#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1h2h s VAL 3 N 0.00 0.79 -0.21 12.58 -7.23 -0.86 -1.40 120.40 124.07 1h2h s VAL 3 Ca 0.00 -1.98 0.02 0.00 -1.81 0.00 0.00 61.98 58.21 1h2h s VAL 3 Cb 0.00 -1.87 0.04 0.00 0.56 0.00 0.00 36.38 35.10 1h2h s VAL 3 CO 0.00 -0.71 -0.16 -0.22 -0.31 0.00 0.00 175.10 173.71 1h2h s LEU 4 N -3.12 2.65 -0.24 1.32 2.96 -0.39 -0.79 118.68 121.08 1h2h s LEU 4 Ca 0.17 -0.96 -0.08 0.00 -0.22 0.00 0.00 54.13 53.05 1h2h s LEU 4 Cb 0.05 -1.49 -0.04 0.00 0.50 0.00 0.00 46.19 45.21 1h2h s LEU 4 CO -0.01 -0.08 0.09 -0.63 -1.32 0.00 0.00 176.35 174.40 1h2h s ILE 5 N 1.22 4.64 -0.36 6.68 -1.09 0.04 -0.31 121.20 132.02 1h2h s ILE 5 Ca -0.01 -0.07 -0.15 0.00 -2.23 0.00 0.00 60.65 58.20 1h2h s ILE 5 Cb -0.16 -3.15 -0.00 0.00 -1.58 0.00 0.00 42.46 37.56 1h2h s ILE 5 CO -0.10 0.36 0.31 -0.63 -1.23 0.00 0.00 174.94 173.65 1h2h s ILE 6 N 1.30 5.22 0.00 2.92 1.01 0.18 -2.36 121.20 129.46 1h2h s ILE 6 Ca 0.05 -0.24 0.00 0.00 0.00 0.00 0.00 60.65 60.46 1h2h s ILE 6 Cb -0.15 -3.83 0.00 0.00 0.01 0.00 0.00 42.46 38.49 1h2h s ILE 6 CO 0.04 -0.14 0.00 0.61 0.00 0.00 0.00 174.94 175.45 1h2h n GLY 7 N 5.07 0.63 0.00 6.18 0.00 -0.13 -1.31 105.19 115.64 1h2h n GLY 7 Ca -0.11 -2.11 0.00 0.00 0.00 0.00 0.00 46.02 43.80 1h2h n GLY 7 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1h2h n GLY 9 N 0.25 -0.61 0.32 -0.02 0.00 -1.26 -3.98 105.19 99.89 1h2h n GLY 9 Ca 0.00 -2.16 0.14 0.00 0.00 0.00 0.00 46.02 44.00 1h2h n GLY 9 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 1h2h h ASN 10 N 0.00 0.34 -0.08 1.61 2.35 -2.00 -1.34 115.58 116.46 1h2h h ASN 10 Ca 0.00 0.16 -0.22 0.00 -0.55 0.00 0.00 56.30 55.68 1h2h h ASN 10 Cb 0.00 0.14 0.01 0.00 0.05 0.00 0.00 38.32 38.52 1h2h h ASN 10 CO 0.00 -0.01 -0.82 0.40 -1.65 0.00 0.00 177.43 175.35 1h2h h ILE 11 N 0.40 1.30 0.16 2.81 2.04 -1.93 -2.90 117.51 119.39 1h2h h ILE 11 Ca 0.57 -2.06 -0.01 0.00 1.00 0.00 0.00 64.86 64.37 1h2h h ILE 11 Cb 1.10 2.20 0.00 0.00 -0.74 0.00 0.00 36.82 39.39 1h2h h ILE 11 CO -0.54 0.64 -0.08 1.23 0.00 0.00 0.00 178.15 179.40 1h2h h GLY 12 N 0.38 -0.23 1.67 5.37 0.00 -1.41 -0.81 103.07 108.04 1h2h h GLY 12 Ca -0.08 0.08 -0.00 0.00 0.00 0.00 0.00 47.33 47.33 1h2h h GLY 12 CO 0.17 -0.08 0.20 0.50 0.00 0.00 0.00 176.54 177.32 1h2h h LYS 13 N -0.36 0.43 -0.38 4.80 1.57 -1.43 -1.62 116.57 119.58 1h2h h LYS 13 Ca -0.02 -0.03 -0.16 0.00 -1.87 0.00 0.00 60.65 58.57 1h2h h LYS 13 Cb 0.28 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 32.49 1h2h h LYS 13 CO 0.04 0.30 -0.37 -0.22 -0.57 0.00 0.00 179.45 178.62 1h2h h LYS 14 N 0.45 0.93 -0.61 3.15 1.63 -1.28 -2.04 116.57 118.78 1h2h h LYS 14 Ca 0.12 -0.49 -0.06 0.00 -0.85 0.00 0.00 60.65 59.37 1h2h h LYS 14 Cb -0.03 0.02 -0.03 0.00 -0.60 0.00 0.00 32.23 31.59 1h2h h LYS 14 CO -0.02 1.14 0.13 -0.07 -3.45 0.00 0.00 179.45 177.18 1h2h h LEU 15 N 0.74 0.91 -0.73 5.20 3.38 -0.47 -1.72 115.31 122.63 1h2h h LEU 15 Ca 0.06 -0.19 -0.07 0.00 0.09 0.00 0.00 57.88 57.77 1h2h h LEU 15 Cb 0.97 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 41.45 1h2h h LEU 15 CO 0.09 0.90 0.17 0.58 0.09 0.00 0.00 178.44 180.27 1h2h h VAL 16 N 0.92 1.26 0.05 1.22 2.07 -1.12 0.14 116.25 120.79 1h2h h VAL 16 Ca 0.19 -0.98 -0.24 0.00 0.82 0.00 0.00 66.70 66.49 1h2h h VAL 16 Cb 0.35 0.54 0.00 0.00 -1.52 0.00 0.00 31.29 30.67 1h2h h VAL 16 CO 0.00 0.38 -1.06 1.05 0.02 0.00 0.00 177.57 177.96 1h2h h GLU 17 N 1.07 0.36 0.00 1.57 4.11 -1.13 -3.36 114.58 117.21 1h2h h GLU 17 Ca 0.22 -0.46 -0.27 0.00 0.07 0.00 0.00 59.36 58.92 1h2h h GLU 17 Cb 0.38 0.15 -0.05 0.00 0.50 0.00 0.00 28.75 29.73 1h2h h GLU 17 CO 0.00 1.15 -1.78 1.28 0.07 0.00 0.00 179.01 179.73 1h2h n LEU 18 N -3.67 0.68 -4.73 3.06 4.77 -0.67 -4.96 117.00 111.49 1h2h n LEU 18 Ca -0.08 0.32 -0.32 0.00 -0.03 0.00 0.00 56.01 55.91 1h2h n LEU 18 Cb 0.90 0.21 0.12 0.00 -2.33 0.00 0.00 43.42 42.32 1h2h n LEU 18 CO 0.52 0.35 0.71 -0.83 -1.33 0.00 0.00 177.39 176.81 1h2h s GLY 19 N -5.10 1.81 -0.37 -0.72 0.00 0.48 -5.01 107.32 98.42 1h2h s GLY 19 Ca -0.05 0.50 0.00 0.00 0.00 0.00 0.00 44.72 45.17 1h2h s GLY 19 CO 0.83 0.88 0.12 -1.31 0.00 0.00 0.00 173.10 173.62 1h2h s ASN 20 N -2.86 5.00 -0.02 1.64 0.01 -1.26 -4.95 114.94 112.50 1h2h s ASN 20 Ca 0.66 -2.06 0.02 0.00 -0.71 0.00 0.00 52.86 50.76 1h2h s ASN 20 Cb -0.21 -1.73 0.01 0.00 0.41 0.00 0.00 41.25 39.73 1h2h s ASN 20 CO 0.54 -0.45 -0.05 -0.36 -1.51 0.00 0.00 177.10 175.27 1h2h s PHE 21 N 1.03 0.56 0.09 2.20 0.08 -1.26 -5.03 117.98 115.64 1h2h s PHE 21 Ca 0.09 -0.11 -0.17 0.00 0.12 0.00 0.00 56.93 56.85 1h2h s PHE 21 Cb -0.21 -0.42 -0.08 0.00 -0.57 0.00 0.00 43.02 41.73 1h2h s PHE 21 CO -0.06 -0.06 1.47 1.05 -0.10 0.00 0.00 175.22 177.52 1h2h h GLU 22 N 6.41 0.53 -3.81 0.44 4.11 -1.98 -3.45 114.58 116.84 1h2h h GLU 22 Ca -0.32 -0.21 -0.21 0.00 0.07 0.00 0.00 59.36 58.69 1h2h h GLU 22 Cb 1.17 -0.03 -0.26 0.00 0.50 0.00 0.00 28.75 30.14 1h2h h GLU 22 CO 0.49 0.75 -0.71 0.21 0.07 0.00 0.00 179.01 179.82 1h2h s LYS 23 N -4.72 0.10 -0.09 1.06 2.20 -1.26 -5.07 119.74 111.97 1h2h s LYS 23 Ca -0.13 -0.19 -0.00 0.00 -0.36 0.00 0.00 55.97 55.28 1h2h s LYS 23 Cb 0.08 0.04 0.02 0.00 -1.51 0.00 0.00 37.83 36.46 1h2h s LYS 23 CO 0.77 -0.02 -0.05 0.42 -0.36 0.00 0.00 175.35 176.12 1h2h s ILE 24 N -0.47 0.76 -0.11 5.43 1.01 -1.26 -2.02 121.20 124.53 1h2h s ILE 24 Ca -0.05 -0.14 -0.06 0.00 0.00 0.00 0.00 60.65 60.40 1h2h s ILE 24 Cb -0.03 -0.82 -0.04 0.00 0.01 0.00 0.00 42.46 41.58 1h2h s ILE 24 CO -0.00 0.32 0.14 -0.31 0.00 0.00 0.00 174.94 175.08 1h2h s TYR 25 N 1.68 3.57 -0.01 3.97 2.02 0.03 -0.10 117.35 128.51 1h2h s TYR 25 Ca 0.03 0.50 0.01 0.00 -0.37 0.00 0.00 57.07 57.23 1h2h s TYR 25 Cb -0.13 -1.92 0.01 0.00 -0.40 0.00 0.00 41.96 39.52 1h2h s TYR 25 CO -0.06 0.72 -0.01 0.00 -1.57 0.00 0.00 175.55 174.63 1h2h s ALA 26 N -1.05 0.20 -0.08 3.71 0.00 -1.19 -0.78 121.76 122.56 1h2h s ALA 26 Ca 0.16 -0.02 0.01 0.00 0.00 0.00 0.00 51.96 52.11 1h2h s ALA 26 Cb -0.12 -0.11 0.02 0.00 0.00 0.00 0.00 23.12 22.91 1h2h s ALA 26 CO 0.05 0.01 -0.11 -0.47 0.00 0.00 0.00 175.76 175.25 1h2h s TYR 27 N 0.21 1.48 -0.23 0.00 5.04 -1.00 -0.98 117.35 121.87 1h2h s TYR 27 Ca -0.02 -0.62 -0.06 0.00 -2.44 0.00 0.00 57.07 53.93 1h2h s TYR 27 Cb -0.04 -1.14 0.12 0.00 0.35 0.00 0.00 41.96 41.25 1h2h s TYR 27 CO -0.01 -0.37 0.45 0.34 -1.34 0.00 0.00 175.55 174.63 1h2h s ASP 28 N 1.04 -0.34 0.36 4.32 -1.08 -1.26 -0.95 116.67 118.76 1h2h s ASP 28 Ca -0.07 0.85 0.30 0.00 -0.52 0.00 0.00 52.55 53.11 1h2h s ASP 28 Cb -0.15 1.48 1.17 0.00 -1.46 0.00 0.00 42.92 43.96 1h2h s ASP 28 CO -0.01 -0.25 1.14 0.54 0.52 0.00 0.00 175.17 177.11 1h2h n ARG 29 N 5.39 -0.01 0.00 4.34 1.74 -1.26 -4.17 116.66 122.69 1h2h n ARG 29 Ca -0.07 0.86 0.00 0.00 -0.77 0.00 0.00 57.85 57.87 1h2h n ARG 29 Cb 0.50 -1.81 0.00 0.00 -1.02 0.00 0.00 32.46 30.12 1h2h n ARG 29 CO 0.00 0.00 0.00 0.44 -1.52 0.00 0.00 177.63 176.55 1h2h n ILE 30 N -3.80 0.00 -1.98 0.55 -5.35 -1.26 -5.04 119.36 102.48 1h2h n ILE 30 Ca 0.31 0.00 -0.04 0.00 -0.27 0.00 0.00 62.75 62.75 1h2h n ILE 30 Cb 1.30 -0.92 -0.04 0.00 -1.74 0.00 0.00 39.64 38.24 1h2h n ILE 30 CO 0.00 0.00 0.00 -1.20 -1.76 0.00 0.00 176.55 173.59 1h2h n SER 31 N 0.00 -0.52 -4.40 7.28 7.64 -1.26 -5.14 113.62 117.23 1h2h n SER 31 Ca 0.00 -1.50 -0.37 0.00 1.01 0.00 0.00 58.87 58.01 1h2h n SER 31 Cb 0.00 0.16 0.05 0.00 -1.01 0.00 0.00 64.21 63.40 1h2h n SER 31 CO 0.00 0.00 0.00 1.17 -3.01 0.00 0.00 175.04 173.20 1h2h n LYS 32 N 0.00 0.29 -1.68 1.43 4.81 -1.26 -4.72 118.16 117.04 1h2h n LYS 32 Ca -0.15 0.12 -0.51 0.00 -0.87 0.00 0.00 58.31 56.90 1h2h n LYS 32 Cb 0.60 -1.59 -0.06 0.00 0.02 0.00 0.00 35.03 34.00 1h2h n LYS 32 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 1h2h n ASP 33 