0.00 55.97 56.43 3hpt s LYS 230 Cb -0.39 -4.07 0.64 0.00 -1.51 0.00 0.00 37.83 32.50 3hpt s LYS 230 CO 0.30 -1.83 1.85 0.28 -0.36 0.00 0.00 175.35 175.60 3hpt h VAL 231 N 6.11 1.21 -0.83 4.02 2.07 -1.81 -2.79 116.25 124.23 3hpt h VAL 231 Ca -0.26 -0.91 0.14 0.00 0.82 0.00 0.00 66.70 66.48 3hpt h VAL 231 Cb 1.05 1.17 -0.06 0.00 -1.52 0.00 0.00 31.29 31.93 3hpt h VAL 231 CO 1.22 0.29 0.54 0.71 0.02 0.00 0.00 177.57 180.35 3hpt h THR 232 N 0.35 0.84 0.00 2.57 1.35 -1.89 0.14 112.91 116.27 3hpt h THR 232 Ca 0.07 -0.21 -0.00 0.00 -0.55 0.00 0.00 66.41 65.71 3hpt h THR 232 Cb 0.44 0.17 -0.00 0.00 -1.73 0.00 0.00 68.15 67.03 3hpt h THR 232 CO 0.02 0.11 -0.02 0.00 -0.25 0.00 0.00 175.52 175.39 3hpt h ALA 233 N 1.61 1.13 -0.03 6.62 0.00 -1.86 -3.24 119.26 123.49 3hpt h ALA 233 Ca 0.41 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.30 3hpt h ALA 233 Cb 0.71 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.49 3hpt h ALA 233 CO -0.17 0.03 0.00 1.19 0.00 0.00 0.00 179.25 180.30 3hpt n PHE 234 N -3.30 0.04 -0.31 0.00 3.72 0.41 -4.68 117.46 113.33 3hpt n PHE 234 Ca -0.02 -0.30 -0.00 0.00 -0.05 0.00 0.00 57.45 57.08 3hpt n PHE 234 Cb 0.14 -0.03 0.13 0.00 -0.94 0.00 0.00 39.48 38.78 3hpt n PHE 234 CO 0.00 0.00 0.00 -0.07 -0.05 0.00 0.00 176.76 176.64 3hpt h LEU 235 N 0.29 0.87 -0.47 4.37 3.38 -1.39 0.13 115.31 122.49 3hpt h LEU 235 Ca 0.00 0.01 -0.10 0.00 0.09 0.00 0.00 57.88 57.88 3hpt h LEU 235 Cb 0.34 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.90 3hpt h LEU 235 CO 0.00 0.58 -0.09 0.50 0.09 0.00 0.00 178.44 179.51 3hpt h LYS 236 N 1.01 0.89 -0.56 1.13 3.64 -1.85 -0.76 116.57 120.08 3hpt h LYS 236 Ca 0.36 -0.33 -0.10 0.00 -1.27 0.00 0.00 60.65 59.31 3hpt h LYS 236 Cb 0.10 -0.06 -0.02 0.00 -0.41 0.00 0.00 32.23 31.84 3hpt h LYS 236 CO -0.15 0.98 -0.04 2.35 -2.27 0.00 0.00 179.45 180.32 3hpt h TRP 237 N 0.74 1.08 -0.28 1.91 7.01 -1.77 -2.20 115.95 122.44 3hpt h TRP 237 Ca 0.12 -0.19 -0.02 0.00 2.11 0.00 0.00 58.89 60.91 3hpt h TRP 237 Cb 0.64 -0.28 -0.01 0.00 -2.10 0.00 0.00 29.16 27.40 3hpt h TRP 237 CO 0.05 0.98 0.09 0.82 -2.79 0.00 0.00 178.44 177.58 3hpt h ILE 238 N 0.90 1.20 -0.42 2.65 2.04 -0.53 -1.55 117.51 121.80 3hpt h ILE 238 Ca 0.16 -0.64 0.06 0.00 1.00 0.00 0.00 64.86 65.45 3hpt h ILE 238 Cb 0.58 1.10 -0.06 0.00 -0.74 0.00 0.00 36.82 37.70 3hpt h ILE 238 CO 0.03 0.21 0.09 0.44 0.00 0.00 0.00 178.15 178.92 3hpt h ASP 