#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hdj s LEU 2 N 0.00 4.36 -0.16 0.00 1.43 -1.26 -5.17 118.68 117.88 3hdj s LEU 2 Ca 0.00 0.81 0.01 0.00 -1.03 0.00 0.00 54.13 53.92 3hdj s LEU 2 Cb 0.00 -2.57 0.01 0.00 0.03 0.00 0.00 46.19 43.66 3hdj s LEU 2 CO 0.00 0.17 -0.18 -2.28 0.23 0.00 0.00 176.35 174.29 3hdj s HIS 3 N -0.20 2.74 -0.33 0.29 2.46 -1.26 -0.79 115.29 118.21 3hdj s HIS 3 Ca 0.23 -1.29 -0.16 0.00 0.47 0.00 0.00 55.06 54.31 3hdj s HIS 3 Cb -0.15 -1.88 -0.01 0.00 -0.13 0.00 0.00 32.58 30.41 3hdj s HIS 3 CO 0.10 -0.61 0.41 0.42 -2.47 0.00 0.00 174.74 172.60 3hdj s ILE 4 N 0.95 5.12 0.48 0.89 1.01 0.57 -4.98 121.20 125.25 3hdj s ILE 4 Ca -0.03 0.25 0.06 0.00 0.00 0.00 0.00 60.65 60.94 3hdj s ILE 4 Cb -0.15 -3.84 0.03 0.00 0.01 0.00 0.00 42.46 38.51 3hdj s ILE 4 CO -0.04 -0.08 0.66 1.51 0.00 0.00 0.00 174.94 176.99 3hdj s ASP 5 N 1.72 5.46 0.26 3.58 1.47 -1.26 -0.57 116.67 127.33 3hdj s ASP 5 Ca 0.15 -0.39 -0.02 0.00 1.18 0.00 0.00 52.55 53.47 3hdj s ASP 5 Cb -0.16 -0.56 0.47 0.00 -0.34 0.00 0.00 42.92 42.33 3hdj s ASP 5 CO 0.12 -0.95 1.83 0.44 0.68 0.00 0.00 175.17 177.28 3hdj h ASP 6 N 0.42 0.84 0.00 2.11 3.32 -1.98 -1.57 116.42 119.57 3hdj h ASP 6 Ca -0.39 0.04 0.00 0.00 0.02 0.00 0.00 57.03 56.70 3hdj h ASP 6 Cb 1.28 -0.13 0.00 0.00 0.22 0.00 0.00 39.33 40.71 3hdj h ASP 6 CO 0.46 0.48 0.00 0.00 -1.72 0.00 0.00 179.24 178.45 3hdj n ALA 7 N -2.36 1.66 0.00 3.45 0.00 -1.26 -0.68 120.51 121.32 3hdj n ALA 7 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.60 3hdj n ALA 7 Cb 0.30 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.75 3hdj n ALA 7 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 3hdj n ILE 9 N 0.82 0.00 -0.24 0.00 2.08 -0.59 -2.70 119.36 118.74 3hdj n ILE 9 Ca 0.00 0.00 0.04 0.00 0.56 0.00 0.00 62.75 63.35 3hdj n ILE 9 Cb 0.10 0.00 0.17 0.00 -0.75 0.00 0.00 39.64 39.16 3hdj n ILE 9 CO 0.00 0.00 0.00 -0.33 0.56 0.00 0.00 176.55 176.78 3hdj h GLU 10 N 0.00 0.32 0.01 0.38 5.08 -1.17 -1.85 114.58 117.35 3hdj h GLU 10 Ca 0.00 -0.02 -0.24 0.00 -1.00 0.00 0.00 59.36 58.10 3hdj h GLU 10 Cb 0.00 -0.07 -0.03 0.00 0.50 0.00 0.00 28.75 29.14 3hdj h GLU 10 CO 0.00 0.21 -1.24 -0.44 -1.00 0.00 0.00 179.01 176.54 3hdj h ASP 11 N 0.33 0.02 1.14 1.42 3.32 -1.79 -3.38 116.42 117.48 3hdj h ASP 11 Ca 0.39 -0.03 -0.12 0.00 0.02 0.00 0.00 57.03 57.29 3hdj h ASP 11 Cb 0.62 -0.01 -0.02 0.00 0.22 0.00 0.00 39.33 40.15 3hdj h ASP 11 CO -0.45 1.02 -0.91 0.00 -1.72 0.00 0.00 179.24 177.19 3hdj h ALA 12 N 0.97 0.66 -3.51 3.45 0.00 -1.68 -3.45 119.26 115.70 3hdj h ALA 12 Ca -0.10 -0.59 -0.64 0.00 0.00 0.00 0.00 54.91 53.58 3hdj h ALA 12 Cb 1.86 0.07 -0.37 0.00 0.00 0.00 0.00 17.79 19.35 3hdj h ALA 12 CO 0.12 0.71 -0.81 0.08 0.00 0.00 0.00 179.25 179.34 3hdj s VAL 13 N -2.97 1.83 0.46 0.00 1.01 -0.75 -4.95 120.40 115.02 3hdj s VAL 13 Ca 0.01 -1.18 -0.08 0.00 0.00 0.00 0.00 61.98 60.73 3hdj s VAL 13 Cb 0.08 -1.89 -0.05 0.00 0.00 0.00 0.00 36.38 34.52 3hdj s VAL 13 CO 0.78 0.14 0.79 0.42 0.00 0.00 0.00 175.10 177.23 3hdj s THR 14 N 1.30 4.85 0.24 3.92 -4.23 -1.26 -4.83 115.64 115.63 3hdj s THR 14 Ca -0.03 0.40 -0.05 0.00 -1.18 0.00 0.00 61.69 60.83 3hdj s THR 14 Cb -0.17 -3.81 0.20 0.00 1.34 0.00 0.00 72.50 70.06 3hdj s THR 14 CO -0.08 -0.73 1.80 -0.65 -0.54 0.00 0.00 174.62 174.43 3hdj h PRO 15 N 0.62 0.73 -0.24 3.99 0.11 -1.98 -0.69 132.00 134.55 3hdj h PRO 15 Ca -0.47 -0.04 -0.15 0.00 0.11 0.00 0.00 66.00 65.45 3hdj h PRO 15 Cb 1.20 -0.16 -0.01 0.00 0.11 0.00 0.00 31.00 32.13 3hdj h PRO 15 CO 0.63 0.48 -0.47 1.96 -0.21 0.00 0.00 178.00 180.39 3hdj h GLN 16 N 0.75 0.62 -0.75 1.05 4.20 -1.99 -0.53 115.11 118.45 3hdj h GLN 16 Ca 0.38 -0.35 0.00 0.00 0.06 0.00 0.00 58.65 58.75 3hdj h GLN 16 Cb 0.34 0.02 -0.04 0.00 0.30 0.00 0.00 27.48 28.11 3hdj h GLN 16 CO -0.24 0.95 0.49 0.00 -0.67 0.00 0.00 178.83 179.36 3hdj h ALA 17 N 0.99 0.95 -0.53 3.87 0.00 -1.88 -2.03 119.26 120.63 3hdj h ALA 17 Ca 0.03 -0.06 0.01 0.00 0.00 0.00 0.00 54.91 54.89 3hdj h ALA 17 Cb 1.00 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 18.46 3hdj h ALA 17 CO 0.09 0.38 0.35 0.00 0.00 0.00 0.00 179.25 180.07 3hdj h ALA 18 N 1.27 0.67 -0.71 0.00 0.00 -0.64 -0.69 119.26 119.16 3hdj h ALA 18 Ca 0.27 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 55.15 3hdj h ALA 18 Cb -0.10 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.45 3hdj h ALA 18 CO -0.06 0.10 0.44 1.96 0.00 0.00 0.00 179.25 181.70 3hdj h GLN 19 N 0.71 0.96 -0.55 0.00 4.20 -0.87 -0.53 115.11 119.03 3hdj h GLN 19 Ca 0.20 -0.08 -0.04 0.00 0.06 0.00 0.00 58.65 58.78 3hdj h GLN 19 Cb -0.07 -0.21 -0.02 0.00 0.30 0.00 0.00 27.48 27.48 3hdj h GLN 19 CO -0.05 0.67 0.18 0.93 -0.67 0.00 0.00 178.83 179.89 3hdj h GLU 20 N 0.97 0.86 -0.35 1.46 4.39 -0.84 0.61 114.58 121.67 3hdj h GLU 20 Ca 0.26 -0.18 -0.09 0.00 0.34 0.00 0.00 59.36 59.68 3hdj h GLU 20 Cb -0.05 -0.13 -0.01 0.00 -0.10 0.00 0.00 28.75 28.46 3hdj h GLU 20 CO -0.05 0.78 -0.14 0.28 -1.16 0.00 0.00 179.01 178.71 3hdj h VAL 21 N 0.77 1.28 -0.26 3.13 2.07 -0.91 -1.43 116.25 120.90 3hdj h VAL 21 Ca 0.18 -1.25 -0.18 0.00 0.82 0.00 0.00 66.70 66.27 3hdj h VAL 21 Cb 0.27 1.35 -0.00 0.00 -1.52 0.00 0.00 31.29 31.39 3hdj h VAL 21 CO -0.01 0.41 -0.55 -0.07 0.02 0.00 0.00 177.57 177.38 3hdj h LEU 22 N 0.50 0.88 -0.23 2.57 3.38 -1.00 -1.91 115.31 119.51 3hdj h LEU 22 Ca 0.08 -0.47 0.03 0.00 0.09 0.00 0.00 57.88 57.61 3hdj h LEU 22 Cb 0.67 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 41.15 3hdj h LEU 22 CO 0.05 1.25 0.06 -0.74 0.09 0.00 0.00 178.44 179.15 3hdj h HIS 23 N 0.61 0.11 -0.76 1.13 2.76 -0.77 0.13 115.15 118.37 3hdj h HIS 23 Ca 0.01 0.01 -0.05 0.00 -2.20 0.00 0.00 60.37 58.15 3hdj h HIS 23 Cb 1.14 -0.02 -0.03 0.00 1.55 0.00 0.00 27.41 30.05 3hdj h HIS 23 CO 0.06 0.05 0.29 0.00 -1.30 0.00 0.00 177.93 177.03 3hdj h ALA 24 N 1.15 1.08 -0.34 5.26 0.00 -1.11 -1.50 119.26 123.80 3hdj h ALA 24 Ca 0.10 -0.20 -0.05 0.00 0.00 0.00 0.00 54.91 54.76 3hdj h ALA 24 Cb 0.08 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.56 3hdj h ALA 24 CO -0.11 0.65 0.00 0.00 0.00 0.00 0.00 179.25 179.78 3hdj h ALA 25 N 1.21 0.46 -0.59 0.00 0.00 -1.06 -1.58 119.26 117.70 3hdj h ALA 25 Ca 0.25 -0.24 -0.02 0.00 0.00 0.00 0.00 54.91 54.90 3hdj h ALA 25 Cb 0.23 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 17.86 3hdj