N 0.69 3.03 -4.78 3.14 8.00 -1.26 -4.93 116.55 120.45 1h2h n ASP 33 Ca 0.09 0.96 -0.38 0.00 0.71 0.00 0.00 54.79 56.16 1h2h n ASP 33 Cb 0.49 -1.29 -0.06 0.00 -0.02 0.00 0.00 41.12 40.24 1h2h n ASP 33 CO 0.00 0.00 0.00 0.27 -0.39 0.00 0.00 177.20 177.08 1h2h s ILE 34 N 4.23 4.94 0.00 0.53 -5.25 -1.26 -5.05 121.20 119.33 1h2h s ILE 34 Ca 0.96 1.14 0.00 0.00 -0.99 0.00 0.00 60.65 61.76 1h2h s ILE 34 Cb -0.82 -3.88 0.00 0.00 2.95 0.00 0.00 42.46 40.71 1h2h s ILE 34 CO 0.56 0.45 0.00 -0.81 -1.79 0.00 0.00 174.94 173.35 1h2h n PRO 35 N 2.56 0.00 -1.00 0.37 -0.04 -1.26 -4.70 135.00 130.92 1h2h n PRO 35 Ca -0.09 0.00 -0.21 0.00 -0.04 0.00 0.00 63.50 63.16 1h2h n PRO 35 Cb 0.51 0.00 0.05 0.00 -0.04 0.00 0.00 33.50 34.02 1h2h n PRO 35 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1h2h n GLY 36 N 3.71 4.55 3.26 0.55 0.00 -1.26 -4.91 105.19 111.09 1h2h n GLY 36 Ca 0.00 -1.40 -0.17 0.00 0.00 0.00 0.00 46.02 44.45 1h2h n GLY 36 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1h2h s VAL 37 N -2.95 1.37 -1.14 1.61 -7.23 -1.26 -4.57 120.40 106.23 1h2h s VAL 37 Ca 0.40 -1.89 -0.09 0.00 -1.81 0.00 0.00 61.98 58.59 1h2h s VAL 37 Cb 0.32 -1.70 0.26 0.00 0.56 0.00 0.00 36.38 35.81 1h2h s VAL 37 CO -0.00 -0.52 1.29 0.52 -0.31 0.00 0.00 175.10 176.08 1h2h n VAL 38 N 0.20 4.65 -1.44 1.32 0.31 0.86 -4.94 118.33 119.29 1h2h n VAL 38 Ca -0.13 -5.31 -0.49 0.00 -0.01 0.00 0.00 64.34 58.40 1h2h n VAL 38 Cb 0.58 -2.46 -0.08 0.00 -0.91 0.00 0.00 33.84 30.97 1h2h n VAL 38 CO 0.00 0.00 0.00 -1.14 -1.32 0.00 0.00 176.83 174.37 1h2h n ARG 39 N 3.04 0.77 -1.79 5.55 3.00 -1.26 -3.19 116.66 122.78 1h2h n ARG 39 Ca 0.28 0.17 -0.30 0.00 -0.00 0.00 0.00 57.85 58.00 1h2h n ARG 39 Cb 0.38 -2.32 0.05 0.00 0.00 0.00 0.00 32.46 30.58 1h2h n ARG 39 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.63 177.12 1h2h s LEU 40 N 8.01 2.91 -0.05 6.15 1.02 -0.16 -4.95 118.68 131.62 1h2h s LEU 40 Ca 1.13 1.25 0.02 0.00 0.02 0.00 0.00 54.13 56.56 1h2h s LEU 40 Cb -0.92 -4.07 -0.04 0.00 0.02 0.00 0.00 46.19 41.19 1h2h s LEU 40 CO 0.48 -1.39 -0.01 0.47 0.02 0.00 0.00 176.35 175.92 1h2h n ASP 41 N -3.06 3.83 -4.34 2.29 9.92 -1.26 -4.76 116.55 119.18 1h2h n ASP 41 Ca 0.07 -0.01 -0.34 0.00 -0.53 0.00 0.00 54.79 53.98 1h2h n ASP 41 Cb 0.56 0.32 -0.14 0.00 -0.64 0.00 0.00 41.12 41.22 1h2h n ASP 41 CO 0.00 0.00 0.00 -1.61 0.13 0.00 0.00 177.20 175.72 1h2h s GLU 42 N -2.10 3.36 0.48 -1.24 0.41 -1.26 -5.06 118.70 113.29 1h2h s GLU 42 Ca -0.04 -0.67 -0.23 0.00 -0.41 0.00 0.00 54.97 53.62 1h2h s GLU 42 Cb 0.01 -2.76 -0.08 0.00 -1.78 0.00 0.00 34.13 29.52 1h2h s GLU 42 CO 0.15 0.05 1.18 0.34 -0.49 0.00 0.00 175.26 176.48 1h2h n PHE 43 N 4.03 1.72 -3.59 1.61 -0.00 -1.26 -4.97 117.46 115.00 1h2h n PHE 43 Ca -0.18 0.49 0.01 0.00 -0.00 0.00 0.00 57.45 57.77 1h2h n PHE 43 Cb 0.52 -2.30 -0.01 0.00 -0.00 0.00 0.00 39.48 37.69 1h2h n PHE 43 CO 0.00 0.00 0.00 1.14 -0.00 0.00 0.00 176.76 177.90 1h2h s GLN 44 N -2.38 0.02 -0.57 -4.13 -2.07 -1.26 -5.11 119.66 104.16 1h2h s GLN 44 Ca 0.66 -0.01 0.01 0.00 -1.82 0.00 0.00 55.36 54.20 1h2h s GLN 44 Cb -0.49 0.01 0.14 0.00 -1.09 0.00 0.00 33.01 31.59 1h2h s GLN 44 CO 0.54 -0.01 0.34 0.08 -1.32 0.00 0.00 175.29 174.93 1h2h s VAL 45 N -2.02 3.12 0.38 3.63 1.01 -1.26 -5.09 120.40 120.17 1h2h s VAL 45 Ca 0.14 -3.13 -0.24 0.00 0.00 0.00 0.00 61.98 58.75 1h2h s VAL 45 Cb 0.04 -3.09 -0.13 0.00 0.00 0.00 0.00 36.38 33.20 1h2h s VAL 45 CO -0.05 -0.83 0.70 -2.65 0.00 0.00 0.00 175.10 172.27 1h2h n PRO 46 N 3.31 0.78 0.32 2.72 -0.02 -1.26 -4.85 135.00 136.01 1h2h n PRO 46 Ca 0.06 0.28 0.21 0.00 -2.02 0.00 0.00 63.50 62.03 1h2h n PRO 46 Cb 0.35 -1.62 1.09 0.00 -0.02 0.00 0.00 33.50 33.31 1h2h n PRO 46 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 1h2h h SER 47 N 1.12 0.00 -0.13 2.55 0.87 -2.04 -2.44 113.55 113.48 1h2h h SER 47 Ca -0.40 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.16 1h2h h SER 47 Cb 1.38 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.34 1h2h h SER 47 CO 0.54 0.01 0.00 -0.90 -0.53 0.00 0.00 176.83 175.95 1h2h n ASP 48 N -3.18 2.14 -4.66 6.23 3.85 -1.26 -4.87 116.55 114.79 1h2h n ASP 48 Ca -0.02 -1.74 -0.43 0.00 -0.71 0.00 0.00 54.79 51.89 1h2h n ASP 48 Cb 0.11 -0.07 -0.02 0.00 -1.35 0.00 0.00 41.12 39.79 1h2h n ASP 48 CO 0.00 0.00 0.00 -0.69 -1.01 0.00 0.00 177.20 175.50 1h2h s VAL 49 N -1.85 4.52 -0.16 2.12 1.01 -0.92 -4.41 120.40 120.70 1h2h s VAL 49 Ca 0.34 1.83 0.22 0.00 0.00 0.00 0.00 61.98 64.38 1h2h s VAL 49 Cb 0.20 -4.18 -0.18 0.00 0.00 0.00 0.00 36.38 32.22 1h2h s VAL 49 CO 0.30 -0.14 0.76 -1.54 0.00 0.00 0.00 175.10 174.48 1h2h n SER 50 N 6.29 0.42 -3.78 3.32 3.41 -0.50 -4.84 113.62 117.94 1h2h n SER 50 Ca 0.12 0.12 -0.13 0.00 -0.26 0.00 0.00 58.87 58.73 1h2h n SER 50 Cb 0.46 1.24 -0.13 0.00 -0.26 0.00 0.00 64.21 65.52 1h2h n SER 50 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 1h2h s THR 51 N -3.43 -0.01 -0.01 6.66 2.01 -1.23 -2.21 115.64 117.41 1h2h s THR 51 Ca -0.04 0.05 0.04 0.00 0.31 0.00 0.00 61.69 62.05 1h2h s THR 51 Cb 0.12 -0.30 -0.03 0.00 0.01 0.00 0.00 72.50 72.30 1h2h s THR 51 CO 0.85 0.02 -0.11 -0.69 -0.69 0.00 0.00 174.62 174.00 1h2h s VAL 52 N 0.46 3.31 -0.11 3.82 1.01 -0.02 -1.26 120.40 127.62 1h2h s VAL 52 Ca -0.03 -0.82 -0.01 0.00 0.00 0.00 0.00 61.98 61.12 1h2h s VAL 52 Cb -0.04 -2.38 0.03 0.00 0.00 0.00 0.00 36.38 33.98 1h2h s VAL 52 CO -0.02 0.46 -0.05 -0.69 0.00 0.00 0.00 175.10 174.79 1h2h s VAL 53 N -0.89 0.84 -0.15 2.92 1.01 0.58 -1.73 120.40 122.99 1h2h s VAL 53 Ca 0.15 -0.21 -0.12 0.00 0.00 0.00 0.00 61.98 61.80 1h2h s VAL 53 Cb -0.11 -0.92 -0.05 0.00 0.00 0.00 0.00 36.38 35.30 1h2h s VAL 53 CO 0.05 0.31 0.24 -0.70 0.00 0.00 0.00 175.10 175.00 1h2h s GLU 54 N 1.78 4.07 -0.41 2.72 -6.30 -0.03 0.48 118.70 121.01 1h2h s GLU 54 Ca 0.05 0.02 0.06 0.00 -2.50 0.00 0.00 54.97 52.60 1h2h s GLU 54 Cb -0.13 -3.36 0.32 0.00 0.00 0.00 0.00 34.13 30.96 1h2h s GLU 54 CO -0.07 0.39 1.22 0.00 0.02 0.00 0.00 175.26 176.82 1h2h n ALA 56 N 0.05 2.93 -3.63 0.00 0.00 -1.19 -4.45 120.51 114.23 1h2h n ALA 56 Ca -0.01 0.00 -0.04 0.00 0.00 0.00 0.00 53.44 53.39 1h2h n ALA 56 Cb 0.75 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 20.18 1h2h n ALA 56 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1h2h s SER 57 N -4.60 -0.21 0.21 0.00 1.04 -1.26 -5.00 113.70 103.89 1h2h s SER 57 Ca 0.00 -0.17 -0.10 0.00 0.48 0.00 0.00 55.95 56.17 1h2h s SER 57 Cb 0.00 0.34 0.18 0.00 0.10 0.00 0.00 66.02 66.64 1h2h s SER 57 CO 0.00 -0.60 1.88 -0.65 0.98 0.00 0.00 173.24 174.85 1h2h h PRO 58 N 2.00 1.00 -0.64 4.02 0.11 -1.98 -1.83 132.00 134.68 1h2h h PRO 58 Ca -0.22 -0.06 0.06 0.00 0.11 0.00 0.00 66.00 65.88 1h2h h PRO 58 Cb 1.22 -0.23 -0.04 0.00 0.11 0.00 0.00 31.00 32.07 1h2h h PRO 58 CO 0.27 0.66 0.42 0.93 -0.21 0.00 0.00 178.00 180.08 1h2h h GLU 59 N 1.03 0.64 -0.45 1.05 3.07 -1.96 -0.97 114.58 116.99 1h2h h GLU 59 Ca 0.29 -0.04 -0.12 0.00 -0.50 0.00 0.00 59.36 58.99 1h2h h GLU 59 Cb -0.09 -0.14 -0.01 0.00 -0.84 0.00 0.00 28.75 27.66 1h2h h GLU 59 CO -0.07 0.42 -0.19 0.00 -1.40 0.00 0.00 179.01 177.78 1h2h h ALA 60 N 1.65 0.63 -0.90 3.43 0.00 -1.74 0.18 119.26 122.51 1h2h h ALA 60 Ca 0.27 -0.37 0.04 0.00 0.00 0.00 0.00 54.91 54.85 1h2h h ALA 60 Cb 0.24 -0.16 -0.05 0.00 0.00 0.00 0.00 17.79 17.82 1h2h h ALA 60 CO -0.08 0.59 0.58 0.28 0.00 0.00 0.00 179.25 180.61 1h2h h VAL 61 N 0.76 1.14 -0.12 0.00 2.07 -0.71 -1.98 116.25 117.40 1h2h h VAL 61 Ca 0.10 -0.38 -0.20 0.00 0.82 0.00 0.00 66.70 67.05 1h2h h VAL 61 Cb 0.75 -0.08 0.00 0.00 -1.52 0.00 0.00 31.29 30.45 1h2h h VAL 61 CO 0.06 0.20 -0.73 0.11 0.02 0.00 0.00 177.57 177.23 1h2h h LYS 62 N 1.12 0.57 -0.36 1.57 1.57 -1.02 -2.06 116.57 117.94 1h2h h LYS 62 Ca 0.36 -0.45 -0.07 0.00 -1.87 0.00 