239 N 0.28 0.02 -0.79 1.72 3.32 -1.07 -0.99 116.42 118.92 3hpt h ASP 239 Ca 0.09 0.07 0.01 0.00 0.02 0.00 0.00 57.03 57.22 3hpt h ASP 239 Cb 0.24 0.09 -0.04 0.00 0.22 0.00 0.00 39.33 39.84 3hpt h ASP 239 CO -0.00 0.05 0.52 0.03 -1.72 0.00 0.00 179.24 178.11 3hpt h ARG 240 N 0.22 1.02 -0.20 3.56 3.08 -1.31 0.13 114.38 120.88 3hpt h ARG 240 Ca 0.20 -0.06 -0.08 0.00 0.07 0.00 0.00 59.98 60.11 3hpt h ARG 240 Cb 0.25 -0.23 -0.01 0.00 0.08 0.00 0.00 29.97 30.05 3hpt h ARG 240 CO -0.26 0.68 -0.24 0.77 -1.07 0.00 0.00 179.97 179.85 3hpt h SER 241 N 1.05 0.37 1.17 7.04 0.02 -0.86 -2.98 113.55 119.36 3hpt h SER 241 Ca 0.29 -0.11 0.00 0.00 -0.84 0.00 0.00 61.79 61.13 3hpt h SER 241 Cb -0.10 -0.10 0.00 0.00 0.14 0.00 0.00 62.40 62.34 3hpt h SER 241 CO -0.07 0.61 -0.52 0.24 -1.14 0.00 0.00 176.83 175.96 3hpt h MET 242 N 0.33 0.00 -0.25 3.45 2.86 -0.82 -3.29 114.93 117.21 3hpt h MET 242 Ca 0.05 0.00 -0.17 0.00 -2.06 0.00 0.00 59.70 57.53 3hpt h MET 242 Cb 0.61 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.26 3hpt h MET 242 CO 0.04 0.00 -0.51 -0.22 1.06 0.00 0.00 176.91 177.28 3hpt h LYS 243 N 0.00 0.70 -0.92 1.72 1.63 -0.82 -3.17 116.57 115.72 3hpt h LYS 243 Ca 0.00 -0.42 0.27 0.00 -0.85 0.00 0.00 60.65 59.65 3hpt h LYS 243 Cb 0.84 0.04 -0.17 0.00 -0.60 0.00 0.00 32.23 32.34 3hpt h LYS 243 CO 0.00 1.05 0.09 2.41 -3.45 0.00 0.00 179.45 179.54 3hpt n THR 244 N -3.99 -0.39 -4.49 1.00 -1.04 -1.22 -4.89 114.28 99.26 3hpt n THR 244 Ca -0.03 2.01 0.00 0.00 -2.04 0.00 0.00 64.05 63.98 3hpt n THR 244 Cb 0.60 -2.98 0.00 0.00 -1.82 0.00 0.00 70.33 66.13 3hpt n THR 244 CO 0.00 0.00 0.00 0.54 -0.64 0.00 0.00 175.07 174.97 3hpt n ARG 245 N -5.32 0.00 -0.93 -2.82 1.74 -1.20 -4.85 116.66 103.28 3hpt n ARG 245 Ca 0.24 0.00 -0.30 0.00 -0.77 0.00 0.00 57.85 57.02 3hpt n ARG 245 Cb 0.78 0.00 0.24 0.00 -1.02 0.00 0.00 32.46 32.46 3hpt n ARG 245 CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 3hpt s GLY 246 N -2.75 1.55 0.37 -0.13 0.00 -1.26 -4.98 107.32 100.11 3hpt s GLY 246 Ca 0.00 -0.74 -0.28 0.00 0.00 0.00 0.00 44.72 43.70 3hpt s GLY 246 CO 0.00 0.10 1.43 1.08 0.00 0.00 0.00 173.10 175.71 3hpt s LEU 247 N -7.03 4.32 0.00 0.66 1.02 -1.26 -5.22 118.68 111.18 3hpt s LEU 247 Ca 0.69 2.94 0.13 0.00 0.02 0.00 0.00 54.13 57.91 3hpt s LEU 247 Cb -0.14 -3.70 0.77 0.00 0.02 0.00 0.00 46.19 43.15 3hpt s LEU 247 CO 0.57 -0.82 1.20 -0.81 0.02 0.00 0.00 176.35 176.52