h ALA 25 CO -0.02 0.22 0.28 0.74 0.00 0.00 0.00 179.25 180.46 3hdj h PHE 26 N 0.41 0.82 -0.62 0.00 0.04 -0.74 -0.67 116.94 116.18 3hdj h PHE 26 Ca 0.10 -0.03 -0.07 0.00 2.80 0.00 0.00 57.97 60.77 3hdj h PHE 26 Cb 0.45 -0.26 -0.02 0.00 2.20 0.00 0.00 35.95 38.31 3hdj h PHE 26 CO 0.04 0.61 0.11 -0.07 -0.60 0.00 0.00 178.31 178.40 3hdj h LEU 27 N 0.83 0.97 -0.54 1.54 3.38 -1.04 -0.32 115.31 120.13 3hdj h LEU 27 Ca 0.20 -0.25 0.02 0.00 0.09 0.00 0.00 57.88 57.94 3hdj h LEU 27 Cb 0.10 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.56 3hdj h LEU 27 CO -0.03 0.98 0.34 0.44 0.09 0.00 0.00 178.44 180.27 3hdj h ASP 28 N 0.93 0.58 -0.66 -0.43 5.19 -0.97 -1.61 116.42 119.44 3hdj h ASP 28 Ca 0.19 -0.01 0.03 0.00 -0.62 0.00 0.00 57.03 56.62 3hdj h ASP 28 Cb 0.41 -0.13 -0.04 0.00 0.18 0.00 0.00 39.33 39.75 3hdj h ASP 28 CO 0.01 0.41 0.41 0.15 -3.12 0.00 0.00 179.24 177.10 3hdj h PHE 29 N 0.69 0.77 -0.08 4.55 3.57 -0.67 -0.39 116.94 125.37 3hdj h PHE 29 Ca 0.21 0.02 -0.05 0.00 3.53 0.00 0.00 57.97 61.68 3hdj h PHE 29 Cb -0.03 -0.25 -0.01 0.00 2.79 0.00 0.00 35.95 38.45 3hdj h PHE 29 CO -0.05 0.45 -0.16 0.78 -2.23 0.00 0.00 178.31 177.09 3hdj h GLY 30 N 0.81 0.14 0.98 2.40 0.00 -0.64 -1.98 103.07 104.78 3hdj h GLY 30 Ca 0.26 -0.09 0.00 0.00 0.00 0.00 0.00 47.33 47.51 3hdj h GLY 30 CO -0.10 0.08 -0.12 0.54 0.00 0.00 0.00 176.54 176.94 3hdj n ARG 31 N -4.28 0.62 -1.13 4.80 1.74 -0.64 -4.93 116.66 112.83 3hdj n ARG 31 Ca -0.01 -0.21 -0.04 0.00 -0.77 0.00 0.00 57.85 56.82 3hdj n ARG 31 Cb 0.27 -1.50 -0.02 0.00 -1.02 0.00 0.00 32.46 30.19 3hdj n ARG 31 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3hdj n GLY 32 N 1.30 0.71 0.89 -0.13 0.00 -0.74 -4.92 105.19 102.30 3hdj n GLY 32 Ca 0.14 -0.65 0.12 0.00 0.00 0.00 0.00 46.02 45.63 3hdj n GLY 32 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3hdj n SER 33 N 0.83 2.79 -4.17 1.61 3.41 -0.20 -4.87 113.62 113.01 3hdj n SER 33 Ca -0.04 -1.92 -0.12 0.00 -0.26 0.00 0.00 58.87 56.52 3hdj n SER 33 Cb 0.17 0.02 -0.10 0.00 -0.26 0.00 0.00 64.21 64.04 3hdj n SER 33 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3hdj s ALA 34 N -2.02 1.05 0.00 7.33 0.00 -1.15 -4.30 121.76 122.67 3hdj s ALA 34 Ca 0.29 -1.28 0.00 0.00 0.00 0.00 0.00 51.96 50.96 3hdj s ALA 34 Cb 0.20 0.10 0.00 0.00 0.00 0.00 0.00 23.12 23.42 3hdj s ALA 34 CO 0.32 -0.15 0.00 0.00 0.00 0.00 0.00 175.76 175.93 3hdj n ALA 35 N 0.20 0.00 -3.47 0.00 0.00 -0.49 -4.51 120.51 112.24 3hdj n ALA 35 Ca -0.14 0.00 -0.25 0.00 0.00 0.00 0.00 53.44 53.05 3hdj n ALA 35 Cb 0.59 0.00 -0.17 0.00 0.00 0.00 0.00 19.45 19.88 3hdj n ALA 35 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.50 176.36 3hdj s GLN 37 N -1.10 1.78 0.84 0.00 0.74 0.16 -0.78 119.66 121.30 3hdj s GLN 37 Ca 0.00 -0.44 -0.11 0.00 0.05 0.00 0.00 55.36 54.86 3hdj s GLN 37 Cb 0.00 -1.48 0.10 0.00 1.10 0.00 0.00 33.01 32.73 3hdj s GLN 37 CO 0.00 0.02 1.14 -0.98 -0.55 0.00 0.00 175.29 174.92 3hdj s ARG 38 N 0.70 1.59 0.07 1.67 1.70 -1.26 -3.13 118.95 120.28 3hdj s ARG 38 Ca -0.14 1.48 -0.31 0.00 -0.47 0.00 0.00 55.73 56.29 3hdj s ARG 38 Cb -0.16 -1.80 -0.08 0.00 -0.57 0.00 0.00 34.95 32.35 3hdj s ARG 38 CO 0.03 -2.20 1.48 0.50 -1.08 0.00 0.00 175.30 174.03 3hdj s ARG 39 N -4.58 4.27 -0.03 3.89 3.52 -1.26 -4.50 118.95 120.25 3hdj s ARG 39 Ca 0.66 2.14 0.05 0.00 -0.13 0.00 0.00 55.73 58.45 3hdj s ARG 39 Cb -0.22 -3.42 -0.01 0.00 -1.56 0.00 0.00 34.95 29.74 3hdj s ARG 39 CO 0.55 -0.57 -0.19 0.08 -0.81 0.00 0.00 175.30 174.35 3hdj s VAL 40 N 1.87 1.58 -0.02 7.11 1.01 -0.42 -4.97 120.40 126.56 3hdj s VAL 40 Ca 0.67 -0.82 0.07 0.00 0.00 0.00 0.00 61.98 61.91 3hdj s VAL 40 Cb -0.37 -1.33 -0.02 0.00 0.00 0.00 0.00 36.38 34.66 3hdj s VAL 40 CO 0.30 0.45 -0.24 -0.13 0.00 0.00 0.00 175.10 175.47 3hdj s ARG 41 N -0.19 1.96 0.02 2.72 0.52 -1.26 -1.19 118.95 121.53 3hdj s ARG 41 Ca 0.01 -0.86 0.04 0.00 -0.52 0.00 0.00 55.73 54.40 3hdj s ARG 41 Cb -0.10 -1.89 -0.02 0.00 0.52 0.00 0.00 34.95 33.46 3hdj s ARG 41 CO 0.01 0.51 -0.13 0.99 0.02 0.00 0.00 175.30 176.71 3hdj s THR 42 N -0.55 0.99 -0.07 0.02 2.01 0.67 -4.98 115.64 113.73 3hdj s THR 42 Ca 0.09 -0.76 -0.06 0.00 0.31 0.00 0.00 61.69 61.27 3hdj s THR 42 Cb -0.09 -0.87 0.02 0.00 0.01 0.00 0.00 72.50 71.57 3hdj s THR 42 CO -0.01 0.11 0.18 -0.70 -0.69 0.00 0.00 174.62 173.51 3hdj s GLU 43 N -0.75 0.20 -0.13 4.92 2.12 -1.26 0.16 118.70 123.96 3hdj s GLU 43 Ca 0.02 0.27 -0.23 0.00 0.36 0.00 0.00 54.97 55.40 3hdj s GLU 43 Cb -0.06 0.07 0.05 0.00 0.26 0.00 0.00 34.13 34.45 3hdj s GLU 43 CO 0.00 -0.04 0.56 0.00 -0.54 0.00 0.00 175.26 175.25 3hdj s ALA 44 N 0.24 -1.43 -1.51 6.30 0.00 -0.81 -4.96 121.76 119.60 3hdj s ALA 44 Ca -0.01 1.31 -0.00 0.00 0.00 0.00 0.00 51.96 53.25 3hdj s ALA 44 Cb -0.03 -0.47 0.00 0.00 0.00 0.00 0.00 23.12 22.62 3hdj s ALA 44 CO -0.01 -0.30 0.05 0.41 0.00 0.00 0.00 175.76 175.91 3hdj n GLY 45 N 1.92 -0.50 2.34 0.00 0.00 -1.26 -0.95 105.19 106.74 3hdj n GLY 45 Ca -0.17 0.01 0.00 0.00 0.00 0.00 0.00 46.02 45.86 3hdj n GLY 45 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hdj n GLY 46 N -0.98 0.42 3.39 -0.02 0.00 -1.26 -5.01 105.19 101.73 3hdj n GLY 46 Ca -0.20 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.48 3hdj n GLY 46 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3hdj s VAL 47 N -1.90 3.58 -0.03 1.61 1.01 -0.12 -4.49 120.40 120.06 3hdj s VAL 47 Ca 0.00 -0.44 -0.02 0.00 0.00 0.00 0.00 61.98 61.52 3hdj s VAL 47 Cb 0.00 -2.60 -0.04 0.00 0.00 0.00 0.00 36.38 33.74 3hdj s VAL 47 CO 0.00 0.45 0.09 -0.54 0.00 0.00 0.00 175.10 175.10 3hdj s LYS 48 N 1.00 3.15 -0.08 2.72 1.02 -0.39 -1.92 119.74 125.24 3hdj s LYS 48 Ca 0.00 -0.41 0.03 0.00 0.02 0.00 0.00 55.97 55.61 3hdj s LYS 48 Cb -0.15 -2.92 0.01 0.00 -0.52 0.00 0.00 37.83 34.25 3hdj s LYS 48 CO 0.01 0.67 -0.17 -1.17 -0.92 0.00 0.00 175.35 173.77 3hdj s LEU 49 N -1.60 1.81 0.08 3.17 2.96 0.12 -1.07 118.68 124.15 3hdj s LEU 49 Ca 0.22 -0.40 0.08 0.00 -0.22 0.00 0.00 54.13 53.81 3hdj s LEU 49 Cb -0.12 -1.05 -0.03 0.00 0.50 0.00 0.00 46.19 45.49 3hdj s LEU 49 CO 0.12 0.08 -0.22 -0.44 -1.32 0.00 0.00 176.35 174.57 3hdj s SER 50 N 0.56 2.68 0.06 3.68 0.01 0.08 -0.24 113.70 120.53 3hdj s SER 50 Ca -0.16 -0.62 0.02 0.00 1.31 0.00 0.00 55.95 56.50 3hdj s SER 50 Cb -0.17 -0.19 -0.03 0.00 0.21 0.00 0.00 66.02 65.85 3hdj s SER 50 CO 0.05 