0.00 60.65 58.62 1h2h h LYS 62 Cb 0.02 0.09 -0.01 0.00 0.08 0.00 0.00 32.23 32.41 1h2h h LYS 62 CO -0.13 1.08 -0.05 0.93 -0.57 0.00 0.00 179.45 180.71 1h2h h GLU 63 N 0.39 0.67 0.00 3.15 5.08 -0.53 -3.37 114.58 119.98 1h2h h GLU 63 Ca -0.03 -0.24 0.00 0.00 -1.00 0.00 0.00 59.36 58.08 1h2h h GLU 63 Cb 1.32 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 30.53 1h2h h GLU 63 CO 0.14 0.81 -0.88 0.66 -1.00 0.00 0.00 179.01 178.74 1h2h n TYR 64 N -4.43 0.00 -0.25 4.33 4.01 -0.78 -4.65 117.16 115.38 1h2h n TYR 64 Ca -0.02 0.00 0.04 0.00 -0.16 0.00 0.00 57.90 57.76 1h2h n TYR 64 Cb 0.32 -0.07 0.14 0.00 -0.31 0.00 0.00 39.34 39.42 1h2h n TYR 64 CO 0.00 0.00 0.00 0.77 -0.46 0.00 0.00 176.86 177.17 1h2h h SER 65 N 0.00 -0.39 -0.11 7.72 0.02 -1.53 0.90 113.55 120.17 1h2h h SER 65 Ca 0.00 0.19 0.04 0.00 -0.84 0.00 0.00 61.79 61.18 1h2h h SER 65 Cb 0.40 0.35 -0.04 0.00 0.14 0.00 0.00 62.40 63.25 1h2h h SER 65 CO 0.00 -0.18 -0.14 0.17 -1.14 0.00 0.00 176.83 175.54 1h2h h LEU 66 N 0.09 -0.42 0.02 5.07 8.10 -1.82 -1.91 115.31 124.43 1h2h h LEU 66 Ca 0.39 0.08 -0.00 0.00 0.11 0.00 0.00 57.88 58.46 1h2h h LEU 66 Cb 0.67 0.20 0.00 0.00 -0.44 0.00 0.00 40.66 41.09 1h2h h LEU 66 CO -0.66 -0.18 -0.01 -0.61 -4.11 0.00 0.00 178.44 172.87 1h2h h GLN 67 N -0.18 -0.02 -0.57 0.17 4.15 -1.52 -3.14 115.11 114.01 1h2h h GLN 67 Ca 0.08 0.00 0.12 0.00 0.77 0.00 0.00 58.65 59.62 1h2h h GLN 67 Cb 0.30 0.00 -0.11 0.00 0.21 0.00 0.00 27.48 27.89 1h2h h GLN 67 CO -0.21 0.17 -0.11 0.82 -1.93 0.00 0.00 178.83 177.57 1h2h h ILE 68 N -0.21 0.45 -0.03 2.39 1.08 -0.72 -1.38 117.51 119.10 1h2h h ILE 68 Ca -0.00 -0.01 0.01 0.00 -0.39 0.00 0.00 64.86 64.47 1h2h h ILE 68 Cb 0.20 0.43 -0.00 0.00 -3.07 0.00 0.00 36.82 34.38 1h2h h ILE 68 CO 0.00 0.00 0.07 -0.07 -0.69 0.00 0.00 178.15 177.47 1h2h h LEU 69 N 0.02 0.00 -0.84 1.44 3.38 -1.30 -1.35 115.31 116.67 1h2h h LEU 69 Ca 0.28 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 58.17 1h2h h LEU 69 Cb 0.43 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.16 1h2h h LEU 69 CO -0.56 0.00 0.04 0.11 0.09 0.00 0.00 178.44 178.12 1h2h h LYS 70 N 0.00 0.91 -7.00 1.13 1.79 -1.27 -3.31 116.57 108.83 1h2h h LYS 70 Ca 0.01 -0.24 -0.46 0.00 -2.18 0.00 0.00 60.65 57.78 1h2h h LYS 70 Cb 0.16 -0.11 -0.00 0.00 -1.58 0.00 0.00 32.23 30.70 1h2h h LYS 70 CO -0.00 0.88 0.37 -0.80 -1.08 0.00 0.00 179.45 178.82 1h2h s ASN 71 N -6.59 6.88 -1.40 0.86 0.01 -0.51 -4.60 114.94 109.59 1h2h s ASN 71 Ca -0.10 1.86 -0.10 0.00 -0.71 0.00 0.00 52.86 53.81 1h2h s ASN 71 Cb 0.15 -2.56 0.08 0.00 0.41 0.00 0.00 41.25 39.32 1h2h s ASN 71 CO 0.83 -0.40 2.29 -0.81 -1.51 0.00 0.00 177.10 177.50 1h2h n PRO 72 N -0.28 3.71 -4.45 -0.60 -0.04 -1.26 -3.71 135.00 128.37 1h2h n PRO 72 Ca 0.06 -3.05 -0.22 0.00 -0.04 0.00 0.00 63.50 60.25 1h2h n PRO 72 Cb 0.52 -2.91 -0.10 0.00 -0.04 0.00 0.00 33.50 30.96 1h2h n PRO 72 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 1h2h s VAL 73 N 0.96 1.51 -0.15 0.52 -7.23 -1.26 -4.89 120.40 109.85 1h2h s VAL 73 Ca 0.51 -2.07 -0.25 0.00 -1.81 0.00 0.00 61.98 58.36 1h2h s VAL 73 Cb 0.14 -2.61 -0.02 0.00 0.56 0.00 0.00 36.38 34.45 1h2h s VAL 73 CO -0.05 -0.17 0.83 0.20 -0.31 0.00 0.00 175.10 175.59 1h2h s ASN 74 N -3.48 6.97 -0.37 4.85 0.01 -0.94 -1.96 114.94 120.03 1h2h s ASN 74 Ca 0.32 1.19 -0.04 0.00 -0.71 0.00 0.00 52.86 53.62 1h2h s ASN 74 Cb 0.06 -2.45 0.07 0.00 0.41 0.00 0.00 41.25 39.34 1h2h s ASN 74 CO 0.14 -0.37 0.14 -0.47 -1.51 0.00 0.00 177.10 175.02 1h2h s TYR 75 N 1.99 3.39 -0.30 2.20 5.04 0.22 -0.84 117.35 129.05 1h2h s TYR 75 Ca 0.39 -1.91 -0.17 0.00 -2.44 0.00 0.00 57.07 52.94 1h2h s TYR 75 Cb -0.17 -2.67 -0.02 0.00 0.35 0.00 0.00 41.96 39.45 1h2h s TYR 75 CO 0.13 -0.85 0.45 0.42 -1.34 0.00 0.00 175.55 174.36 1h2h s ILE 76 N 1.27 5.10 -0.08 3.14 1.01 -0.70 -0.47 121.20 130.47 1h2h s ILE 76 Ca 0.01 0.53 0.04 0.00 0.00 0.00 0.00 60.65 61.23 1h2h s ILE 76 Cb -0.21 -3.82 -0.01 0.00 0.01 0.00 0.00 42.46 38.43 1h2h s ILE 76 CO -0.01 0.01 -0.22 -0.63 0.00 0.00 0.00 174.94 174.09 1h2h s ILE 77 N 2.22 2.32 -0.01 2.92 1.01 -0.83 -0.85 121.20 127.99 1h2h s ILE 77 Ca 0.17 -0.95 0.00 0.00 0.00 0.00 0.00 60.65 59.88 1h2h s ILE 77 Cb -0.16 -1.89 -0.01 0.00 0.01 0.00 0.00 42.46 40.42 1h2h s ILE 77 CO 0.11 0.56 0.00 2.30 0.00 0.00 0.00 174.94 177.91 1h2h n ILE 78 N 3.19 0.04 -0.80 2.92 -5.35 -1.24 -4.27 119.36 113.84 1h2h n ILE 78 Ca -0.18 -0.02 -0.15 0.00 -0.27 0.00 0.00 62.75 62.13 1h2h n ILE 78 Cb 0.52 -0.91 -0.09 0.00 -1.74 0.00 0.00 39.64 37.42 1h2h n ILE 78 CO 0.00 0.00 0.00 -1.20 -1.76 0.00 0.00 176.55 173.59 1h2h n SER 79 N -2.10 4.64 0.31 7.28 7.64 -1.26 -4.61 113.62 125.52 1h2h n SER 79 Ca -0.01 -2.28 0.20 0.00 1.01 0.00 0.00 58.87 57.79 1h2h n SER 79 Cb 0.52 -1.11 1.07 0.00 -1.01 0.00 0.00 64.21 63.67 1h2h n SER 79 CO 0.00 0.00 0.00 0.71 -3.01 0.00 0.00 175.04 172.74 1h2h h THR 80 N 2.57 0.00 -0.40 0.44 1.35 -1.85 -2.75 112.91 112.27 1h2h h THR 80 Ca 0.29 0.00 0.12 0.00 -0.55 0.00 0.00 66.41 66.27 1h2h h THR 80 Cb 0.84 0.87 -0.02 0.00 -1.73 0.00 0.00 68.15 68.11 1h2h h THR 80 CO 0.69 0.00 0.58 0.77 -0.25 0.00 0.00 175.52 177.31 1h2h h SER 81 N 0.00 0.00 0.56 5.36 4.64 -1.80 0.49 113.55 122.81 1h2h h SER 81 Ca 0.00 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.31 1h2h h SER 81 Cb 0.10 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.19 1h2h h SER 81 CO 0.00 0.00 -0.07 0.00 -0.87 0.00 0.00 176.83 175.89 1h2h h ALA 82 N 1.22 1.10 0.00 5.18 0.00 -1.80 -2.18 119.26 122.79 1h2h h ALA 82 Ca 0.19 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.04 1h2h h ALA 82 Cb 1.34 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.12 1h2h h ALA 82 CO -0.00 0.08 0.00 1.19 0.00 0.00 0.00 179.25 180.52 1h2h n PHE 83 N -3.32 0.00 0.61 0.00 3.01 0.17 -3.03 117.46 114.90 1h2h n PHE 83 Ca -0.01 0.00 0.08 0.00 1.01 0.00 0.00 57.45 58.53 1h2h n PHE 83 Cb 0.25 -0.23 0.36 0.00 -0.01 0.00 0.00 39.48 39.85 1h2h n PHE 83 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1h2h n ALA 84 N -1.23 1.78 -2.62 4.37 0.00 -0.82 -4.46 120.51 117.53 1h2h n ALA 84 Ca 0.16 -0.06 -0.43 0.00 0.00 0.00 0.00 53.44 53.11 1h2h n ALA 84 Cb 0.21 -1.26 -0.06 0.00 0.00 0.00 0.00 19.45 18.34 1h2h n ALA 84 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1h2h s ASP 85 N -2.90 6.33 0.20 0.00 3.68 -1.17 -4.64 116.67 118.17 1h2h s ASP 85 Ca 0.10 -0.42 -0.16 0.00 2.13 0.00 0.00 52.55 54.20 1h2h s ASP 85 Cb 0.11 -2.36 0.18 0.00 -1.45 0.00 0.00 42.92 39.40 1h2h s ASP 85 CO 0.28 -0.96 1.63 -0.33 0.13 0.00 0.00 175.17 175.93 1h2h h GLU 86 N 9.04 -0.03 -0.37 4.34 5.08 -1.91 -1.34 114.58 129.40 1h2h h GLU 86 Ca -0.26 0.00 0.01 0.00 -1.00 0.00 0.00 59.36 58.12 1h2h h GLU 86 Cb 1.09 0.01 -0.02 0.00 0.50 0.00 0.00 28.75 30.32 1h2h h GLU 86 CO 0.98 -0.02 0.22 0.28 -1.00 0.00 0.00 179.01 179.46 1h2h h VAL 87 N -0.04 1.04 -0.39 3.13 2.07 -1.95 -2.09 116.25 118.03 1h2h h VAL 87 Ca 0.26 -0.15 -0.11 0.00 0.82 0.00 0.00 66.70 67.52 1h2h h VAL 87 Cb 0.44 0.56 -0.02 0.00 -1.52 0.00 0.00 31.29 30.76 1h2h h VAL 87 CO -0.59 0.08 -0.19 0.15 0.02 0.00 0.00 177.57 177.04 1h2h h PHE 88 N 0.44 0.84 -0.55 1.57 3.57 -1.79 -2.63 116.94 118.39 1h2h h PHE 88 Ca 0.14 -0.18 -0.02 0.00 3.53 0.00 0.00 57.97 61.45 1h2h h PHE 88 Cb -0.00 -0.21 -0.03 0.00 2.79 0.00 0.00 35.95 38.51 1h2h h PHE 88 CO -0.07 0.88 0.27 -0.09 -2.23 0.00 0.00 178.31 177.07 1h2h h ARG 89 N 0.66 0.79 -0.10 1.11 2.43 -1.04 -0.22 114.38 118.02 1h2h h ARG 89 Ca 0.10 -0.11 -0.00 0.00 -0.81 0.00 0.00 59.98 59.15 1h2h h ARG 89 Cb 0.68 -0.14 -0.00 0.00 -0.42 0.00 0.00 29.97 30.08 1h2h h ARG 89 CO 0.05 0.65 0.06 1.49 -1.51 0.00 0.00 179.97 180.70 1h2h h GLU 90 N 0.75 0.13 -0.29 0.20 4.22 -1.32 -2.81 114.58 115.46 1h2h h GLU 90 Ca 0.19 -0.01 0.03 0.00 0.08 0.00 0.00 59.36 59.64 1h2h h GLU 90 Cb 0.11 -0.03 -0.03 0.00 0.50 0.00 0.00 28.75 29.30 1h2h h GLU 90 CO -0.03 0.14 0.12 -0.09 -2.18 0.00 0.00 179.01 176.98 1h2h h ARG 91 N 0.08 0.25 0.45 1.92 2.43 -1.21 -2.89 114.38 115.40 1h2h h ARG 91 Ca 0.03 -0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 59.18 1h2h h ARG 91 Cb 0.05 -0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 29.52 1h2h h ARG 91 CO -0.01 0.16 -0.48 0.35 -1.51 0.00 0.00 179.97 178.49 1h2h h PHE 92 N 0.25 -1.33 0.00 2.20 3.57 -0.89 -2.13 116.94 118.62 1h2h h PHE 92 Ca 0.12 0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.64 1h2h h PHE 92 Cb 0.07 0.52 0.00 0.00 2.79 0.00 0.00 35.95 39.33 1h2h h PHE 92 CO -0.12 -0.63 0.00 1.19 -2.23 0.00 0.00 178.31 176.53 1h2h n PHE 93 N -5.31 0.00 0.02 0.41 3.01 -1.07 -1.50 117.46 113.01 1h2h n PHE 93 Ca -0.11 0.00 -0.07 0.00 1.01 0.00 0.00 57.45 58.28 1h2h n PHE 93 Cb 0.43 -0.43 -0.05 0.00 -0.01 0.00 0.00 39.48 39.42 1h2h n PHE 93 CO 0.00 0.00 0.00 0.77 1.01 0.00 0.00 176.76 178.54 1h2h h SER 94 N 0.00 -0.14 -0.42 4.37 0.02 -1.19 -3.04 113.55 113.16 1h2h h SER 94 Ca 0.00 -0.28 0.12 0.00 -0.84 0.00 0.00 61.79 60.79 1h2h h SER 94 Cb 0.14 0.04 -0.02 0.00 0.14 0.00 0.00 62.40 62.70 1h2h h SER 94 CO 0.00 0.45 0.30 -0.33 -1.14 0.00 0.00 176.83 176.11 1h2h h GLU 95 N -0.98 0.03 -0.03 3.45 5.08 -0.71 -2.22 114.58 119.20 1h2h h GLU 95 Ca -0.02 -0.00 -0.14 0.00 -1.00 0.00 0.00 59.36 58.20 1h2h h GLU 95 Cb 0.41 -0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.64 1h2h h GLU 95 CO 0.03 0.02 -0.63 1.25 -1.00 0.00 0.00 179.01 178.68 1h2h h LEU 96 N 0.03 0.14 -1.06 1.33 5.85 -1.27 0.75 115.31 121.06 1h2h h LEU 96 Ca 0.20 -0.08 -0.09 0.00 0.84 0.00 0.00 57.88 58.74 1h2h h LEU 96 Cb 0.76 -0.04 -0.01 0.00 0.37 0.00 0.00 40.66 41.73 1h2h h LEU 96 CO -0.01 0.73 -0.36 0.11 -0.34 0.00 0.00 178.44 178.56 1h2h h LYS 97 N 0.09 0.19 0.00 1.25 1.57 -1.27 -2.49 116.57 115.90 1h2h h LYS 97 Ca -0.01 -0.08 -0.05 0.00 -1.87 0.00 0.00 60.65 58.64 1h2h h LYS 97 Cb 1.12 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 33.42 1h2h h LYS 97 CO 0.09 0.53 -0.96 -0.91 -0.57 0.00 0.00 179.45 177.64 1h2h h ASN 98 N 0.16 0.00 -4.00 0.86 -0.26 -1.56 -3.48 115.58 107.31 1h2h h ASN 98 Ca 0.02 0.00 -0.52 0.00 -0.56 0.00 0.00 56.30 55.24 1h2h h ASN 98 Cb 0.73 0.00 0.08 0.00 -1.06 0.00 0.00 38.32 38.07 1h2h h ASN 98 CO 0.05 0.18 0.53 -0.55 -1.06 0.00 0.00 177.43 176.59 1h2h s SER 99 N -5.64 6.00 0.00 5.81 0.15 0.24 -4.94 113.70 115.33 1h2h s SER 99 Ca 0.00 2.46 0.27 0.00 0.70 0.00 0.00 55.95 59.38 1h2h s SER 99 Cb 0.09 -2.62 0.77 0.00 -1.71 0.00 0.00 66.02 62.55 1h2h s SER 99 CO 0.78 -1.04 1.57 -0.81 1.20 0.00 0.00 173.24 174.94 1h2h n PRO 100 N -0.49 1.19 -2.00 5.44 -0.04 -1.24 -4.93 135.00 132.92 1h2h n PRO 100 Ca 0.07 -0.74 -0.29 0.00 -0.04 0.00 0.00 63.50 62.50 1h2h n PRO 100 Cb 0.47 -1.48 0.17 0.00 -0.04 0.00 0.00 33.50 32.62 1h2h n PRO 100 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1h2h s ALA 101 N -2.32 2.40 -0.03 0.55 0.00 -1.24 -4.56 121.76 116.56 1h2h s ALA 101 Ca 0.28 -1.24 -0.01 0.00 0.00 0.00 0.00 51.96 51.00 1h2h s ALA 101 Cb 0.20 -2.70 0.03 0.00 0.00 0.00 0.00 23.12 20.65 1h2h s ALA 101 CO 0.46 -2.31 0.04 0.50 0.00 0.00 0.00 175.76 174.44 1h2h s ARG 102 N -5.80 -0.02 -0.14 0.00 3.52 -0.83 -4.95 118.95 110.74 1h2h s ARG 102 Ca 0.73 0.24 -0.07 0.00 -0.13 0.00 0.00 55.73 56.50 1h2h s ARG 102 Cb -0.04 -0.35 -0.04 0.00 -1.56 0.00 0.00 34.95 32.96 1h2h s ARG 102 CO 0.52 -0.22 0.11 0.08 -0.81 0.00 0.00 175.30 174.98 1h2h s VAL 103 N 1.41 5.25 -0.10 7.11 1.01 -1.26 0.69 120.40 134.50 1h2h s VAL 103 Ca -0.05 0.12 0.03 0.00 0.00 0.00 0.00 61.98 62.08 1h2h s VAL 103 Cb -0.13 -3.30 0.01 0.00 0.00 0.00 0.00 36.38 32.96 1h2h s VAL 103 CO -0.03 0.57 -0.21 -0.36 0.00 0.00 0.00 175.10 175.07 1h2h s PHE 104 N -0.63 2.37 -0.73 5.22 0.40 0.38 -4.92 117.98 120.08 1h2h s PHE 104 Ca 0.12 -1.03 0.00 0.00 -0.60 0.00 0.00 56.93 55.42 1h2h s PHE 104 Cb -0.12 -1.62 0.18 0.00 0.51 0.00 0.00 43.02 41.98 1h2h s PHE 104 CO 0.02 -0.45 0.55 -0.06 0.70 0.00 0.00 175.22 175.99 1h2h s PHE 105 N 0.56 3.59 0.70 0.36 0.08 -1.26 -1.96 117.98 120.04 1h2h s PHE 105 Ca -0.15 -3.03 -0.17 0.00 0.12 0.00 0.00 56.93 53.71 1h2h s PHE 105 Cb -0.17 -3.06 0.02 0.00 -0.57 0.00 0.00 43.02 39.24 1h2h s PHE 105 CO 0.05 -0.72 1.27 -1.25 -0.10 0.00 0.00 175.22 174.47 1h2h s PRO 106 N -0.87 2.25 0.67 0.24 0.04 -1.26 -4.87 135.00 131.19 1h2h s PRO 106 Ca 0.22 1.99 0.43 0.00 0.04 0.00 0.00 61.00 63.68 1h2h s PRO 106 Cb -0.13 -1.82 2.33 0.00 0.04 0.00 0.00 34.50 34.93 1h2h s PRO 106 CO -0.09 -1.81 2.32 0.77 0.04 0.00 0.00 177.00 178.23 1h2h h SER 107 N 0.10 0.00 0.00 6.66 0.02 -1.90 -3.47 113.55 114.95 1h2h h SER 107 Ca -0.50 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.45 1h2h h SER 107 Cb 1.33 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.87 1h2h h SER 107 CO 0.51 0.00 0.00 0.61 -1.14 0.00 0.00 176.83 176.81 1h2h n GLY 108 N -1.11 3.36 0.05 -3.77 0.00 -1.26 -2.82 105.19 99.64 1h2h n GLY 108 Ca -0.03 -0.12 0.13 0.00 0.00 0.00 0.00 46.02 46.00 1h2h n GLY 108 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1h2h n ALA 109 N 11.82 2.17 -4.30 4.61 0.00 -1.26 -3.64 120.51 129.91 1h2h n ALA 109 Ca 0.00 -0.05 -0.22 0.00 0.00 0.00 0.00 53.44 53.17 1h2h n ALA 109 Cb 0.00 -1.44 -0.03 0.00 0.00 0.00 0.00 19.45 17.98 1h2h n ALA 109 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.50 177.94 1h2h n ILE 110 N -1.84 0.00 -4.08 0.00 -5.35 -1.13 -4.96 119.36 102.00 1h2h n ILE 110 Ca 0.06 -1.64 -0.11 0.00 -0.27 0.00 0.00 62.75 60.78 1h2h n ILE 110 Cb 0.34 0.18 -0.07 0.00 -1.74 0.00 0.00 39.64 38.36 1h2h n ILE 110 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 1h2h s GLY 111 N -3.11 1.03 0.00 3.28 0.00 -1.26 -4.74 107.32 102.51 1h2h s GLY 111 Ca 0.07 -1.28 0.00 0.00 0.00 0.00 0.00 44.72 43.51 1h2h s GLY 111 CO 0.04 -0.96 0.00 0.61 0.00 0.00 0.00 173.10 172.80 1h2h n GLY 112 N -0.38 0.59 0.04 0.20 0.00 -1.26 -4.94 105.19 99.44 1h2h n GLY 112 Ca 0.00 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.12 1h2h n GLY 112 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1h2h n LEU 113 N 0.00 0.25 0.01 0.99 4.77 -1.26 -2.26 117.00 119.50 1h2h n LEU 113 Ca 0.00 0.55 -0.13 0.00 -0.03 0.00 0.00 56.01 56.40 1h2h n LEU 113 Cb 0.00 -0.50 -0.09 0.00 -2.33 0.00 0.00 43.42 40.49 1h2h n LEU 113 CO 0.00 -0.29 0.63 -2.24 -1.33 0.00 0.00 177.39 174.17 1h2h h ASP 114 N 0.00 -0.04 -0.25 -1.43 3.04 -1.92 -1.72 116.42 114.10 1h2h h ASP 114 Ca 0.00 -0.41 -0.19 0.00 -3.24 0.00 0.00 57.03 53.18 1h2h h ASP 114 Cb 0.36 0.01 0.00 0.00 -1.04 0.00 0.00 39.33 38.67 1h2h h ASP 114 CO 0.00 0.40 -0.60 1.62 -2.04 0.00 0.00 179.24 178.62 1h2h h VAL 115 N -0.50 1.27 0.00 4.15 3.04 -1.96 -2.51 116.25 119.75 1h2h h VAL 115 Ca -0.01 -1.78 -0.00 0.00 -1.01 0.00 0.00 66.70 63.90 1h2h h VAL 115 Cb 0.45 1.70 -0.00 0.00 -2.01 0.00 0.00 31.29 31.44 1h2h h VAL 115 CO 0.01 0.58 -0.01 0.25 -1.01 0.00 0.00 177.57 177.39 1h2h h LEU 116 N 0.64 0.00 0.06 3.16 5.85 -1.50 -0.98 115.31 122.54 1h2h h LEU 116 Ca 0.00 0.00 -0.28 0.00 0.84 0.00 0.00 57.88 58.44 1h2h h LEU 116 Cb 1.21 0.00 0.02 0.00 0.37 0.00 0.00 40.66 42.26 1h2h h LEU 116 CO 0.13 0.01 -1.17 -1.28 -0.34 0.00 0.00 178.44 175.78 1h2h h SER 117 N 0.00 0.80 -0.35 1.25 0.87 -1.13 -2.27 113.55 112.72 1h2h h SER 117 Ca -0.00 -0.71 -0.04 0.00 -1.23 0.00 0.00 61.79 59.81 1h2h h SER 117 Cb 0.01 -0.25 -0.01 0.00 -0.44 0.00 0.00 62.40 61.71 1h2h h SER 117 CO 0.00 1.52 0.06 0.28 -0.53 0.00 0.00 176.83 178.16 1h2h h SER 118 N 0.27 0.55 -0.51 6.23 0.02 -0.91 -3.23 113.55 115.97 1h2h h SER 118 Ca -0.16 -0.26 0.00 0.00 -0.84 0.00 0.00 61.79 60.53 1h2h h SER 118 Cb 1.84 -0.15 0.00 0.00 0.14 0.00 0.00 62.40 