0.13 -0.08 0.42 0.41 0.00 0.00 173.24 174.18 3hdj s THR 51 N -0.98 0.60 0.27 1.44 -4.23 -0.33 -1.77 115.64 110.64 3hdj s THR 51 Ca 0.08 -1.31 -0.19 0.00 -1.18 0.00 0.00 61.69 59.09 3hdj s THR 51 Cb -0.10 -0.90 0.01 0.00 1.34 0.00 0.00 72.50 72.86 3hdj s THR 51 CO 0.03 -0.50 0.67 -1.48 -0.54 0.00 0.00 174.62 172.80 3hdj s LEU 52 N -1.96 -0.13 0.00 4.79 2.34 -0.79 -1.30 118.68 121.64 3hdj s LEU 52 Ca -0.04 -0.68 0.00 0.00 0.06 0.00 0.00 54.13 53.47 3hdj s LEU 52 Cb -0.06 2.52 0.00 0.00 -0.56 0.00 0.00 46.19 48.09 3hdj s LEU 52 CO -0.01 -1.30 0.00 0.61 -1.06 0.00 0.00 176.35 174.59 3hdj n GLY 53 N -0.44 -0.68 3.50 -3.48 0.00 -1.19 -0.69 105.19 102.21 3hdj n GLY 53 Ca -0.04 -0.65 -0.09 0.00 0.00 0.00 0.00 46.02 45.25 3hdj n GLY 53 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hdj s ALA 54 N -1.00 -1.80 -0.14 4.61 0.00 -0.33 -0.66 121.76 122.44 3hdj s ALA 54 Ca 0.00 0.98 0.01 0.00 0.00 0.00 0.00 51.96 52.95 3hdj s ALA 54 Cb 0.00 0.42 0.02 0.00 0.00 0.00 0.00 23.12 23.56 3hdj s ALA 54 CO 0.00 -0.68 -0.14 0.08 0.00 0.00 0.00 175.76 175.02 3hdj s VAL 55 N -3.09 1.55 -0.49 0.00 1.01 0.04 -0.96 120.40 118.45 3hdj s VAL 55 Ca 0.04 -0.63 0.06 0.00 0.00 0.00 0.00 61.98 61.45 3hdj s VAL 55 Cb -0.01 -1.45 0.21 0.00 0.00 0.00 0.00 36.38 35.14 3hdj s VAL 55 CO -0.09 0.45 0.50 -0.38 0.00 0.00 0.00 175.10 175.59 3hdj n ILE 56 N 4.62 0.05 0.24 2.22 5.41 0.07 -1.40 119.36 130.57 3hdj n ILE 56 Ca -0.17 -4.18 0.07 0.00 1.00 0.00 0.00 62.75 59.47 3hdj n ILE 56 Cb 0.50 -1.92 0.57 0.00 -0.71 0.00 0.00 39.64 38.08 3hdj n ILE 56 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 176.55 175.90 3hdj h PRO 57 N 4.75 0.00 0.00 0.38 0.11 -1.75 -0.56 132.00 134.94 3hdj h PRO 57 Ca 0.17 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 66.28 3hdj h PRO 57 Cb 0.83 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.94 3hdj h PRO 57 CO 0.54 0.16 -0.00 0.78 -0.21 0.00 0.00 178.00 179.27 3hdj h GLY 58 N 0.57 0.00 -0.31 -0.55 0.00 -1.92 -0.99 103.07 99.87 3hdj h GLY 58 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 3hdj h GLY 58 CO 0.02 0.00 0.00 -1.06 0.00 0.00 0.00 176.54 175.50 3hdj n GLN 59 N -3.14 2.73 -1.25 4.80 6.02 -0.27 -5.01 117.38 121.26 3hdj n GLN 59 Ca -0.03 -1.81 -0.09 0.00 -0.01 0.00 0.00 57.00 55.06 3hdj n GLN 59 Cb 0.08 -1.16 -0.04 0.00 1.02 0.00 0.00 30.24 30.15 3hdj n GLN 59 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3hdj n GLY 60 N -0.45 1.03 3.14 1.08 0.00 -0.38 -4.95 105.19 104.67 3hdj n GLY 60 Ca 0.05 -0.49 -0.11 0.00 0.00 0.00 0.00 46.02 45.48 3hdj n GLY 60 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3hdj s VAL 61 N -2.25 0.64 0.05 1.61 -7.23 -1.09 -1.14 120.40 110.99 3hdj s VAL 61 Ca 0.00 -1.70 -0.03 0.00 -1.81 0.00 0.00 61.98 58.43 3hdj s VAL 61 Cb 0.00 -1.39 -0.02 0.00 0.56 0.00 0.00 36.38 35.52 3hdj s VAL 61 CO 0.00 -0.75 0.04 0.00 -0.31 0.00 0.00 175.10 174.09 3hdj s ALA 62 N -3.03 0.21 -0.02 1.32 0.00 -0.62 -0.75 121.76 118.86 3hdj s ALA 62 Ca 0.06 -0.91 -0.29 0.00 0.00 0.00 0.00 51.96 50.82 3hdj s ALA 62 Cb 0.01 0.30 0.11 0.00 0.00 0.00 0.00 23.12 23.54 3hdj s ALA 62 CO -0.04 -0.37 1.30 0.20 0.00 0.00 0.00 175.76 176.85 3hdj s GLY 63 N -2.64 -0.25 0.00 0.00 0.00 -0.14 0.18 107.32 104.47 3hdj s GLY 63 Ca 0.03 0.33 -0.05 0.00 0.00 0.00 0.00 44.72 45.03 3hdj s GLY 63 CO -0.08 3.34 0.08 0.00 0.00 0.00 0.00 173.10 176.44 3hdj s ALA 64 N -2.15 -0.18 -0.14 3.20 0.00 -0.79 -1.19 121.76 120.51 3hdj s ALA 64 Ca 0.23 -0.23 -0.02 0.00 0.00 0.00 0.00 51.96 51.94 3hdj s ALA 64 Cb 0.02 0.09 -0.03 0.00 0.00 0.00 0.00 23.12 23.21 3hdj s ALA 64 CO -0.02 -0.17 -0.06 0.21 0.00 0.00 0.00 175.76 175.72 3hdj s LYS 65 N -1.24 3.51 -0.02 0.00 2.20 0.13 -0.57 119.74 123.75 3hdj s LYS 65 Ca -0.13 -0.55 0.04 0.00 -0.36 0.00 0.00 55.97 54.97 3hdj s LYS 65 Cb -0.08 -2.82 -0.01 0.00 -1.51 0.00 0.00 37.83 33.41 3hdj s LYS 65 CO 0.01 0.29 -0.14 0.08 -0.36 0.00 0.00 175.35 175.23 3hdj s VAL 66 N 0.21 1.13 -0.04 4.02 1.01 0.28 -1.88 120.40 125.12 3hdj s VAL 66 Ca -0.03 -0.59 -0.22 0.00 0.00 0.00 0.00 61.98 61.14 3hdj s VAL 66 Cb -0.14 -0.95 0.04 0.00 0.00 0.00 0.00 36.38 35.33 3hdj s VAL 66 CO 0.03 0.32 0.48 -0.72 0.00 0.00 0.00 175.10 175.22 3hdj s TYR 67 N -0.19 -0.41 0.21 5.22 -0.85 -0.73 -0.87 117.35 119.73 3hdj s TYR 67 Ca 0.03 0.71 -0.08 0.00 -0.52 0.00 0.00 57.07 57.21 3hdj s TYR 67 Cb -0.07 0.24 -0.07 0.00 0.38 0.00 0.00 41.96 42.44 3hdj s TYR 67 CO 0.00 -0.47 0.51 0.95 -1.52 0.00 0.00 175.55 175.01 3hdj s THR 68 N -1.15 4.99 -0.13 -3.49 -4.23 -0.63 -0.74 115.64 110.25 3hdj s THR 68 Ca -0.11 0.37 0.02 0.00 -1.18 0.00 0.00 61.69 60.78 3hdj s THR 68 Cb -0.03 -3.62 0.02 0.00 1.34 0.00 0.00 72.50 70.21 3hdj s THR 68 CO 0.06 -0.04 -0.17 -0.89 -0.54 0.00 0.00 174.62 173.04 3hdj s THR 69 N -1.78 1.74 -0.05 3.99 2.01 -0.24 -1.86 115.64 119.45 3hdj s THR 69 Ca 0.46 -0.77 -0.00 0.00 0.31 0.00 0.00 61.69 61.69 3hdj s THR 69 Cb -0.11 -1.58 0.03 0.00 0.01 0.00 0.00 72.50 70.84 3hdj s THR 69 CO 0.22 0.49 -0.01 -0.63 -0.69 0.00 0.00 174.62 174.00 3hdj s ILE 70 N 1.09 0.37 -1.57 1.82 1.01 -0.37 -1.26 121.20 122.28 3hdj s ILE 70 Ca -0.03 0.06 -0.12 0.00 0.00 0.00 0.00 60.65 60.56 3hdj s ILE 70 Cb -0.14 -0.48 0.09 0.00 0.01 0.00 0.00 42.46 41.94 3hdj s ILE 70 CO -0.05 0.23 0.74 0.29 0.00 0.00 0.00 174.94 176.14 3hdj n LYS 71 N 4.64 -3.86 -0.92 2.79 5.02 -1.26 -1.40 118.16 123.18 3hdj n LYS 71 Ca -0.16 0.45 0.00 0.00 -2.02 0.00 0.00 58.31 56.58 3hdj n LYS 71 Cb 0.50 -5.05 0.00 0.00 -0.02 0.00 0.00 35.03 30.46 3hdj n LYS 71 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3hdj n GLY 72 N -1.63 0.49 3.71 0.72 0.00 -1.26 -5.01 105.19 102.21 3hdj n GLY 72 Ca -0.05 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.64 3hdj n GLY 72 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3hdj s GLN 73 N -0.51 2.87 -0.01 1.61 -1.52 -0.49 -5.07 119.66 116.53 3hdj s GLN 73 Ca 0.00 -0.57 0.04 0.00 -1.95 0.00 0.00 55.36 52.88 3hdj s GLN 73 Cb 0.00 -2.72 -0.03 0.00 -0.22 0.00 0.00 33.01 30.04 3hdj s GLN 73 CO 0.00 0.64 -0.12 -0.06 -0.25 0.00 0.00 175.29 175.49 3hdj s PHE 74 N -1.10 2.74 -0.09 0.91 0.08 -1.26 -1.24 117.98 118.02 3hdj s PHE 74 Ca 0.20 -0.13 -0.00 0.00 0.12 0.00 0.00 56.93 57.12 3hdj s PHE 74 Cb -0.12 -1.59 0.02 0.00 -0.57 0.00 0.00 43.02 40.77 3hdj s PHE 74 CO 0.10 0.27 -0.07 -0.65 -0.10 0.00 0.00 175.22 