64.23 1h2h h SER 118 CO 0.22 0.67 0.00 2.30 -1.14 0.00 0.00 176.83 178.88 1h2h n ILE 119 N -4.58 2.44 -0.34 3.27 -6.64 -0.45 -4.75 119.36 108.31 1h2h n ILE 119 Ca -0.01 -1.47 0.18 0.00 -1.77 0.00 0.00 62.75 59.68 1h2h n ILE 119 Cb 0.22 -0.17 0.41 0.00 -1.44 0.00 0.00 39.64 38.66 1h2h n ILE 119 CO 0.00 0.00 0.00 0.07 -1.77 0.00 0.00 176.55 174.85 1h2h h LYS 120 N 3.46 0.54 0.00 6.28 2.10 -1.43 -0.85 116.57 126.67 1h2h h LYS 120 Ca 0.00 -0.03 -0.03 0.00 -2.00 0.00 0.00 60.65 58.59 1h2h h LYS 120 Cb 1.73 -0.12 -0.00 0.00 -0.90 0.00 0.00 32.23 32.93 1h2h h LYS 120 CO 0.37 0.36 -0.15 -0.44 -2.00 0.00 0.00 179.45 177.59 1h2h h ASP 121 N 0.55 0.00 0.16 7.07 3.32 -1.88 -2.99 116.42 122.65 1h2h h ASP 121 Ca 0.62 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.67 1h2h h ASP 121 Cb 1.25 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.80 1h2h h ASP 121 CO -0.40 0.15 -0.36 0.49 -1.72 0.00 0.00 179.24 177.40 1h2h n PHE 122 N -3.49 0.00 -2.00 4.55 3.01 -0.33 -4.94 117.46 114.25 1h2h n PHE 122 Ca -0.01 0.00 -0.42 0.00 1.01 0.00 0.00 57.45 58.03 1h2h n PHE 122 Cb 0.30 -0.08 -0.03 0.00 -0.01 0.00 0.00 39.48 39.66 1h2h n PHE 122 CO 0.00 0.00 0.00 0.08 1.01 0.00 0.00 176.76 177.85 1h2h s VAL 123 N -2.53 3.01 -0.11 -4.37 1.01 -1.13 -2.16 120.40 114.13 1h2h s VAL 123 Ca 0.22 0.61 -0.13 0.00 0.00 0.00 0.00 61.98 62.68 1h2h s VAL 123 Cb 0.19 -3.39 -0.27 0.00 0.00 0.00 0.00 36.38 32.91 1h2h s VAL 123 CO 0.55 0.02 0.48 0.11 0.00 0.00 0.00 175.10 176.27 1h2h h LYS 124 N 7.50 0.25 -1.99 2.72 1.57 -1.08 -3.48 116.57 122.06 1h2h h LYS 124 Ca -0.42 -0.43 0.11 0.00 -1.87 0.00 0.00 60.65 58.04 1h2h h LYS 124 Cb 1.20 0.16 -0.18 0.00 0.08 0.00 0.00 32.23 33.49 1h2h h LYS 124 CO 0.91 1.21 0.52 0.54 -0.57 0.00 0.00 179.45 182.06 1h2h s ASN 125 N -7.06 -0.36 -0.07 0.86 2.20 -1.12 -4.90 114.94 104.49 1h2h s ASN 125 Ca -0.21 0.15 0.01 0.00 -0.94 0.00 0.00 52.86 51.87 1h2h s ASN 125 Cb 0.05 0.35 0.02 0.00 -2.00 0.00 0.00 41.25 39.67 1h2h s ASN 125 CO 0.76 -0.51 -0.10 -0.69 -2.94 0.00 0.00 177.10 173.63 1h2h s VAL 126 N -2.39 1.02 -0.20 3.54 1.01 0.24 -1.80 120.40 121.82 1h2h s VAL 126 Ca 0.03 -0.38 -0.03 0.00 0.00 0.00 0.00 61.98 61.60 1h2h s VAL 126 Cb -0.01 -0.97 -0.01 0.00 0.00 0.00 0.00 36.38 35.39 1h2h s VAL 126 CO -0.05 0.34 -0.06 -0.13 0.00 0.00 0.00 175.10 175.20 1h2h s ARG 127 N 0.96 3.40 -0.22 2.72 0.52 -0.26 -1.01 118.95 125.06 1h2h s ARG 127 Ca -0.09 -0.63 0.01 0.00 -0.52 0.00 0.00 55.73 54.50 1h2h s ARG 127 Cb -0.15 -2.93 0.04 0.00 0.52 0.00 0.00 34.95 32.43 1h2h s ARG 127 CO 0.00 -0.08 -0.15 -1.50 0.02 0.00 0.00 175.30 173.59 1h2h s ILE 128 N 1.17 2.19 -0.11 1.52 1.10 -0.52 -0.49 121.20 126.06 1h2h s ILE 128 Ca 0.02 -1.20 -0.00 0.00 -0.51 0.00 0.00 60.65 58.95 1h2h s ILE 128 Cb -0.14 -2.08 -0.02 0.00 0.15 0.00 0.00 42.46 40.36 1h2h s ILE 128 CO -0.01 0.30 -0.09 -0.70 -2.11 0.00 0.00 174.94 172.33 1h2h s GLU 129 N 1.22 3.17 -0.16 3.50 2.12 -0.15 -1.53 118.70 126.88 1h2h s GLU 129 Ca -0.01 -0.60 0.00 0.00 0.36 0.00 0.00 54.97 54.73 1h2h s GLU 129 Cb -0.16 -2.67 0.00 0.00 0.26 0.00 0.00 34.13 31.56 1h2h s GLU 129 CO -0.09 0.41 -0.16 0.99 -0.54 0.00 0.00 175.26 175.87 1h2h s THR 130 N -0.13 2.59 -0.36 -1.70 2.01 0.40 -1.10 115.64 117.35 1h2h s THR 130 Ca 0.01 -0.79 -0.02 0.00 0.31 0.00 0.00 61.69 61.20 1h2h s THR 130 Cb -0.13 -2.09 0.08 0.00 0.01 0.00 0.00 72.50 70.36 1h2h s THR 130 CO 0.03 0.51 0.11 -0.63 -0.69 0.00 0.00 174.62 173.95 1h2h s ILE 131 N 0.93 3.13 0.24 1.82 1.01 -0.58 0.32 121.20 128.07 1h2h s ILE 131 Ca -0.03 -1.77 0.06 0.00 0.00 0.00 0.00 60.65 58.91 1h2h s ILE 131 Cb -0.15 -3.01 -0.03 0.00 0.01 0.00 0.00 42.46 39.28 1h2h s ILE 131 CO -0.02 -0.43 0.26 -0.54 0.00 0.00 0.00 174.94 174.20 1h2h s LYS 132 N 1.18 3.13 0.33 2.79 1.02 0.37 -2.13 119.74 126.43 1h2h s LYS 132 Ca 0.03 -0.92 -0.27 0.00 0.02 0.00 0.00 55.97 54.83 1h2h s LYS 132 Cb -0.21 -2.70 -0.09 0.00 -0.52 0.00 0.00 37.83 34.30 1h2h s LYS 132 CO -0.03 0.42 1.04 -2.14 -0.92 0.00 0.00 175.35 173.72 1h2h s PRO 133 N -3.83 4.46 0.30 -1.68 0.02 -1.26 -1.57 135.00 131.44 1h2h s PRO 133 Ca 0.33 1.58 0.06 0.00 0.02 0.00 0.00 61.00 63.00 1h2h s PRO 133 Cb -0.09 -2.88 0.76 0.00 0.02 0.00 0.00 34.50 32.32 1h2h s PRO 133 CO 0.26 0.11 1.75 -1.35 -0.33 0.00 0.00 177.00 177.45 1h2h h PRO 134 N 3.22 0.64 -0.67 5.54 0.11 -1.84 -1.55 132.00 137.46 1h2h h PRO 134 Ca -0.47 -0.04 0.13 0.00 0.11 0.00 0.00 66.00 65.73 1h2h h PRO 134 Cb 1.21 -0.15 -0.10 0.00 0.11 0.00 0.00 31.00 32.08 1h2h h PRO 134 CO 0.65 0.43 0.14 -0.22 -0.21 0.00 0.00 178.00 178.79 1h2h h LYS 135 N 0.66 0.25 0.00 1.05 3.64 -1.92 0.77 116.57 121.03 1h2h h LYS 135 Ca 0.59 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.95 1h2h h LYS 135 Cb 0.99 -0.06 0.00 0.00 -0.41 0.00 0.00 32.23 32.75 1h2h h LYS 135 CO -0.42 0.17 0.00 -1.13 -2.27 0.00 0.00 179.45 175.79 1h2h n SER 136 N -5.15 0.00 -0.06 4.20 3.41 -0.58 -0.95 113.62 114.49 1h2h n SER 136 Ca 0.11 -0.47 0.01 0.00 -0.26 0.00 0.00 58.87 58.26 1h2h n SER 136 Cb 0.39 0.00 0.01 0.00 -0.26 0.00 0.00 64.21 64.35 1h2h n SER 136 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1h2h n LEU 137 N -0.77 0.94 -3.63 1.04 4.32 0.20 -5.00 117.00 114.11 1h2h n LEU 137 Ca 0.04 -1.11 -0.23 0.00 -0.02 0.00 0.00 56.01 54.69 1h2h n LEU 137 Cb 0.02 -0.04 0.07 0.00 -1.62 0.00 0.00 43.42 41.85 1h2h n LEU 137 CO 0.03 0.27 0.15 0.61 -1.22 0.00 0.00 177.39 177.23 1h2h n GLY 138 N -0.31 -0.46 3.24 -0.72 0.00 -0.12 -4.99 105.19 101.82 1h2h n GLY 138 Ca 0.01 0.19 -0.21 0.00 0.00 0.00 0.00 46.02 46.02 1h2h n GLY 138 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1h2h s LEU 139 N -7.00 2.32 -0.15 0.99 1.43 -0.79 -5.02 118.68 110.45 1h2h s LEU 139 Ca 0.39 -0.70 0.00 0.00 -1.03 0.00 0.00 54.13 52.80 1h2h s LEU 139 Cb -0.18 -0.68 0.03 0.00 0.03 0.00 0.00 46.19 45.38 1h2h s LEU 139 CO 0.76 -0.03 -0.12 1.51 0.23 0.00 0.00 176.35 178.69 1h2h s ASP 140 N -2.00 2.73 0.14 2.29 1.47 -1.26 -3.68 116.67 116.37 1h2h s ASP 140 Ca 0.04 -0.53 0.03 0.00 1.18 0.00 0.00 52.55 53.27 1h2h s ASP 140 Cb -0.09 -1.13 -0.04 0.00 -0.34 0.00 0.00 42.92 41.32 1h2h s ASP 140 CO 0.03 -0.08 -0.06 -0.76 0.68 0.00 0.00 175.17 174.98 1h2h s LEU 141 N 1.51 2.42 0.00 2.11 1.43 -1.26 -5.04 118.68 119.85 1h2h s LEU 141 Ca 0.04 -1.06 0.11 0.00 -1.03 0.00 0.00 54.13 52.19 1h2h s LEU 141 Cb -0.13 -0.20 -0.06 0.00 0.03 0.00 0.00 46.19 45.82 1h2h s LEU 141 CO -0.10 -0.43 0.57 0.29 0.23 0.00 0.00 176.35 176.90 1h2h n LYS 142 N -0.17 2.75 -3.88 1.70 4.76 -1.26 -4.77 118.16 117.29 1h2h n LYS 142 Ca -0.10 -0.30 -0.08 0.00 -2.87 0.00 0.00 58.31 54.96 1h2h n LYS 142 Cb 0.61 -1.07 -0.03 0.00 -1.84 0.00 0.00 35.03 32.71 1h2h n LYS 142 CO 0.00 0.00 0.00 0.20 -1.37 0.00 0.00 177.40 176.23 1h2h s GLY 143 N -1.78 0.06 0.56 0.72 0.00 -1.26 -4.96 107.32 100.67 1h2h s GLY 143 Ca 0.07 -0.44 -0.21 0.00 0.00 0.00 0.00 44.72 44.14 1h2h s GLY 143 CO 0.37 -0.23 1.35 0.54 0.00 0.00 0.00 173.10 175.14 1h2h s LYS 144 N -3.94 3.07 -0.11 2.90 1.02 -1.26 -4.49 119.74 116.93 1h2h s LYS 144 Ca 0.14 2.22 -0.06 0.00 0.02 0.00 0.00 55.97 58.28 1h2h s LYS 144 Cb -0.04 -2.21 0.04 0.00 -0.52 0.00 0.00 37.83 35.10 1h2h s LYS 144 CO 0.07 -1.24 0.26 0.99 -0.92 0.00 0.00 175.35 174.51 1h2h s THR 145 N -1.31 -0.03 -0.14 2.17 2.01 -0.21 -4.99 115.64 113.13 1h2h s THR 145 Ca 0.73 0.11 -0.28 0.00 0.31 0.00 0.00 61.69 62.57 1h2h s THR 145 Cb -0.40 -0.39 -0.01 0.00 0.01 0.00 0.00 72.50 71.71 1h2h s THR 145 CO 0.47 0.05 0.93 -0.69 -0.69 0.00 0.00 174.62 174.68 1h2h s VAL 146 N 1.05 4.82 -0.81 3.82 1.01 -1.26 -0.86 120.40 128.17 1h2h s VAL 146 Ca -0.07 1.86 0.21 0.00 0.00 0.00 0.00 61.98 63.97 1h2h s VAL 146 Cb -0.09 -4.23 -0.24 0.00 0.00 0.00 0.00 36.38 31.82 1h2h s VAL 146 CO -0.07 0.01 0.84 1.33 0.00 0.00 0.00 