174.77 3hdj s GLN 75 N -1.11 1.38 0.04 0.44 -0.21 -0.78 -4.98 119.66 114.45 3hdj s GLN 75 Ca 0.14 -0.22 0.06 0.00 0.02 0.00 0.00 55.36 55.35 3hdj s GLN 75 Cb -0.11 -1.42 -0.03 0.00 1.00 0.00 0.00 33.01 32.45 3hdj s GLN 75 CO 0.04 -0.21 -0.11 -0.06 -2.12 0.00 0.00 175.29 172.82 3hdj s PHE 76 N 1.52 2.74 -0.04 0.91 0.08 -1.26 -1.60 117.98 120.33 3hdj s PHE 76 Ca 0.01 -0.14 0.01 0.00 0.12 0.00 0.00 56.93 56.93 3hdj s PHE 76 Cb -0.13 -1.51 0.02 0.00 -0.57 0.00 0.00 43.02 40.83 3hdj s PHE 76 CO -0.05 0.35 -0.04 0.08 -0.10 0.00 0.00 175.22 175.45 3hdj s VAL 77 N -1.04 0.50 -0.16 -0.44 1.01 -0.04 -4.63 120.40 115.61 3hdj s VAL 77 Ca 0.18 -0.12 -0.07 0.00 0.00 0.00 0.00 61.98 61.96 3hdj s VAL 77 Cb -0.11 -0.52 -0.04 0.00 0.00 0.00 0.00 36.38 35.71 3hdj s VAL 77 CO 0.09 0.21 0.08 -0.63 0.00 0.00 0.00 175.10 174.84 3hdj s ILE 78 N 0.80 4.94 -0.13 2.22 1.01 -0.77 -0.56 121.20 128.71 3hdj s ILE 78 Ca -0.10 0.01 0.03 0.00 0.00 0.00 0.00 60.65 60.58 3hdj s ILE 78 Cb -0.13 -3.19 0.01 0.00 0.01 0.00 0.00 42.46 39.15 3hdj s ILE 78 CO 0.00 0.51 -0.22 -0.22 0.00 0.00 0.00 174.94 175.01 3hdj s LEU 79 N -0.09 2.07 -0.09 2.97 2.96 0.27 -0.78 118.68 126.00 3hdj s LEU 79 Ca 0.07 -0.58 -0.01 0.00 -0.22 0.00 0.00 54.13 53.40 3hdj s LEU 79 Cb -0.12 -1.40 -0.03 0.00 0.50 0.00 0.00 46.19 45.14 3hdj s LEU 79 CO 0.01 0.09 -0.04 -0.76 -1.32 0.00 0.00 176.35 174.33 3hdj s LEU 80 N 0.74 3.30 0.17 -0.68 1.43 -0.22 -1.89 118.68 121.53 3hdj s LEU 80 Ca -0.09 0.00 0.09 0.00 -1.03 0.00 0.00 54.13 53.10 3hdj s LEU 80 Cb -0.16 -1.74 -0.04 0.00 0.03 0.00 0.00 46.19 44.27 3hdj s LEU 80 CO 0.00 0.33 -0.20 -0.36 0.23 0.00 0.00 176.35 176.35 3hdj s PHE 81 N -0.60 1.94 0.06 0.29 0.08 0.13 0.07 117.98 119.95 3hdj s PHE 81 Ca 0.09 -0.44 -0.31 0.00 0.12 0.00 0.00 56.93 56.40 3hdj s PHE 81 Cb -0.12 -0.96 -0.06 0.00 -0.57 0.00 0.00 43.02 41.31 3hdj s PHE 81 CO 0.02 0.37 1.31 0.45 -0.10 0.00 0.00 175.22 177.27 3hdj s SER 82 N -2.65 6.94 0.32 1.36 0.15 0.33 -1.59 113.70 118.56 3hdj s SER 82 Ca 0.17 2.14 0.26 0.00 0.70 0.00 0.00 55.95 59.21 3hdj s SER 82 Cb -0.06 -2.58 0.78 0.00 -1.71 0.00 0.00 66.02 62.45 3hdj s SER 82 CO 0.07 -0.60 1.75 0.00 1.20 0.00 0.00 173.24 175.66 3hdj h ALA 83 N 7.06 1.00 0.04 5.45 0.00 -1.39 0.20 119.26 131.63 3hdj h ALA 83 Ca -0.41 0.00 -0.25 0.00 0.00 0.00 0.00 54.91 54.26 3hdj h ALA 83 Cb 1.20 0.00 0.02 0.00 0.00 0.00 0.00 17.79 19.01 3hdj h ALA 83 CO 0.85 0.00 -0.99 0.00 0.00 0.00 0.00 179.25 179.12 3hdj h ALA 84 N 2.27 0.06 0.00 0.00 0.00 -1.83 -3.40 119.26 116.36 3hdj h ALA 84 Ca 0.00 -0.69 0.00 0.00 0.00 0.00 0.00 54.91 54.22 3hdj h ALA 84 Cb 0.71 0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.58 3hdj h ALA 84 CO 0.00 0.59 0.00 -0.40 0.00 0.00 0.00 179.25 179.44 3hdj n ASP 85 N -3.94 0.60 0.00 0.00 5.68 -1.25 -5.03 116.55 112.61 3hdj n ASP 85 Ca -0.12 -1.09 0.00 0.00 -0.50 0.00 0.00 54.79 53.08 3hdj n ASP 85 Cb 0.86 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.84 3hdj n ASP 85 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3hdj n GLY 86 N -0.05 1.48 3.80 6.12 0.00 0.69 -5.00 105.19 112.22 3hdj n GLY 86 Ca 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.67 3hdj n GLY 86 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 3hdj s ARG 87 N -0.31 4.01 0.38 1.61 1.70 -1.25 -4.57 118.95 120.52 3hdj s ARG 87 Ca 0.00 1.37 -0.27 0.00 -0.47 0.00 0.00 55.73 56.36 3hdj s ARG 87 Cb 0.00 -2.27 -0.09 0.00 -0.57 0.00 0.00 34.95 32.02 3hdj s ARG 87 CO 0.00 -0.25 1.25 -2.14 -1.08 0.00 0.00 175.30 173.08 3hdj s PRO 88 N -2.95 4.14 -0.17 3.89 0.02 -1.26 -0.51 135.00 138.15 3hdj s PRO 88 Ca 0.63 2.05 -0.03 0.00 0.02 0.00 0.00 61.00 63.67 3hdj s PRO 88 Cb -0.17 -2.84 -0.09 0.00 0.02 0.00 0.00 34.50 31.42 3hdj s PRO 88 CO 0.21 -0.32 -0.18 1.28 -0.33 0.00 0.00 177.00 177.67 3hdj n LEU 89 N 0.36 2.23 -3.56 -5.54 4.77 0.11 -4.82 117.00 110.54 3hdj n LEU 89 Ca 0.03 0.04 -0.07 0.00 -0.03 0.00 0.00 56.01 55.98 3hdj n LEU 89 Cb 0.44 -0.54 -0.03 0.00 -2.33 0.00 0.00 43.42 40.96 3hdj n LEU 89 CO 0.55 0.59 0.85 0.00 -1.33 0.00 0.00 177.39 178.05 3hdj s ALA 90 N -2.32 -1.95 0.25 -1.18 0.00 -1.18 -4.31 121.76 111.06 3hdj s ALA 90 Ca -0.23 1.41 0.06 0.00 0.00 0.00 0.00 51.96 53.21 3hdj s ALA 90 Cb 0.07 -0.18 -0.03 0.00 0.00 0.00 0.00 23.12 22.98 3hdj s ALA 90 CO 0.34 -0.53 0.27 0.95 0.00 0.00 0.00 175.76 176.79 3hdj s THR 91 N -2.23 4.76 -0.10 0.00 -4.23 0.03 -1.06 115.64 112.81 3hdj s THR 91 Ca 0.05 -1.23 -0.07 0.00 -1.18 0.00 0.00 61.69 59.26 3hdj s THR 91 Cb -0.01 -3.59 0.04 0.00 1.34 0.00 0.00 72.50 70.28 3hdj s THR 91 CO -0.05 -0.34 0.26 0.00 -0.54 0.00 0.00 174.62 173.95 3hdj s ASP 93 N 0.75 4.23 -0.01 0.00 1.01 0.27 -1.85 116.67 121.07 3hdj s ASP 93 Ca -0.05 2.38 0.14 0.00 0.71 0.00 0.00 52.55 55.73 3hdj s ASP 93 Cb -0.06 -2.59 -0.19 0.00 1.01 0.00 0.00 42.92 41.08 3hdj s ASP 93 CO -0.05 -2.24 0.46 0.00 0.21 0.00 0.00 175.17 173.55 3hdj n ALA 94 N -2.64 3.19 0.37 5.23 0.00 -1.26 -4.61 120.51 120.78 3hdj n ALA 94 Ca 0.14 -0.37 -0.14 0.00 0.00 0.00 0.00 53.44 53.06 3hdj n ALA 94 Cb 0.50 -0.51 -0.07 0.00 0.00 0.00 0.00 19.45 19.37 3hdj n ALA 94 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 3hdj h GLY 95 N 3.00 -0.99 1.19 0.00 0.00 -1.95 0.32 103.07 104.64 3hdj h GLY 95 Ca 0.00 0.37 -0.12 0.00 0.00 0.00 0.00 47.33 47.57 3hdj h GLY 95 CO 0.00 -0.36 -0.20 -0.84 0.00 0.00 0.00 176.54 175.14 3hdj h THR 96 N -0.97 1.27 -0.41 4.70 2.02 -1.88 -1.95 112.91 115.70 3hdj h THR 96 Ca -0.10 -1.35 0.05 0.00 0.77 0.00 0.00 66.41 65.79 3hdj h THR 96 Cb 0.72 1.12 -0.05 0.00 -1.74 0.00 0.00 68.15 68.21 3hdj h THR 96 CO 0.16 0.46 0.13 0.25 0.37 0.00 0.00 175.52 176.89 3hdj h LEU 97 N 0.81 0.12 -0.83 2.58 6.46 -1.81 -0.83 115.31 121.81 3hdj h LEU 97 Ca 0.11 0.05 -0.10 0.00 -0.12 0.00 0.00 57.88 57.83 3hdj h LEU 97 Cb 0.75 0.04 -0.02 0.00 -0.73 0.00 0.00 40.66 40.71 3hdj h LEU 97 CO 0.06 0.10 -0.15 0.74 -0.62 0.00 0.00 178.44 178.58 3hdj h THR 98 N 0.28 1.26 -0.04 1.05 2.02 -0.71 0.11 112.91 116.87 3hdj h THR 98 Ca 0.19 -1.20 -0.00 0.00 0.77 0.00 0.00 66.41 66.17 3hdj h THR 98 Cb 0.19 1.12 -0.00 0.00 -1.74 0.00 0.00 68.15 67.71 3hdj h THR 98 CO -0.21 0.40 0.02 -0.09 0.37 0.00 0.00 175.52 176.02 3hdj h ARG 99 N 0.65 0.06 -0.44 6.66 2.43 -0.55 -0.84 114.38 122.34 3hdj h ARG 99 Ca 0.11 -0.01 -0.06 0.00 -0.81 0.00 0.00 59.98 59.21 3hdj h ARG 