175.10 177.20 1h2h n VAL 147 N 4.65 0.00 -3.62 2.92 0.24 -0.28 -4.96 118.33 117.28 1h2h n VAL 147 Ca 0.07 -0.10 -0.09 0.00 -2.04 0.00 0.00 64.34 62.18 1h2h n VAL 147 Cb 0.49 0.78 -0.06 0.00 -1.47 0.00 0.00 33.84 33.57 1h2h n VAL 147 CO 0.00 0.00 0.00 0.12 -2.14 0.00 0.00 176.83 174.81 1h2h s PHE 148 N -3.10 -0.39 -0.24 6.34 2.19 -1.14 -4.99 117.98 116.65 1h2h s PHE 148 Ca 0.05 0.88 -0.11 0.00 0.33 0.00 0.00 56.93 58.08 1h2h s PHE 148 Cb 0.16 0.40 0.09 0.00 -1.31 0.00 0.00 43.02 42.35 1h2h s PHE 148 CO 0.87 -0.24 0.55 -2.00 1.83 0.00 0.00 175.22 176.24 1h2h s GLU 149 N -0.19 0.52 0.00 10.12 2.12 -1.26 -1.19 118.70 128.82 1h2h s GLU 149 Ca 0.02 1.11 0.00 0.00 0.36 0.00 0.00 54.97 56.47 1h2h s GLU 149 Cb -0.04 0.27 0.00 0.00 0.26 0.00 0.00 34.13 34.62 1h2h s GLU 149 CO -0.05 -0.18 0.00 0.41 -0.54 0.00 0.00 175.26 174.90 1h2h n GLY 150 N 4.72 -0.55 3.83 -1.50 0.00 -0.83 -5.01 105.19 105.84 1h2h n GLY 150 Ca -0.17 -0.78 -0.29 0.00 0.00 0.00 0.00 46.02 44.78 1h2h n GLY 150 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1h2h s SER 151 N -4.00 3.92 0.17 1.61 1.04 -1.26 -1.06 113.70 114.13 1h2h s SER 151 Ca 0.00 0.92 -0.07 0.00 0.48 0.00 0.00 55.95 57.28 1h2h s SER 151 Cb 0.00 -1.48 0.06 0.00 0.10 0.00 0.00 66.02 64.70 1h2h s SER 151 CO 0.00 -2.29 1.53 0.58 0.98 0.00 0.00 173.24 174.04 1h2h h VAL 152 N -1.32 1.28 -0.39 5.02 2.07 -1.87 -2.22 116.25 118.82 1h2h h VAL 152 Ca -0.49 -1.54 0.04 0.00 0.82 0.00 0.00 66.70 65.54 1h2h h VAL 152 Cb 1.33 1.40 -0.04 0.00 -1.52 0.00 0.00 31.29 32.46 1h2h h VAL 152 CO 0.63 0.51 0.15 -0.08 0.02 0.00 0.00 177.57 178.80 1h2h h GLU 153 N 0.67 0.31 -0.31 1.57 4.81 -1.94 -2.23 114.58 117.47 1h2h h GLU 153 Ca 0.06 -0.02 -0.17 0.00 -0.13 0.00 0.00 59.36 59.11 1h2h h GLU 153 Cb 0.93 -0.07 -0.00 0.00 0.63 0.00 0.00 28.75 30.23 1h2h h GLU 153 CO 0.09 0.20 -0.46 0.93 -0.73 0.00 0.00 179.01 179.03 1h2h h GLU 154 N 0.31 0.81 -0.75 1.92 5.08 -1.93 -2.99 114.58 117.05 1h2h h GLU 154 Ca 0.18 -0.47 0.03 0.00 -1.00 0.00 0.00 59.36 58.10 1h2h h GLU 154 Cb 0.14 0.03 -0.04 0.00 0.50 0.00 0.00 28.75 29.39 1h2h h GLU 154 CO -0.17 1.10 0.50 0.00 -1.00 0.00 0.00 179.01 179.44 1h2h h ALA 155 N 0.82 1.53 -0.25 3.43 0.00 -1.17 -1.93 119.26 121.69 1h2h h ALA 155 Ca 0.04 -0.04 -0.15 0.00 0.00 0.00 0.00 54.91 54.76 1h2h h ALA 155 Cb 1.05 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.56 1h2h h ALA 155 CO 0.10 0.41 -0.46 1.03 0.00 0.00 0.00 179.25 180.33 1h2h h SER 156 N 0.95 0.69 -0.12 0.00 0.87 -1.33 0.20 113.55 114.81 1h2h h SER 156 Ca 0.29 -0.33 -0.05 0.00 -1.23 0.00 0.00 61.79 60.47 1h2h h SER 156 Cb -0.00 -0.20 -0.01 0.00 -0.44 0.00 0.00 62.40 61.75 1h2h h SER 156 CO -0.08 1.05 -0.05 0.11 -0.53 0.00 0.00 176.83 177.32 1h2h h LYS 157 N 0.51 0.39 0.00 2.24 1.79 -1.22 -2.96 116.57 117.33 1h2h h LYS 157 Ca 0.03 -0.08 -0.07 0.00 -2.18 0.00 0.00 60.65 58.35 1h2h h LYS 157 Cb 0.99 -0.06 -0.01 0.00 -1.58 0.00 0.00 32.23 31.57 1h2h h LYS 157 CO 0.09 0.46 -1.79 1.28 -1.08 0.00 0.00 179.45 178.41 1h2h n LEU 158 N -4.29 0.27 -3.56 2.94 4.32 -0.99 -4.64 117.00 111.05 1h2h n LEU 158 Ca 0.00 0.11 -0.27 0.00 -0.02 0.00 0.00 56.01 55.83 1h2h n LEU 158 Cb 0.25 0.07 -0.10 0.00 -1.62 0.00 0.00 43.42 42.02 1h2h n LEU 158 CO 0.38 0.05 -0.05 0.49 -1.22 0.00 0.00 177.39 177.04 1h2h n PHE 159 N -2.49 2.50 0.04 -1.77 3.72 0.68 -4.92 117.46 115.21 1h2h n PHE 159 Ca -0.08 -4.05 0.00 0.00 -0.05 0.00 0.00 57.45 53.27 1h2h n PHE 159 Cb 0.68 -0.46 0.01 0.00 -0.94 0.00 0.00 39.48 38.77 1h2h n PHE 159 CO 0.00 0.00 0.00 -2.30 -0.05 0.00 0.00 176.76 174.41 1h2h n PRO 160 N 1.54 0.02 0.00 -1.08 -0.02 -1.13 -3.99 135.00 130.34 1h2h n PRO 160 Ca 0.25 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.73 1h2h n PRO 160 Cb 0.41 -1.31 0.00 0.00 -0.02 0.00 0.00 33.50 32.58 1h2h n PRO 160 CO 0.00 0.00 0.00 2.89 1.98 0.00 0.00 175.50 180.37 1h2h n ARG 161 N -0.81 0.00 0.00 -0.52 1.85 -1.26 -5.02 116.66 110.91 1h2h n ARG 161 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.85 1h2h n ARG 161 Cb 0.00 0.00 0.00 0.00 -1.05 0.00 0.00 32.46 31.41 1h2h n ARG 161 CO 0.00 0.00 0.00 -1.71 -0.01 0.00 0.00 177.63 175.91 1h2h n ASN 162 N 0.00 0.00 -0.70 2.89 2.85 -1.26 -4.73 115.26 114.31 1h2h n ASN 162 Ca 0.00 0.00 -0.09 0.00 -0.11 0.00 0.00 54.58 54.38 1h2h n ASN 162 Cb 0.00 0.00 -0.04 0.00 1.24 0.00 0.00 39.78 40.98 1h2h n ASN 162 CO 0.00 0.00 0.00 -0.38 -2.11 0.00 0.00 177.26 174.77 1h2h n ILE 163 N 0.00 -0.01 -0.04 -1.44 -0.00 -1.26 -4.87 119.36 111.74 1h2h n ILE 163 Ca 0.00 0.00 -0.19 0.00 -0.00 0.00 0.00 62.75 62.56 1h2h n ILE 163 Cb 0.00 -1.16 -0.13 0.00 -0.00 0.00 0.00 39.64 38.35 1h2h n ILE 163 CO 0.00 0.00 0.00 0.59 -0.00 0.00 0.00 176.55 177.14 1h2h n ASN 164 N 0.53 1.89 0.17 4.38 4.13 -1.26 -3.51 115.26 121.59 1h2h n ASN 164 Ca -0.09 0.11 -0.14 0.00 1.68 0.00 0.00 54.58 56.13 1h2h n ASN 164 Cb 0.30 -0.58 -0.08 0.00 -1.54 0.00 0.00 39.78 37.89 1h2h n ASN 164 CO 0.00 0.00 0.00 0.58 0.28 0.00 0.00 177.26 178.12 1h2h h VAL 165 N 0.04 0.73 -0.48 2.41 2.07 -1.92 -1.46 116.25 117.64 1h2h h VAL 165 Ca -0.47 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.05 1h2h h VAL 165 Cb 2.00 0.73 -0.02 0.00 -1.52 0.00 0.00 31.29 32.47 1h2h h VAL 165 CO 0.03 0.00 0.30 0.00 0.02 0.00 0.00 177.57 177.92 1h2h h ALA 166 N 0.38 1.63 -0.19 1.67 0.00 -1.98 -2.25 119.26 118.52 1h2h h ALA 166 Ca -0.03 -0.05 -0.04 0.00 0.00 0.00 0.00 54.91 54.79 1h2h h ALA 166 Cb 0.28 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 1h2h h ALA 166 CO 0.05 0.33 -0.03 0.77 0.00 0.00 0.00 179.25 180.37 1h2h h SER 167 N 0.65 0.36 -0.85 0.00 0.02 -1.49 0.39 113.55 112.63 1h2h h SER 167 Ca 0.17 -0.35 0.04 0.00 -0.84 0.00 0.00 61.79 60.81 1h2h h SER 167 Cb -0.04 -0.10 -0.05 0.00 0.14 0.00 0.00 62.40 62.34 1h2h h SER 167 CO -0.03 0.63 0.54 0.74 -1.14 0.00 0.00 176.83 177.57 1h2h h THR 168 N 0.09 1.11 -0.26 -2.27 2.02 -1.04 0.36 112.91 112.92 1h2h h THR 168 Ca 0.05 -0.36 -0.01 0.00 0.77 0.00 0.00 66.41 66.87 1h2h h THR 168 Cb 0.47 -0.01 -0.01 0.00 -1.74 0.00 0.00 68.15 66.85 1h2h h THR 168 CO 0.02 0.19 0.14 0.40 0.37 0.00 0.00 175.52 176.64 1h2h h ILE 169 N 1.04 1.13 -1.00 3.11 2.04 -1.14 -2.21 117.51 120.47 1h2h h ILE 169 Ca 0.34 -0.34 0.04 0.00 1.00 0.00 0.00 64.86 65.90 1h2h h ILE 169 Cb 0.04 0.88 -0.06 0.00 -0.74 0.00 0.00 36.82 36.94 1h2h h ILE 169 CO -0.13 0.13 0.65 1.23 0.00 0.00 0.00 178.15 180.03 1h2h h GLY 170 N 0.30 1.48 2.00 5.37 0.00 0.97 -0.16 103.07 113.03 1h2h h GLY 170 Ca 0.09 -0.50 -0.01 0.00 0.00 0.00 0.00 47.33 46.92 1h2h h GLY 170 CO -0.01 0.41 -0.03 1.41 0.00 0.00 0.00 176.54 178.31 1h2h h LEU 171 N 1.25 0.00 0.00 3.11 3.38 0.20 0.48 115.31 123.73 1h2h h LEU 171 Ca 0.40 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 58.27 1h2h h LEU 171 Cb 0.03 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.76 1h2h h LEU 171 CO -0.13 0.03 -0.60 0.40 0.09 0.00 0.00 178.44 178.23 1h2h h ILE 172 N 0.00 1.16 0.00 1.22 2.04 -0.48 -3.41 117.51 118.04 1h2h h ILE 172 Ca -0.00 -2.09 0.00 0.00 1.00 0.00 0.00 64.86 63.77 1h2h h ILE 172 Cb 0.08 2.42 0.00 0.00 -0.74 0.00 0.00 36.82 38.58 1h2h h ILE 172 CO 0.00 0.39 -1.64 1.33 0.00 0.00 0.00 178.15 178.24 1h2h n VAL 173 N -4.54 0.08 0.00 1.67 0.24 -0.69 -4.90 118.33 110.18 1h2h n VAL 173 Ca -0.19 -0.40 0.00 0.00 -2.04 0.00 0.00 64.34 61.71 1h2h n VAL 173 Cb 0.53 0.15 0.00 0.00 -1.47 0.00 0.00 33.84 33.04 1h2h n VAL 173 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1h2h n GLY 174 N 1.30 3.19 0.30 7.63 0.00 0.17 -4.82 105.19 112.96 1h2h n GLY 174 Ca -0.02 -1.47 -0.03 0.00 0.00 0.00 0.00 46.02 44.50 1h2h n GLY 174 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 1h2h h PHE 175 N 0.00 0.85 -0.22 1.61 -1.00 -1.88 -2.73 116.94 113.57 1h2h h PHE 175 Ca 0.00 -0.08 0.06 