99 Cb 0.62 -0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 30.14 3hdj h ARG 99 CO 0.04 0.13 0.05 0.87 -1.51 0.00 0.00 179.97 179.55 3hdj h LYS 100 N -0.02 0.73 -0.38 0.20 1.57 -1.01 -3.10 116.57 114.56 3hdj h LYS 100 Ca 0.01 -0.21 -0.01 0.00 -1.87 0.00 0.00 60.65 58.58 3hdj h LYS 100 Cb 0.08 -0.08 -0.02 0.00 0.08 0.00 0.00 32.23 32.30 3hdj h LYS 100 CO -0.00 0.77 0.19 -0.09 -0.57 0.00 0.00 179.45 179.75 3hdj h ARG 101 N 0.59 0.55 -0.24 3.15 1.12 -0.55 -0.88 114.38 118.12 3hdj h ARG 101 Ca 0.13 -0.08 -0.01 0.00 -1.11 0.00 0.00 59.98 58.91 3hdj h ARG 101 Cb 0.41 -0.10 -0.01 0.00 -0.01 0.00 0.00 29.97 30.26 3hdj h ARG 101 CO 0.01 0.48 0.09 1.15 -3.11 0.00 0.00 179.97 178.59 3hdj h THR 102 N 0.48 1.17 -0.45 0.20 2.02 -1.16 -0.70 112.91 114.47 3hdj h THR 102 Ca 0.13 -0.53 -0.09 0.00 0.77 0.00 0.00 66.41 66.69 3hdj h THR 102 Cb 0.11 1.08 -0.02 0.00 -1.74 0.00 0.00 68.15 67.58 3hdj h THR 102 CO -0.02 0.18 -0.10 0.00 0.37 0.00 0.00 175.52 175.95 3hdj h ALA 103 N 0.93 0.98 -0.72 6.16 0.00 -1.51 -2.02 119.26 123.08 3hdj h ALA 103 Ca 0.08 -0.32 -0.04 0.00 0.00 0.00 0.00 54.91 54.63 3hdj h ALA 103 Cb 0.19 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.77 3hdj h ALA 103 CO -0.01 0.61 0.29 0.00 0.00 0.00 0.00 179.25 180.14 3hdj h ALA 104 N 1.15 0.93 -0.32 0.00 0.00 -0.91 0.12 119.26 120.24 3hdj h ALA 104 Ca 0.13 -0.18 -0.13 0.00 0.00 0.00 0.00 54.91 54.72 3hdj h ALA 104 Cb 0.59 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.08 3hdj h ALA 104 CO 0.04 0.56 -0.32 0.00 0.00 0.00 0.00 179.25 179.52 3hdj h THR 106 N 0.59 1.23 -0.79 0.00 2.02 -0.97 -1.21 112.91 113.78 3hdj h THR 106 Ca 0.06 -0.72 -0.03 0.00 0.77 0.00 0.00 66.41 66.50 3hdj h THR 106 Cb 0.84 0.63 -0.04 0.00 -1.74 0.00 0.00 68.15 67.84 3hdj h THR 106 CO 0.07 0.27 0.36 0.58 0.37 0.00 0.00 175.52 177.18 3hdj h VAL 107 N 0.79 1.25 -0.42 3.16 2.07 -0.50 0.22 116.25 122.81 3hdj h VAL 107 Ca 0.19 -0.73 -0.01 0.00 0.82 0.00 0.00 66.70 66.97 3hdj h VAL 107 Cb 0.21 0.26 -0.02 0.00 -1.52 0.00 0.00 31.29 30.22 3hdj h VAL 107 CO -0.01 0.31 0.22 -0.07 0.02 0.00 0.00 177.57 178.03 3hdj h LEU 108 N 1.13 0.53 -0.13 2.57 3.38 -0.80 0.97 115.31 122.97 3hdj h LEU 108 Ca 0.27 -0.10 -0.04 0.00 0.09 0.00 0.00 57.88 58.10 3hdj h LEU 108 Cb 0.14 -0.14 -0.00 0.00 0.09 0.00 0.00 40.66 40.75 3hdj h LEU 108 CO -0.03 0.48 -0.07 0.00 0.09 0.00 0.00 178.44 178.91 3hdj h ALA 109 N 1.07 0.18 -0.79 1.53 0.00 -0.93 -2.73 119.26 117.59 3hdj h ALA 109 Ca 0.15 -0.27 -0.05 0.00 0.00 0.00 0.00 54.91 54.74 3hdj h ALA 109 Cb 0.08 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 17.79 3hdj h ALA 109 CO -0.02 -0.02 0.31 0.00 0.00 0.00 0.00 179.25 179.53 3hdj h ALA 110 N 0.65 1.07 -1.00 0.00 0.00 -0.50 -0.70 119.26 118.77 3hdj h ALA 110 Ca 0.03 -0.19 0.12 0.00 0.00 0.00 0.00 54.91 54.87 3hdj h ALA 110 Cb 0.55 -0.31 -0.09 0.00 0.00 0.00 0.00 17.79 17.94 3hdj h ALA 110 CO 0.02 0.66 0.63 0.78 0.00 0.00 0.00 179.25 181.34 3hdj h GLY 111 N 1.16 1.65 1.72 0.00 0.00 -0.76 0.12 103.07 106.96 3hdj h GLY 111 Ca 0.26 -0.42 -0.21 0.00 0.00 0.00 0.00 47.33 46.96 3hdj h GLY 111 CO -0.02 0.15 -1.12 0.00 0.00 0.00 0.00 176.54 175.55 3hdj h ALA 112 N 1.55 0.50 0.00 3.60 0.00 -1.13 -3.42 119.26 120.36 3hdj h ALA 112 Ca 0.50 -0.97 0.00 0.00 0.00 0.00 0.00 54.91 54.44 3hdj h ALA 112 Cb 0.51 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.32 3hdj h ALA 112 CO -0.27 1.23 -0.91 1.28 0.00 0.00 0.00 179.25 180.57 3hdj n LEU 113 N -3.24 0.00 -4.84 0.00 4.77 -0.31 -4.94 117.00 108.44 3hdj n LEU 113 Ca -0.04 0.00 -0.31 0.00 -0.03 0.00 0.00 56.01 55.63 3hdj n LEU 113 Cb 0.93 0.00 0.04 0.00 -2.33 0.00 0.00 43.42 42.07 3hdj n LEU 113 CO 0.46 0.00 0.72 0.00 -1.33 0.00 0.00 177.39 177.23 3hdj s ALA 114 N -1.85 2.78 0.20 -1.18 0.00 0.39 -4.87 121.76 117.24 3hdj s ALA 114 Ca 0.00 -0.08 -0.31 0.00 0.00 0.00 0.00 51.96 51.57 3hdj s ALA 114 Cb 0.00 -3.11 -0.11 0.00 0.00 0.00 0.00 23.12 19.90 3hdj s ALA 114 CO 0.00 -1.12 1.62 1.03 0.00 0.00 0.00 175.76 177.29 3hdj s ARG 115 N -5.15 4.17 0.39 0.00 0.52 -1.26 -4.87 118.95 112.75 3hdj s ARG 115 Ca 0.58 2.48 0.13 0.00 -0.52 0.00 0.00 55.73 58.40 3hdj s ARG 115 Cb -0.13 -3.10 0.96 0.00 0.52 0.00 0.00 34.95 33.20 3hdj s ARG 115 CO 0.54 -0.65 1.87 -1.35 0.02 0.00 0.00 175.30 175.73 3hdj h PRO 116 N 6.43 0.52 -0.69 3.54 0.11 -1.93 -1.06 132.00 138.92 3hdj h PRO 116 Ca -0.44 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.64 3hdj h PRO 116 Cb 1.21 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 32.20 3hdj h PRO 116 CO 0.91 0.34 0.00 0.54 -0.21 0.00 0.00 178.00 179.58 3hdj n ARG 117 N -4.54 3.43 -1.54 1.05 1.74 -1.26 -4.80 116.66 110.74 3hdj n ARG 117 Ca 0.18 -2.08 -0.52 0.00 -0.77 0.00 0.00 57.85 54.66 3hdj n ARG 117 Cb 0.57 -1.93 -0.05 0.00 -1.02 0.00 0.00 32.46 30.02 3hdj n ARG 117 CO 0.00 0.00 0.00 0.43 -1.52 0.00 0.00 177.63 176.54 3hdj n SER 118 N 0.50 0.73 0.00 0.55 7.64 -0.41 -4.87 113.62 117.76 3hdj n SER 118 Ca 0.18 1.14 0.00 0.00 1.01 0.00 0.00 58.87 61.21 3hdj n SER 118 Cb 0.82 -1.10 0.00 0.00 -1.01 0.00 0.00 64.21 62.92 3hdj n SER 118 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 3hdj n SER 119 N 1.97 0.86 -4.18 6.43 3.41 -1.26 -4.20 113.62 116.64 3hdj n SER 119 Ca 0.17 -0.13 -0.34 0.00 -0.26 0.00 0.00 58.87 58.32 3hdj n SER 119 Cb 0.19 0.43 -0.15 0.00 -0.26 0.00 0.00 64.21 64.41 3hdj n SER 119 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 3hdj s VAL 120 N -0.60 2.49 -0.19 -3.33 1.01 -1.26 0.42 120.40 118.93 3hdj s VAL 120 Ca 0.00 -0.80 -0.08 0.00 0.00 0.00 0.00 61.98 61.10 3hdj s VAL 120 Cb 0.00 -2.08 -0.04 0.00 0.00 0.00 0.00 36.38 34.25 3hdj s VAL 120 CO 0.00 0.50 0.08 -0.22 0.00 0.00 0.00 175.10 175.46 3hdj s LEU 121 N 1.35 3.93 -0.10 3.92 2.96 -0.83 -0.66 118.68 129.25 3hdj s LEU 121 Ca 0.05 0.12 -0.03 0.00 -0.22 0.00 0.00 54.13 54.05 3hdj s LEU 121 Cb -0.13 -2.00 -0.04 0.00 0.50 0.00 0.00 46.19 44.52 3hdj s LEU 121 CO -0.10 0.17 0.04 -0.83 -1.32 0.00 0.00 176.35 174.31 3hdj s GLY 122 N 0.41 1.93 -0.10 7.98 0.00 0.11 -0.63 107.32 117.03 3hdj s GLY 122 Ca 0.05 -0.76 0.00 0.00 0.00 0.00 0.00 44.72 44.00 3hdj s GLY 122 CO -0.00 -0.50 -0.08 -2.27 0.00 0.00 0.00 173.10 170.25 3hdj s LEU 123 N -0.86 1.25 -0.43 0.66 2.96 0.31 -0.98 118.68 121.57 3hdj s LEU 123 Ca 0.13 -0.28 -0.11 0.00 -0.22 0.00 0.00 54.13 53.64 3hdj s LEU 123 