0.00 2.81 0.00 0.00 57.97 60.76 1h2h h PHE 175 Cb 0.00 -0.25 -0.01 0.00 3.61 0.00 0.00 35.95 39.30 1h2h h PHE 175 CO 0.00 0.72 0.24 1.05 -1.61 0.00 0.00 178.31 178.71 1h2h h GLU 176 N 0.79 0.00 -0.07 1.51 9.09 -1.92 -1.70 114.58 122.29 1h2h h GLU 176 Ca 0.17 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.58 1h2h h GLU 176 Cb 0.31 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.41 1h2h h GLU 176 CO 0.00 0.00 0.00 1.63 0.05 0.00 0.00 179.01 180.69 1h2h n LYS 177 N -3.82 1.57 -4.53 1.06 5.02 -1.03 -4.87 118.16 111.55 1h2h n LYS 177 Ca 0.03 -0.84 -0.33 0.00 -2.02 0.00 0.00 58.31 55.14 1h2h n LYS 177 Cb 0.37 -1.44 -0.13 0.00 -0.02 0.00 0.00 35.03 33.82 1h2h n LYS 177 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1h2h s VAL 178 N -1.93 3.65 -0.10 -0.18 1.01 -0.64 -0.60 120.40 121.62 1h2h s VAL 178 Ca 0.36 -0.45 0.03 0.00 0.00 0.00 0.00 61.98 61.92 1h2h s VAL 178 Cb 0.19 -2.57 -0.01 0.00 0.00 0.00 0.00 36.38 34.00 1h2h s VAL 178 CO 0.30 0.52 -0.21 -0.75 0.00 0.00 0.00 175.10 174.97 1h2h s LYS 179 N 0.16 3.03 -0.11 2.72 2.20 -0.18 -4.44 119.74 123.12 1h2h s LYS 179 Ca -0.03 -0.82 -0.01 0.00 -0.36 0.00 0.00 55.97 54.75 1h2h s LYS 179 Cb -0.14 -2.37 -0.03 0.00 -1.51 0.00 0.00 37.83 33.78 1h2h s LYS 179 CO 0.03 0.25 -0.06 0.08 -0.36 0.00 0.00 175.35 175.29 1h2h s VAL 180 N 0.20 3.70 -0.08 4.02 1.01 -0.22 -1.44 120.40 127.59 1h2h s VAL 180 Ca -0.13 -0.45 0.01 0.00 0.00 0.00 0.00 61.98 61.41 1h2h s VAL 180 Cb -0.16 -2.56 0.02 0.00 0.00 0.00 0.00 36.38 33.68 1h2h s VAL 180 CO 0.07 0.55 -0.07 -0.89 0.00 0.00 0.00 175.10 174.76 1h2h s THR 181 N -0.25 0.84 -0.30 3.92 2.01 -0.58 -1.97 115.64 119.30 1h2h s THR 181 Ca 0.04 -0.24 -0.05 0.00 0.31 0.00 0.00 61.69 61.75 1h2h s THR 181 Cb -0.13 -0.85 0.02 0.00 0.01 0.00 0.00 72.50 71.56 1h2h s THR 181 CO 0.03 0.31 0.05 -0.63 -0.69 0.00 0.00 174.62 173.69 1h2h s ILE 182 N 1.27 3.62 -0.07 1.82 -1.09 -0.33 -0.45 121.20 125.97 1h2h s ILE 182 Ca -0.04 -0.94 0.02 0.00 -2.23 0.00 0.00 60.65 57.46 1h2h s ILE 182 Cb -0.14 -2.93 -0.03 0.00 -1.58 0.00 0.00 42.46 37.79 1h2h s ILE 182 CO -0.03 0.02 -0.12 -0.69 -1.23 0.00 0.00 174.94 172.89 1h2h s VAL 183 N 1.42 3.26 -0.31 2.92 1.01 0.15 -1.12 120.40 127.72 1h2h s VAL 183 Ca 0.00 -0.64 -0.09 0.00 0.00 0.00 0.00 61.98 61.25 1h2h s VAL 183 Cb -0.18 -2.31 0.00 0.00 0.00 0.00 0.00 36.38 33.89 1h2h s VAL 183 CO 0.01 0.58 0.14 0.00 0.00 0.00 0.00 175.10 175.83 1h2h s ALA 184 N -0.59 3.21 -0.22 5.51 0.00 -0.04 -0.48 121.76 129.16 1h2h s ALA 184 Ca 0.08 -1.44 0.02 0.00 0.00 0.00 0.00 51.96 50.62 1h2h s ALA 184 Cb -0.11 -2.33 0.04 0.00 0.00 0.00 0.00 23.12 20.71 1h2h s ALA 184 CO 0.01 -0.96 -0.15 0.34 0.00 0.00 0.00 175.76 175.00 1h2h s ASP 185 N 1.57 3.79 0.63 0.00 -1.08 -0.61 -1.05 116.67 119.93 1h2h s ASP 185 Ca 0.04 -1.03 0.42 0.00 -0.52 0.00 0.00 52.55 51.46 1h2h s ASP 185 Cb -0.17 -1.51 2.28 0.00 -1.46 0.00 0.00 42.92 42.06 1h2h s ASP 185 CO 0.05 -0.10 2.29 1.55 0.52 0.00 0.00 175.17 179.49 1h2h h PRO 186 N 7.86 0.00 -3.37 4.34 0.13 -1.86 -3.35 132.00 135.74 1h2h h PRO 186 Ca -0.32 0.00 -0.71 0.00 -0.87 0.00 0.00 66.00 64.10 1h2h h PRO 186 Cb 1.09 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.17 1h2h h PRO 186 CO 0.55 0.00 3.07 0.00 -0.23 0.00 0.00 178.00 181.39 1h2h n ALA 187 N -2.05 6.38 0.00 -0.56 0.00 -1.26 -4.89 120.51 118.13 1h2h n ALA 187 Ca -0.03 -3.88 0.00 0.00 0.00 0.00 0.00 53.44 49.54 1h2h n ALA 187 Cb 0.08 -3.27 0.00 0.00 0.00 0.00 0.00 19.45 16.26 1h2h n ALA 187 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1h2h n ASP 189 N 4.20 0.00 -4.22 0.00 -0.08 -1.26 -5.14 116.55 110.04 1h2h n ASP 189 Ca 0.60 0.00 -0.22 0.00 -1.51 0.00 0.00 54.79 53.66 1h2h n ASP 189 Cb 0.31 0.01 -0.09 0.00 2.34 0.00 0.00 41.12 43.69 1h2h n ASP 189 CO 0.00 0.00 0.00 -1.38 0.12 0.00 0.00 177.20 175.94 1h2h s HIS 190 N -1.04 1.77 0.45 -0.67 -3.43 -1.26 -4.85 115.29 106.26 1h2h s HIS 190 Ca 0.00 -1.19 -0.21 0.00 -0.80 0.00 0.00 55.06 52.86 1h2h s HIS 190 Cb 0.00 -1.10 -0.09 0.00 -1.43 0.00 0.00 32.58 29.95 1h2h s HIS 190 CO 0.00 -0.25 1.01 -0.80 -2.00 0.00 0.00 174.74 172.69 1h2h s ASN 191 N -3.49 6.64 0.00 7.38 0.01 -1.26 -4.51 114.94 119.72 1h2h s ASN 191 Ca 0.32 1.86 -0.01 0.00 -0.71 0.00 0.00 52.86 54.31 1h2h s ASN 191 Cb 0.06 -2.56 -0.01 0.00 0.41 0.00 0.00 41.25 39.15 1h2h s ASN 191 CO 0.15 -0.57 0.02 -0.63 -1.51 0.00 0.00 177.10 174.56 1h2h s ILE 192 N -1.99 0.06 -0.09 0.60 1.01 -0.91 -4.14 121.20 115.74 1h2h s ILE 192 Ca 0.63 -0.46 0.03 0.00 0.00 0.00 0.00 60.65 60.86 1h2h s ILE 192 Cb -0.15 -0.19 0.01 0.00 0.01 0.00 0.00 42.46 42.14 1h2h s ILE 192 CO 0.19 -0.25 -0.18 -1.00 0.00 0.00 0.00 174.94 173.69 1h2h s HIS 193 N -0.76 2.06 -0.14 3.97 3.76 -0.23 -1.53 115.29 122.42 1h2h s HIS 193 Ca -0.08 -0.83 0.00 0.00 -0.15 0.00 0.00 55.06 54.00 1h2h s HIS 193 Cb -0.05 -1.42 0.02 0.00 1.11 0.00 0.00 32.58 32.24 1h2h s HIS 193 CO -0.00 -0.36 -0.14 0.42 -0.85 0.00 0.00 174.74 173.81 1h2h s ILE 194 N 0.52 1.52 -0.30 0.60 1.01 -0.26 0.30 121.20 124.59 1h2h s ILE 194 Ca -0.16 -0.60 -0.04 0.00 0.00 0.00 0.00 60.65 59.84 1h2h s ILE 194 Cb -0.17 -1.43 0.03 0.00 0.01 0.00 0.00 42.46 40.91 1h2h s ILE 194 CO 0.06 0.45 0.03 -0.69 0.00 0.00 0.00 174.94 174.80 1h2h s VAL 195 N 1.46 3.38 -0.24 2.92 1.01 0.07 -0.97 120.40 128.03 1h2h s VAL 195 Ca 0.04 -1.12 -0.07 0.00 0.00 0.00 0.00 61.98 60.83 1h2h s VAL 195 Cb -0.13 -2.86 -0.03 0.00 0.00 0.00 0.00 36.38 33.36 1h2h s VAL 195 CO -0.10 -0.04 0.07 -0.13 0.00 0.00 0.00 175.10 174.91 1h2h s ARG 196 N 1.36 3.70 -0.16 2.72 0.52 0.36 -1.20 118.95 126.25 1h2h s ARG 196 Ca -0.02 -0.46 0.01 0.00 -0.52 0.00 0.00 55.73 54.74 1h2h s ARG 196 Cb -0.19 -3.32 0.00 0.00 0.52 0.00 0.00 34.95 31.97 1h2h s ARG 196 CO 0.00 -0.13 -0.17 0.42 0.02 0.00 0.00 175.30 175.45 1h2h s ILE 197 N 1.46 2.49 -0.15 1.52 1.01 0.98 -1.10 121.20 127.41 1h2h s ILE 197 Ca 0.06 -0.82 -0.03 0.00 0.00 0.00 0.00 60.65 59.85 1h2h s ILE 197 Cb -0.15 -2.04 -0.03 0.00 0.01 0.00 0.00 42.46 40.25 1h2h s ILE 197 CO 0.04 0.52 -0.05 -0.55 0.00 0.00 0.00 174.94 174.90 1h2h s SER 198 N 0.91 4.68 0.30 3.58 0.15 -0.75 -0.87 113.70 121.70 1h2h s SER 198 Ca -0.04 -0.15 -0.13 0.00 0.70 0.00 0.00 55.95 56.33 1h2h s SER 198 Cb -0.15 -1.72 0.02 0.00 -1.71 0.00 0.00 66.02 62.45 1h2h s SER 198 CO -0.02 0.18 0.60 -0.94 1.20 0.00 0.00 173.24 174.26 1h2h s SER 199 N 0.28 0.08 0.39 5.45 1.04 -0.94 -0.40 113.70 119.60 1h2h s SER 199 Ca -0.04 -1.02 0.28 0.00 0.48 0.00 0.00 55.95 55.65 1h2h s SER 199 Cb -0.14 0.69 0.99 0.00 0.10 0.00 0.00 66.02 67.66 1h2h s SER 199 CO 0.03 -1.34 1.80 0.00 0.98 0.00 0.00 173.24 174.72 1h2h h ALA 200 N 2.12 1.00 0.00 5.32 0.00 -1.81 -3.12 119.26 122.76 1h2h h ALA 200 Ca -0.26 0.00 -0.18 0.00 0.00 0.00 0.00 54.91 54.47 1h2h h ALA 200 Cb 1.25 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 19.01 1h2h h ALA 200 CO 0.35 0.00 -1.40 0.82 0.00 0.00 0.00 179.25 179.01 1h2h h ILE 201 N 0.00 0.54 0.00 0.00 1.08 -1.95 -3.50 117.51 113.68 1h2h h ILE 201 Ca 0.00 -2.06 0.00 0.00 -0.39 0.00 0.00 64.86 62.41 1h2h h ILE 201 Cb 0.58 2.08 0.00 0.00 -3.07 0.00 0.00 36.82 36.41 1h2h h ILE 201 CO 0.00 0.31 0.00 0.61 -0.69 0.00 0.00 178.15 178.38 1h2h n GLY 202 N 1.40 -2.46 3.29 5.37 0.00 -1.18 -5.14 105.19 106.47 1h2h n GLY 202 Ca -0.10 -1.27 -0.30 0.00 0.00 0.00 0.00 46.02 44.35 1h2h n GLY 202 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1h2h s ASN 203 N -0.76 2.94 0.03 1.61 0.02 -1.26 -2.22 114.94 115.29 1h2h s ASN 203 Ca 0.00 -0.46 0.05 0.00 -1.02 0.00 0.00 52.86 51.43 1h2h s ASN 203 Cb 0.00 -0.41 -0.02 0.00 0.02 0.00 0.00 41.25 40.84 1h2h s ASN 203 CO 0.00 0.29 -0.15 -0.31 0.02 0.00 0.00 177.10 176.95 1h2h s TYR 204 N -0.51 1.32 -0.08 2.20 2.02 -0.05 -4.99 117.35 117.26 1h2h s TYR 204 Ca 0.07 -0.32 0.01 0.00 -0.37 0.00 0.00 57.07 56.46 1h2h s TYR 204 Cb -0.10 -0.80 0.02 0.00 -0.40 0.00 0.00 41.96 40.68 1h2h s TYR 204 CO -0.00 0.03 -0.09 -1.21 -1.57 0.00 0.00 175.55 172.71 1h2h s GLU 205 N -0.92 1.48 -0.17 -0.62 2.02 -1.26 -0.01 118.70 119.22 1h2h s GLU 205 Ca 0.03 -0.29 0.00 0.00 0.02 0.00 0.00 54.97 54.74 1h2h s GLU 205 Cb -0.07 -1.39 0.03 0.00 0.10 0.00 0.00 34.13 32.80 1h2h s GLU 205 CO 0.01 -0.12 -0.11 -0.06 0.02 0.00 0.00 175.26 175.00 1h2h s PHE 206 N 1.17 2.16 -0.17 1.61 0.08 -0.34 -4.98 117.98 117.51 1h2h s PHE 206 Ca -0.05 -1.31 -0.05 0.00 0.12 0.00 0.00 56.93 55.64 1h2h s PHE 206 Cb -0.14 -1.56 -0.03 0.00 -0.57 0.00 0.00 43.02 40.72 1h2h s PHE 206 CO -0.02 -0.68 -0.01 0.21 -0.10 0.00 0.00 175.22 174.62 1h2h s LYS 207 N 1.49 3.69 -0.21 0.44 2.20 -1.26 -0.75 119.74 125.34 1h2h s LYS 207 Ca 0.02 -0.50 0.02 0.00 -0.36 0.00 0.00 55.97 55.15 1h2h s LYS 207 Cb -0.14 -3.01 0.04 0.00 -1.51 0.00 0.00 37.83 33.20 1h2h s LYS 207 CO -0.09 0.17 -0.16 0.42 -0.36 0.00 0.00 175.35 175.33 1h2h s ILE 208 N 0.59 2.01 -0.69 5.43 -1.09 0.15 -4.98 121.20 122.62 1h2h s ILE 208 Ca -0.01 -1.15 0.03 0.00 -2.23 0.00 0.00 60.65 57.29 1h2h s ILE 208 Cb -0.14 -1.95 0.17 0.00 -1.58 0.00 0.00 42.46 38.96 1h2h s ILE 208 CO 0.02 0.31 0.49 -1.61 -1.23 0.00 0.00 174.94 172.92 1h2h s GLU 209 N 1.26 2.51 0.17 2.79 2.02 -1.26 -1.07 118.70 125.12 1h2h s GLU 209 Ca -0.00 -3.10 -0.30 0.00 0.02 0.00 0.00 54.97 51.59 1h2h s GLU 209 Cb -0.16 -3.52 -0.08 0.00 0.10 0.00 0.00 34.13 30.47 1h2h s GLU 209 CO -0.10 -1.23 1.16 -0.80 0.02 0.00 0.00 175.26 174.31 1h2h s ASN 210 N -0.76 7.16 0.06 -0.19 0.02 -1.26 -5.08 114.94 114.89 1h2h s ASN 210 Ca 0.23 2.16 0.28 0.00 -1.02 0.00 0.00 52.86 54.50 1h2h s ASN 210 Cb -0.11 -2.60 1.11 0.00 0.02 0.00 0.00 41.25 39.66 1h2h s ASN 210 CO -0.11 -0.32 1.88 -0.38 0.02 0.00 0.00 177.10 178.19 1h2h n ILE 211 N 2.56 0.19 -4.01 0.60 5.41 -1.26 -4.62 119.36 118.23 1h2h n ILE 211 Ca 0.04 -0.08 -0.27 0.00 1.00 0.00 0.00 62.75 63.44 1h2h n ILE 211 Cb 0.45 -0.53 -0.01 0.00 -0.71 0.00 0.00 39.64 38.84 1h2h n ILE 211 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 176.55 176.00 1h2h s SER 220 N -3.44 4.56 0.00 4.38 0.15 -1.26 -5.10 113.70 112.98 1h2h s SER 220 Ca 0.13 -1.31 0.00 0.00 0.70 0.00 0.00 55.95 55.47 1h2h s SER 220 Cb 0.17 0.45 0.00 0.00 -1.71 0.00 0.00 66.02 64.93 1h2h s SER 220 CO 0.55 -1.08 0.00 -0.11 1.20 0.00 0.00 173.24 173.80 1h2h n LEU 222 N -1.70 0.00 -0.30 3.45 7.94 -1.26 -3.03 117.00 122.10 1h2h n LEU 222 Ca -0.04 0.00 -0.04 0.00 -1.11 0.00 0.00 56.01 54.82 1h2h n LEU 222 Cb 0.65 0.00 0.10 0.00 0.53 0.00 0.00 43.42 44.70 1h2h n LEU 222 CO 0.39 0.00 1.13 0.74 -1.11 0.00 0.00 177.39 178.54 1h2h h THR 223 N 0.00 1.25 0.59 1.96 2.02 -1.94 0.47 112.91 117.26 1h2h h THR 223 Ca 0.00 -0.69 -0.02 0.00 0.77 0.00 0.00 66.41 66.47 1h2h h THR 223 Cb 0.00 0.16 -0.00 0.00 -1.74 0.00 0.00 68.15 66.57 1h2h h THR 223 CO 0.00 0.30 -0.33 0.58 0.37 0.00 0.00 175.52 176.44 1h2h h VAL 224 N 1.19 0.32 0.00 3.16 2.07 -1.89 -0.56 116.25 120.54 1h2h h VAL 224 Ca 0.29 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.80 1h2h h VAL 224 Cb 0.09 0.32 -0.00 0.00 -1.52 0.00 0.00 31.29 30.18 1h2h h VAL 224 CO -0.04 0.00 -0.05 1.88 0.02 0.00 0.00 177.57 179.38 1h2h h TYR 225 N -0.86 0.00 -0.37 1.57 0.05 -1.84 -0.26 116.97 115.26 1h2h h TYR 225 Ca -0.07 0.00 -0.12 0.00 0.05 0.00 0.00 58.73 58.59 1h2h h TYR 225 Cb 0.69 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.42 1h2h h TYR 225 CO -0.08 0.05 -0.22 1.03 -1.05 0.00 0.00 178.16 177.89 1h2h h SER 226 N 0.00 0.84 0.03 3.88 0.87 -0.18 -0.64 113.55 118.35 1h2h h SER 226 Ca -0.00 -0.42 -0.00 0.00 -1.23 0.00 0.00 61.79 60.14 1h2h h SER 226 Cb 0.20 -0.23 0.00 0.00 -0.44 0.00 0.00 62.40 61.93 1h2h h SER 226 CO 0.01 1.08 -0.02 0.40 -0.53 0.00 0.00 176.83 177.77 1h2h h ILE 227 N 0.60 1.20 -0.84 2.23 1.08 0.47 -2.71 117.51 119.54 1h2h h ILE 227 Ca 0.08 -0.75 0.11 0.00 -0.39 0.00 0.00 64.86 63.91 1h2h h ILE 227 Cb 0.78 1.70 -0.08 0.00 -3.07 0.00 0.00 36.82 36.15 1h2h h ILE 227 CO 0.06 0.19 0.48 -0.07 -0.69 0.00 0.00 178.15 178.12 1h2h h LEU 228 N -0.37 0.67 -1.25 1.44 3.38 -1.13 0.05 115.31 118.09 1h2h h LEU 228 Ca -0.00 0.06 -0.06 0.00 0.09 0.00 0.00 57.88 57.96 1h2h h LEU 228 Cb 0.34 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.01 1h2h h LEU 228 CO 0.01 0.36 -0.12 -0.09 0.09 0.00 0.00 178.44 178.69 1h2h h ARG 229 N 0.78 0.36 -0.31 1.13 9.65 -1.07 0.22 114.38 125.14 1h2h h ARG 229 Ca 0.42 -0.09 -0.13 0.00 -1.10 0.00 0.00 59.98 59.07 1h2h h ARG 229 Cb 0.42 -0.04 -0.00 0.00 -1.39 0.00 0.00 29.97 28.95 1h2h h ARG 229 CO -0.27 0.49 -0.33 1.15 2.80 0.00 0.00 179.97 183.81 1h2h h THR 230 N 0.34 1.29 -0.17 0.20 2.02 -0.72 -0.03 112.91 115.84 1h2h h THR 230 Ca 0.07 -1.50 -0.02 0.00 0.77 0.00 0.00 66.41 65.73 1h2h h THR 230 Cb 0.43 1.55 -0.01 0.00 -1.74 0.00 0.00 68.15 68.38 1h2h h THR 230 CO 0.02 0.49 0.03 -0.07 0.37 0.00 0.00 175.52 176.36 1h2h h LEU 231 N 0.53 0.27 -1.20 2.58 3.38 -0.66 -2.56 115.31 117.64 1h2h h LEU 231 Ca 0.05 -0.26 0.05 0.00 0.09 0.00 0.00 57.88 57.80 1h2h h LEU 231 Cb 0.91 -0.07 -0.05 0.00 0.09 0.00 0.00 40.66 41.54 1h2h h LEU 231 CO 0.08 0.46 0.56 0.03 0.09 0.00 0.00 178.44 179.66 1h2h h ARG 232 N 0.07 0.98 -0.29 1.13 2.47 -0.51 -1.87 114.38 116.36 1h2h h ARG 232 Ca 0.05 -0.06 -0.04 0.00 -1.26 0.00 0.00 59.98 58.68 1h2h h ARG 232 Cb 0.31 -0.22 -0.02 0.00 -1.65 0.00 0.00 29.97 28.39 1h2h h ARG 232 CO 0.00 0.65 0.02 -0.91 0.56 0.00 0.00 179.97 180.29 1h2h h ASN 233 N 1.01 0.40 -0.96 7.04 2.35 -0.69 -2.38 115.58 122.35 1h2h h ASN 233 Ca 0.35 -0.06 0.11 0.00 -0.55 0.00 0.00 56.30 56.14 1h2h h ASN 233 Cb 0.10 -0.10 -0.08 0.00 0.05 0.00 0.00 38.32 38.29 1h2h h ASN 233 CO -0.11 0.45 0.61 -0.07 -1.65 0.00 0.00 177.43 176.66 1h2h h LEU 234 N 0.42 0.88 -3.54 1.61 3.38 -0.94 -2.51 115.31 114.61 1h2h h LEU 234 Ca 0.10 0.03 -0.25 0.00 0.09 0.00 0.00 57.88 57.85 1h2h h LEU 234 Cb 0.25 -0.15 -0.15 0.00 0.09 0.00 0.00 40.66 40.71 1h2h h LEU 234 CO 0.00 0.50 0.14 -0.62 0.09 0.00 0.00 178.44 178.56 1h2h n GLU 235 N -4.57 2.25 -4.36 1.13 -0.58 -0.92 -5.03 120.64 108.56 1h2h n GLU 235 Ca 0.17 -3.10 -0.26 0.00 -0.42 0.00 0.00 57.16 53.55 1h2h n GLU 235 Cb 0.33 -1.95 -0.10 0.00 -0.57 0.00 0.00 31.44 29.15 1h2h n GLU 235 CO 0.00 0.00 0.00 0.45 -0.48 0.00 0.00 177.13 177.10 1h2h s SER 236 N -2.02 3.91 0.03 1.62 0.15 -0.95 -5.03 113.70 111.42 1h2h s SER 236 Ca 0.48 -0.73 0.22 0.00 0.70 0.00 0.00 55.95 56.62 1h2h s SER 236 Cb 0.42 -0.52 -0.09 0.00 -1.71 0.00 0.00 66.02 64.13 1h2h s SER 236 CO 0.05 0.10 0.88 0.29 1.20 0.00 0.00 173.24 175.76 1h2h n LYS 237 N -0.01 0.35 -3.87 5.44 5.02 -1.26 -4.78 118.16 119.04 1h2h n LYS 237 Ca -0.10 -0.04 -0.35 0.00 -2.02 0.00 0.00 58.31 55.79 1h2h n LYS 237 Cb 0.56 -1.58 -0.13 0.00 -0.02 0.00 0.00 35.03 33.87 1h2h n LYS 237 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1h2h s ILE 238 N -3.25 3.05 -0.16 -0.18 -1.09 -1.26 -5.09 121.20 113.22 1h2h s ILE 238 Ca 0.01 -1.68 -0.01 0.00 -2.23 0.00 0.00 60.65 56.75 1h2h s ILE 238 Cb 0.14 -2.90 -0.01 0.00 -1.58 0.00 0.00 42.46 38.11 1h2h s ILE 238 CO 0.84 -0.34 -0.11 -0.63 -1.23 0.00 0.00 174.94 173.47 1h2h s ILE 239 N 1.19 3.09 0.11 2.92 1.09 -1.26 -5.01 121.20 123.33 1h2h s ILE 239 Ca 0.01 -0.63 0.06 0.00 -1.10 0.00 0.00 60.65 58.99 1h2h s ILE 239 Cb -0.21 -2.33 -0.04 0.00 -1.06 0.00 0.00 42.46 38.82 1h2h s ILE 239 CO -0.03 0.50 -0.02 -0.36 -0.10 0.00 0.00 174.94 174.93 1h2h s PHE 240 N 0.69 2.91 0.00 3.97 0.08 -1.26 -5.26 117.98 119.11 1h2h s PHE 240 Ca -0.06 -0.08 0.00 0.00 0.12 0.00 0.00 56.93 56.92 1h2h s PHE 240 Cb -0.15 -1.48 0.00 0.00 -0.57 0.00 0.00 43.02 40.82 1h2h s PHE 240 CO 0.02 0.48 0.00 0.41 -0.10 0.00 0.00 175.22 176.03