Cb -0.12 -0.80 0.07 0.00 0.50 0.00 0.00 46.19 45.84 3hdj s LEU 123 CO 0.03 -0.09 0.30 -0.36 -1.32 0.00 0.00 176.35 174.91 3hdj s PHE 124 N 1.49 3.30 0.00 5.38 0.08 -0.24 -0.79 117.98 127.21 3hdj s PHE 124 Ca 0.01 -1.31 0.00 0.00 0.12 0.00 0.00 56.93 55.75 3hdj s PHE 124 Cb -0.13 -3.00 0.00 0.00 -0.57 0.00 0.00 43.02 39.32 3hdj s PHE 124 CO -0.06 -0.82 0.00 0.41 -0.10 0.00 0.00 175.22 174.65 3hdj n GLY 125 N 5.01 1.41 1.08 4.36 0.00 -0.14 -0.98 105.19 115.93 3hdj n GLY 125 Ca -0.11 -1.16 0.03 0.00 0.00 0.00 0.00 46.02 44.79 3hdj n GLY 125 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hdj n ALA 126 N 2.76 3.24 -1.00 4.61 0.00 -1.26 -4.13 120.51 124.72 3hdj n ALA 126 Ca 0.00 -2.98 0.00 0.00 0.00 0.00 0.00 53.44 50.46 3hdj n ALA 126 Cb 0.00 -0.51 0.00 0.00 0.00 0.00 0.00 19.45 18.94 3hdj n ALA 126 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3hdj n GLY 127 N -0.50 -1.45 0.36 0.00 0.00 -1.26 -4.47 105.19 97.87 3hdj n GLY 127 Ca 0.15 -1.54 0.06 0.00 0.00 0.00 0.00 46.02 44.69 3hdj n GLY 127 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 3hdj h THR 128 N -0.45 1.02 -0.08 2.61 1.35 -1.99 -0.25 112.91 115.12 3hdj h THR 128 Ca 0.00 -0.31 -0.03 0.00 -0.55 0.00 0.00 66.41 65.52 3hdj h THR 128 Cb 0.00 0.03 -0.00 0.00 -1.73 0.00 0.00 68.15 66.45 3hdj h THR 128 CO 0.00 0.17 -0.07 1.56 -0.25 0.00 0.00 175.52 176.93 3hdj h GLN 129 N 0.92 0.19 -0.31 4.72 1.08 -1.94 -1.56 115.11 118.21 3hdj h GLN 129 Ca 0.38 -0.10 0.06 0.00 -1.45 0.00 0.00 58.65 57.54 3hdj h GLN 129 Cb 0.28 0.00 -0.05 0.00 -0.05 0.00 0.00 27.48 27.66 3hdj h GLN 129 CO -0.15 0.60 -0.00 0.78 -0.95 0.00 0.00 178.83 179.11 3hdj h GLY 130 N -0.21 0.30 1.32 3.46 0.00 -1.63 -1.50 103.07 104.81 3hdj h GLY 130 Ca 0.02 0.04 -0.00 0.00 0.00 0.00 0.00 47.33 47.38 3hdj h GLY 130 CO 0.02 -0.07 0.40 0.00 0.00 0.00 0.00 176.54 176.89 3hdj h ALA 131 N 1.27 1.46 -0.25 3.60 0.00 -1.04 -0.20 119.26 124.10 3hdj h ALA 131 Ca 0.15 -0.07 -0.03 0.00 0.00 0.00 0.00 54.91 54.96 3hdj h ALA 131 Cb 0.20 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 3hdj h ALA 131 CO -0.26 0.47 0.04 1.49 0.00 0.00 0.00 179.25 181.00 3hdj h GLU 132 N 0.92 0.41 -0.64 0.00 4.57 -0.92 -1.41 114.58 117.50 3hdj h GLU 132 Ca 0.24 -0.11 0.09 0.00 -1.18 0.00 0.00 59.36 58.41 3hdj h GLU 132 Cb -0.04 -0.05 -0.07 0.00 -0.16 0.00 0.00 28.75 28.43 3hdj h GLU 132 CO -0.05 0.54 0.27 0.45 -1.18 0.00 0.00 179.01 179.04 3hdj h HIS 133 N 0.21 0.47 -0.50 0.92 3.86 -0.89 -0.95 115.15 118.27 3hdj h HIS 133 Ca 0.07 0.03 0.00 0.00 -1.16 0.00 0.00 60.37 59.32 3hdj h HIS 133 Cb 0.33 -0.12 -0.02 0.00 1.06 0.00 0.00 27.41 28.66 3hdj h HIS 133 CO 0.02 0.14 0.33 0.00 0.86 0.00 0.00 177.93 179.28 3hdj h ALA 134 N 1.42 0.64 0.20 2.45 0.00 -0.83 -0.21 119.26 122.93 3hdj h ALA 134 Ca 0.32 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 55.18 3hdj h ALA 134 Cb 0.38 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 17.96 3hdj h ALA 134 CO -0.29 0.09 -0.10 0.00 0.00 0.00 0.00 179.25 178.95 3hdj h ALA 135 N 1.18 -0.27 -0.61 0.00 0.00 -0.87 -0.17 119.26 118.51 3hdj h ALA 135 Ca 0.18 -0.11 -0.07 0.00 0.00 0.00 0.00 54.91 54.92 3hdj h ALA 135 Cb -0.08 0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 3hdj h ALA 135 CO -0.04 -0.59 0.11 1.96 0.00 0.00 0.00 179.25 180.69 3hdj h GLN 136 N -0.39 1.01 -0.19 0.00 4.20 -1.15 -2.71 115.11 115.88 3hdj h GLN 136 Ca -0.03 -0.27 -0.12 0.00 0.06 0.00 0.00 58.65 58.29 3hdj h GLN 136 Cb 0.30 -0.12 -0.01 0.00 0.30 0.00 0.00 27.48 27.95 3hdj h GLN 136 CO 0.05 0.94 -0.41 -0.07 -0.67 0.00 0.00 178.83 178.67 3hdj h LEU 137 N 0.92 0.45 -1.84 1.46 3.38 -1.02 -2.67 115.31 115.99 3hdj h LEU 137 Ca 0.19 -0.20 -0.03 0.00 0.09 0.00 0.00 57.88 57.93 3hdj h LEU 137 Cb 0.41 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 41.03 3hdj h LEU 137 CO 0.01 0.82 -0.14 0.28 0.09 0.00 0.00 178.44 179.49 3hdj h SER 138 N 0.36 0.00 1.32 -0.43 0.02 -0.82 0.10 113.55 114.10 3hdj h SER 138 Ca 0.03 0.00 -0.08 0.00 -0.84 0.00 0.00 61.79 60.90 3hdj h SER 138 Cb 0.87 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.40 3hdj h SER 138 CO 0.07 0.14 -0.39 0.00 -1.14 0.00 0.00 176.83 175.51 3hdj h ALA 139 N 1.86 0.81 0.01 3.77 0.00 -1.17 -3.34 119.26 121.20 3hdj h ALA 139 Ca -0.00 -0.36 -0.34 0.00 0.00 0.00 0.00 54.91 54.21 3hdj h ALA 139 Cb 0.33 -0.06 -0.06 0.00 0.00 0.00 0.00 17.79 18.00 3hdj h ALA 139 CO 0.02 0.49 -2.10 -2.13 0.00 0.00 0.00 179.25 175.52 3hdj n ARG 140 N -3.29 0.67 -4.40 0.00 3.00 -0.61 -4.96 116.66 107.07 3hdj n ARG 140 Ca 0.01 0.15 -0.28 0.00 -0.00 0.00 0.00 57.85 57.73 3hdj n ARG 140 Cb 0.63 -1.64 -0.12 0.00 0.00 0.00 0.00 32.46 31.32 3hdj n ARG 140 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.63 177.57 3hdj s PHE 141 N -2.54 2.33 -1.32 -0.14 0.08 -0.08 -5.06 117.98 111.25 3hdj s PHE 141 Ca -0.12 -0.36 -0.16 0.00 0.12 0.00 0.00 56.93 56.42 3hdj s PHE 141 Cb 0.07 -1.20 0.09 0.00 -0.57 0.00 0.00 43.02 41.41 3hdj s PHE 141 CO 0.80 0.42 1.81 0.00 -0.10 0.00 0.00 175.22 178.16 3hdj n ALA 142 N 0.57 4.23 -1.78 5.36 0.00 -1.26 -4.63 120.51 123.00 3hdj n ALA 142 Ca -0.15 -3.96 -0.37 0.00 0.00 0.00 0.00 53.44 48.95 3hdj n ALA 142 Cb 0.54 -3.45 -0.06 0.00 0.00 0.00 0.00 19.45 16.49 3hdj n ALA 142 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3hdj s LEU 143 N 2.93 4.35 -0.01 0.00 1.43 -1.26 -4.48 118.68 121.64 3hdj s LEU 143 Ca 0.49 1.88 0.07 0.00 -1.03 0.00 0.00 54.13 55.55 3hdj s LEU 143 Cb 0.06 -3.98 -0.10 0.00 0.03 0.00 0.00 46.19 42.19 3hdj s LEU 143 CO 0.02 -0.09 0.21 -0.62 0.23 0.00 0.00 176.35 176.09 3hdj n GLU 144 N 0.60 1.77 -3.65 1.70 1.02 0.17 -4.89 120.64 117.35 3hdj n GLU 144 Ca 0.02 -0.04 -0.15 0.00 -0.02 0.00 0.00 57.16 56.96 3hdj n GLU 144 Cb 0.50 -1.05 -0.07 0.00 -0.02 0.00 0.00 31.44 30.79 3hdj n GLU 144 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3hdj s ALA 145 N -2.21 -1.20 -0.13 0.62 0.00 -1.06 -4.41 121.76 113.37 3hdj s ALA 145 Ca -0.01 0.72 0.02 0.00 0.00 0.00 0.00 51.96 52.69 3hdj s ALA 145 Cb 0.05 0.07 0.01 0.00 0.00 0.00 0.00 23.12 23.26 3hdj s ALA 145 CO 0.30 -0.32 -0.18 0.42 0.00 0.00 0.00 175.76 175.97 3hdj s ILE 146 N -1.38 1.79 -0.16 0.00 1.01 -0.33 -1.96 121.20 120.17 3hdj s ILE 146 Ca -0.12 -0.81 -0.05 0.00 0.00 0.00 0.00 60.65 59.67 3hdj s ILE 146 Cb -0.03 -1.61 -0.03 0.00 0.01 0.00 0.00 42.46 40.80 3hdj s ILE 146 CO 0.06 0.50 0.01 -0.76 0.00 0.00 0.00 174.94 174.74 3hdj s LEU 147 N 0.97 3.52 -0.06 2.97 1.02 0.20 -0.51 118.68 126.80 3hdj s LEU 147 Ca -0.05 -0.01 0.06 0.00 0.02 0.00 0.00 54.13 54.14 3hdj s LEU 147 Cb -0.15 -1.86 -0.01 0.00 0.02 0.00 0.00 46.19 44.19 3hdj s LEU 147 CO -0.03 0.19 -0.23 -0.69 0.02 0.00 0.00 176.35 175.61 3hdj s VAL 148 N 0.24 1.92 -0.22 -1.59 1.01 0.46 -0.53 120.40 121.69 3hdj s VAL 148 Ca 0.00 -0.99 0.02 0.00 0.00 0.00 0.00 61.98 61.01 3hdj s VAL 148 Cb -0.13 -1.63 0.04 0.00 0.00 0.00 0.00 36.38 34.66 3hdj s VAL 148 CO 0.02 0.54 -0.13 -2.28 0.00 0.00 0.00 175.10 173.25 3hdj s HIS 149 N -0.11 2.82 -0.30 5.22 2.46 0.03 -1.34 115.29 124.08 3hdj s HIS 149 Ca -0.04 -1.89 -0.11 0.00 0.47 0.00 0.00 55.06 53.49 3hdj s HIS 149 Cb -0.13 -1.81 0.17 0.00 -0.13 0.00 0.00 32.58 30.68 3hdj s HIS 149 CO 0.04 -0.81 0.87 0.34 -2.47 0.00 0.00 174.74 172.71 3hdj s ASP 150 N 1.26 -0.80 0.48 9.88 -1.08 -1.26 -0.96 116.67 124.18 3hdj s ASP 150 Ca -0.03 0.77 0.32 0.00 -0.52 0.00 0.00 52.55 53.10 3hdj s ASP 150 Cb -0.17 1.78 1.75 0.00 -1.46 0.00 0.00 42.92 44.82 3hdj s ASP 150 CO -0.08 -0.15 1.99 1.55 0.52 0.00 0.00 175.17 179.00 3hdj h PRO 151 N 7.82 0.00 -0.07 4.34 0.13 -2.02 -1.98 132.00 140.21 3hdj h PRO 151 Ca -0.17 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.96 3hdj h PRO 151 Cb 1.14 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.27 3hdj h PRO 151 CO 0.07 0.00 0.00 0.66 -0.23 0.00 0.00 178.00 178.50 3hdj n TYR 152 N -2.63 0.06 -2.32 1.56 4.01 -1.26 -4.93 117.16 111.64 3hdj n TYR 152 Ca -0.02 -0.03 -0.38 0.00 -0.16 0.00 0.00 57.90 57.31 3hdj n TYR 152 Cb 0.05 0.00 -0.02 0.00 -0.31 0.00 0.00 39.34 39.06 3hdj n TYR 152 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 3hdj s ALA 153 N -1.94 3.13 0.26 -0.72 0.00 -0.75 -5.04 121.76 116.70 3hdj s ALA 153 Ca 0.30 0.93 0.10 0.00 0.00 0.00 0.00 51.96 53.29 3hdj s ALA 153 Cb 0.20 -3.37 -0.05 0.00 0.00 0.00 0.00 23.12 19.91 3hdj s ALA 153 CO 0.30 -0.50 -0.16 -1.54 0.00 0.00 0.00 175.76 173.86 3hdj s SER 154 N -1.21 3.23 0.50 0.00 1.04 -1.26 -4.99 113.70 111.01 3hdj s SER 154 Ca 0.58 -1.05 0.23 0.00 0.48 0.00 0.00 55.95 56.18 3hdj s SER 154 Cb -0.29 -0.24 1.30 0.00 0.10 0.00 0.00 66.02 66.88 3hdj s SER 154 CO 0.37 -0.08 1.97 -0.65 0.98 0.00 0.00 173.24 175.83 3hdj h PRO 155 N 2.34 0.12 -0.40 4.02 0.11 -1.99 0.14 132.00 136.34 3hdj h PRO 155 Ca -0.40 -0.01 -0.14 0.00 0.11 0.00 0.00 66.00 65.57 3hdj h PRO 155 Cb 1.25 -0.03 -0.01 0.00 0.11 0.00 0.00 31.00 32.32 3hdj h PRO 155 CO 0.62 0.08 -0.30 1.49 -0.21 0.00 0.00 178.00 179.68 3hdj h GLU 156 N 0.13 0.87 -0.49 1.05 4.22 -1.99 -1.24 114.58 117.13 3hdj h GLU 156 Ca 0.30 -0.40 -0.07 0.00 0.08 0.00 0.00 59.36 59.27 3hdj h GLU 156 Cb 1.00 -0.01 -0.02 0.00 0.50 0.00 0.00 28.75 30.22 3hdj h GLU 156 CO -0.04 1.05 0.05 0.82 -2.18 0.00 0.00 179.01 178.71 3hdj h ILE 157 N 0.73 1.26 -0.75 2.32 2.04 -1.40 -1.56 117.51 120.14 3hdj h ILE 157 Ca 0.08 -0.99 -0.03 0.00 1.00 0.00 0.00 64.86 64.93 3hdj h ILE 157 Cb 0.86 0.94 -0.03 0.00 -0.74 0.00 0.00 36.82 37.84 3hdj h ILE 157 CO 0.08 0.35 0.37 -0.07 0.00 0.00 0.00 178.15 178.88 3hdj h LEU 158 N 0.70 0.98 -0.75 1.44 3.38 -1.13 -0.03 115.31 119.90 3hdj h LEU 158 Ca 0.14 -0.13 -0.12 0.00 0.09 0.00 0.00 57.88 57.87 3hdj h LEU 158 Cb 0.45 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.93 3hdj h LEU 158 CO 0.02 0.83 -0.30 1.05 0.09 0.00 0.00 178.44 180.13 3hdj h GLU 159 N 1.06 0.61 -0.21 1.13 4.11 -1.18 0.56 114.58 120.65 3hdj h GLU 159 Ca 0.26 -0.27 -0.01 0.00 0.07 0.00 0.00 59.36 59.41 3hdj h GLU 159 Cb 0.10 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.33 3hdj h GLU 159 CO -0.03 0.84 0.08 -0.09 0.07 0.00 0.00 179.01 179.88 3hdj h ARG 160 N 0.53 0.32 -0.28 1.06 2.43 -0.80 0.69 114.38 118.32 3hdj h ARG 160 Ca 0.07 -0.06 -0.05 0.00 -0.81 0.00 0.00 59.98 59.13 3hdj h ARG 160 Cb 0.78 -0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 30.27 3hdj h ARG 160 CO 0.06 0.38 -0.02 0.82 -1.51 0.00 0.00 179.97 179.70 3hdj h ILE 161 N 0.19 1.27 -0.39 1.20 2.04 -0.91 -1.05 117.51 119.86 3hdj h ILE 161 Ca 0.07 -0.98 0.07 0.00 1.00 0.00 0.00 64.86 65.02 3hdj h ILE 161 Cb 0.18 1.35 -0.06 0.00 -0.74 0.00 0.00 36.82 37.55 3hdj h ILE 161 CO -0.01 0.31 0.02 1.23 0.00 0.00 0.00 178.15 179.70 3hdj h GLY 162 N 0.28 0.40 0.97 5.37 0.00 -0.75 -0.15 103.07 109.19 3hdj h GLY 162 Ca 0.08 0.03 -0.02 0.00 0.00 0.00 0.00 47.33 47.41 3hdj h GLY 162 CO 0.02 -0.08 0.22 3.21 0.00 0.00 0.00 176.54 179.91 3hdj h ARG 163 N 0.13 0.70 -0.59 4.80 3.08 -0.70 0.18 114.38 121.98 3hdj h ARG 163 Ca 0.19 -0.11 0.03 0.00 0.07 0.00 0.00 59.98 60.16 3hdj h ARG 163 Cb 0.26 -0.12 -0.04 0.00 0.08 0.00 0.00 29.97 30.14 3hdj h ARG 163 CO -0.30 0.60 0.35 -0.09 -1.07 0.00 0.00 179.97 179.46 3hdj h ARG 164 N 0.64 0.67 0.00 0.04 2.43 -0.65 -3.08 114.38 114.42 3hdj h ARG 164 Ca 0.17 -0.04 -0.19 0.00 -0.81 0.00 0.00 59.98 59.10 3hdj h ARG 164 Cb 0.14 -0.15 -0.03 0.00 -0.42 0.00 0.00 29.97 29.51 3hdj h ARG 164 CO -0.02 0.44 -1.03 0.00 -1.51 0.00 0.00 179.97 177.85 3hdj n GLY 166 N 1.36 0.21 2.81 0.00 0.00 0.59 -4.88 105.19 105.28 3hdj n GLY 166 Ca -0.03 -0.70 -0.14 0.00 0.00 0.00 0.00 46.02 45.14 3hdj n GLY 166 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3hdj s VAL 167 N -2.24 -0.05 0.21 1.61 1.01 -1.01 -5.05 120.40 114.88 3hdj s VAL 167 Ca 0.00 0.19 -0.31 0.00 0.00 0.00 0.00 61.98 61.87 3hdj s VAL 167 Cb -0.00 -0.10 -0.10 0.00 0.00 0.00 0.00 36.38 36.18 3hdj s VAL 167 CO 0.01 0.08 1.48 -2.16 0.00 0.00 0.00 175.10 174.50 3hdj s PRO 168 N 0.97 4.25 0.00 2.72 0.04 -1.26 -4.27 135.00 137.46 3hdj s PRO 168 Ca -0.08 2.30 0.02 0.00 0.04 0.00 0.00 61.00 63.29 3hdj s PRO 168 Cb -0.11 -3.14 -0.04 0.00 0.04 0.00 0.00 34.50 31.26 3hdj s PRO 168 CO -0.03 -0.48 -0.03 0.00 0.04 0.00 0.00 177.00 176.49 3hdj s ALA 169 N 0.47 3.16 0.00 8.56 0.00 -1.26 -1.19 121.76 131.51 3hdj s ALA 169 Ca 0.63 -0.99 0.00 0.00 0.00 0.00 0.00 51.96 51.60 3hdj s ALA 169 Cb -0.42 -1.24 0.00 0.00 0.00 0.00 0.00 23.12 21.46 3hdj s ALA 169 CO 0.38 0.63 0.00 2.89 0.00 0.00 0.00 175.76 179.66 3hdj n ARG 170 N 1.43 0.00 0.00 0.00 1.85 0.33 -4.87 116.66 115.40 3hdj n ARG 170 Ca -0.15 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.70 3hdj n ARG 170 Cb 0.53 0.00 0.00 0.00 -1.05 0.00 0.00 32.46 31.94 3hdj n ARG 170 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 3hdj n ALA 172 N -3.00 0.00 -1.79 2.89 0.00 -0.45 -0.40 120.51 117.77 3hdj n ALA 172 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 53.44 53.10 3hdj n ALA 172 Cb 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.42 3hdj n ALA 172 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3hdj s ALA 173 N -2.00 2.83 0.24 0.00 0.00 -1.26 -4.30 121.76 117.27 3hdj s ALA 173 Ca 0.00 0.64 -0.06 0.00 0.00 0.00 0.00 51.96 52.55 3hdj s ALA 173 Cb 0.00 -3.27 0.45 0.00 0.00 0.00 0.00 23.12 20.29 3hdj s ALA 173 CO 0.00 -0.42 1.68 -1.35 0.00 0.00 0.00 175.76 175.67 3hdj h PRO 174 N 1.45 0.23 -0.07 0.00 0.11 -1.95 0.11 132.00 131.89 3hdj h PRO 174 Ca -0.49 -0.01 -0.04 0.00 0.11 0.00 0.00 66.00 65.56 3hdj h PRO 174 Cb 1.23 -0.05 -0.01 0.00 0.11 0.00 0.00 31.00 32.28 3hdj h PRO 174 CO 0.59 0.16 -0.15 0.00 -0.21 0.00 0.00 178.00 178.39 3hdj h ALA 175 N 1.61 1.63 0.05 -0.75 0.00 -1.93 -2.07 119.26 117.80 3hdj h ALA 175 Ca 0.41 -0.17 -0.24 0.00 0.00 0.00 0.00 54.91 54.90 3hdj h ALA 175 Cb 0.69 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.43 3hdj h ALA 175 CO -0.52 0.27 -1.04 -0.44 0.00 0.00 0.00 179.25 177.52 3hdj h ASP 176 N 0.11 0.48 -0.10 0.00 3.45 -1.21 -2.75 116.42 116.40 3hdj h ASP 176 Ca 0.02 -0.42 -0.00 0.00 0.43 0.00 0.00 57.03 57.05 3hdj h ASP 176 Cb 0.33 -0.15 -0.00 0.00 -0.56 0.00 0.00 39.33 38.94 3hdj h ASP 176 CO 0.02 1.25 0.05 0.40 -1.57 0.00 0.00 179.24 179.39 3hdj h ILE 177 N 0.17 1.11 -0.68 0.35 2.04 -0.89 -2.06 117.51 117.54 3hdj h ILE 177 Ca -0.10 -0.33 -0.01 0.00 1.00 0.00 0.00 64.86 65.42 3hdj h ILE 177 Cb 1.70 1.16 -0.03 0.00 -0.74 0.00 0.00 36.82 38.91 3hdj h ILE 177 CO 0.18 0.10 0.39 0.00 0.00 0.00 0.00 178.15 178.81 3hdj h ALA 178 N 0.92 1.40 0.00 1.87 0.00 -1.41 -1.04 119.26 121.00 3hdj h ALA 178 Ca 0.03 -0.09 -0.19 0.00 0.00 0.00 0.00 54.91 54.66 3hdj h ALA 178 Cb 0.12 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 17.61 3hdj h ALA 178 CO -0.00 0.50 -0.90 0.00 0.00 0.00 0.00 179.25 178.85 3hdj h ALA 179 N 1.48 0.52 0.00 0.00 0.00 -1.40 -1.52 119.26 118.34 3hdj h ALA 179 Ca 0.24 -0.81 -0.13 0.00 0.00 0.00 0.00 54.91 54.21 3hdj h ALA 179 Cb -0.00 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.62 3hdj h ALA 179 CO -0.04 1.11 -2.07 1.04 0.00 0.00 0.00 179.25 179.29 3hdj n GLN 180 N -3.48 0.67 -2.95 0.00 6.02 -0.78 -4.39 117.38 112.46 3hdj n GLN 180 Ca -0.00 -0.10 -0.40 0.00 -0.01 0.00 0.00 57.00 56.48 3hdj n GLN 180 Cb 0.85 -1.54 -0.05 0.00 1.02 0.00 0.00 30.24 30.52 3hdj n GLN 180 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3hdj s ALA 181 N -3.14 3.36 0.14 -1.58 0.00 -0.43 -4.80 121.76 115.30 3hdj s ALA 181 Ca -0.08 0.32 0.08 0.00 0.00 0.00 0.00 51.96 52.28 3hdj s ALA 181 Cb 0.11 -3.03 -0.07 0.00 0.00 0.00 0.00 23.12 20.13 3hdj s ALA 181 CO 0.87 0.06 1.36 -0.44 0.00 0.00 0.00 175.76 177.62 3hdj h ASP 182 N 5.61 0.00 -3.38 0.00 3.32 -1.24 -3.42 116.42 117.32 3hdj h ASP 182 Ca -0.44 0.00 -0.45 0.00 0.02 0.00 0.00 57.03 56.16 3hdj h ASP 182 Cb 1.21 0.00 -0.35 0.00 0.22 0.00 0.00 39.33 40.41 3hdj h ASP 182 CO 0.71 0.89 -0.78 -0.63 -1.72 0.00 0.00 179.24 177.71 3hdj s ILE 183 N -2.91 0.68 -0.12 0.35 1.01 -1.03 -1.39 121.20 117.78 3hdj s ILE 183 Ca 0.01 -0.16 0.03 0.00 0.00 0.00 0.00 60.65 60.52 3hdj s ILE 183 Cb 0.10 -0.71 0.01 0.00 0.01 0.00 0.00 42.46 41.87 3hdj s ILE 183 CO 0.80 0.27 -0.22 -0.69 0.00 0.00 0.00 174.94 175.11 3hdj s VAL 184 N 1.16 2.00 -0.11 2.92 1.01 -0.08 0.09 120.40 127.39 3hdj s VAL 184 Ca -0.07 -0.96 0.03 0.00 0.00 0.00 0.00 61.98 60.98 3hdj s VAL 184 Cb -0.14 -1.76 -0.00 0.00 0.00 0.00 0.00 36.38 34.48 3hdj s VAL 184 CO -0.01 0.54 -0.21 -0.69 0.00 0.00 0.00 175.10 174.73 3hdj s VAL 185 N 0.66 2.36 -0.19 2.92 1.01 -0.16 0.06 120.40 127.08 3hdj s VAL 185 Ca -0.11 -0.91 -0.00 0.00 0.00 0.00 0.00 61.98 60.96 3hdj s VAL 185 Cb -0.16 -1.94 0.01 0.00 0.00 0.00 0.00 36.38 34.29 3hdj s VAL 185 CO 0.02 0.55 -0.16 0.42 0.00 0.00 0.00 175.10 175.93 3hdj s THR 186 N 0.38 2.41 -0.43 3.92 -4.23 -0.41 -1.07 115.64 116.20 3hdj s THR 186 Ca -0.16 -0.82 0.08 0.00 -1.18 0.00 0.00 61.69 59.61 3hdj s THR 186 Cb -0.17 -2.04 0.25 0.00 1.34 0.00 0.00 72.50 71.89 3hdj s THR 186 CO 0.07 0.51 0.57 0.00 -0.54 0.00 0.00 174.62 175.23 3hdj n ALA 187 N 4.59 2.69 -2.22 3.99 0.00 -0.16 -0.71 120.51 128.70 3hdj n ALA 187 Ca -0.20 -3.62 -0.12 0.00 0.00 0.00 0.00 53.44 49.49 3hdj n ALA 187 Cb 0.50 -0.83 -0.10 0.00 0.00 0.00 0.00 19.45 19.03 3hdj n ALA 187 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 3hdj s THR 188 N -1.44 0.50 -0.39 0.00 -4.23 -1.26 -4.54 115.64 104.28 3hdj s THR 188 Ca 0.36 -1.96 0.04 0.00 -1.18 0.00 0.00 61.69 58.95 3hdj s THR 188 Cb 0.17 -2.11 0.59 0.00 1.34 0.00 0.00 72.50 72.50 3hdj s THR 188 CO -0.09 -0.46 1.78 0.54 -0.54 0.00 0.00 174.62 175.85 3hdj n ARG 189 N -0.20 2.24 -1.72 3.99 1.74 -1.26 -3.38 116.66 118.07 3hdj n ARG 189 Ca -0.06 -2.62 -0.38 0.00 -0.77 0.00 0.00 57.85 54.02 3hdj n ARG 189 Cb 0.63 -2.03 0.05 0.00 -1.02 0.00 0.00 32.46 30.09 3hdj n ARG 189 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 3hdj n SER 190 N -0.83 2.26 -0.25 0.55 2.88 -1.26 -4.88 113.62 112.09 3hdj n SER 190 Ca 0.50 0.90 0.03 0.00 -1.33 0.00 0.00 58.87 58.98 3hdj n SER 190 Cb 1.49 -1.55 0.03 0.00 -0.75 0.00 0.00 64.21 63.44 3hdj n SER 190 CO 0.00 0.00 0.00 0.35 -1.23 0.00 0.00 175.04 174.16 3hdj n THR 191 N -1.44 0.18 -4.26 2.46 -2.24 -1.24 -1.27 114.28 106.47 3hdj n THR 191 Ca 0.13 -0.59 -0.14 0.00 -2.27 0.00 0.00 64.05 61.17 3hdj n THR 191 Cb 0.46 1.01 -0.10 0.00 -2.10 0.00 0.00 70.33 69.60 3hdj n THR 191 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 3hdj s THR 192 N -0.58 1.04 0.34 4.28 -4.23 -1.18 -4.47 115.64 110.84 3hdj s THR 192 Ca 0.08 -2.03 -0.29 0.00 -1.18 0.00 0.00 61.69 58.27 3hdj s THR 192 Cb 0.05 -1.97 -0.11 0.00 1.34 0.00 0.00 72.50 71.81 3hdj s THR 192 CO 0.07 -0.63 1.43 -2.16 -0.54 0.00 0.00 174.62 172.79 3hdj s PRO 193 N -3.80 4.22 0.40 3.99 0.05 -1.26 -4.42 135.00 134.18 3hdj s PRO 193 Ca 0.20 2.42 0.22 0.00 0.05 0.00 0.00 61.00 63.88 3hdj s PRO 193 Cb 0.04 -3.03 0.51 0.00 0.05 0.00 0.00 34.50 32.07 3hdj s PRO 193 CO 0.02 -0.41 1.65 -0.07 0.05 0.00 0.00 177.00 178.25 3hdj h LEU 194 N 3.59 0.00 -7.27 -3.56 3.38 -1.11 -3.47 115.31 106.88 3hdj h LEU 194 Ca -0.49 0.00 0.02 0.00 0.09 0.00 0.00 57.88 57.50 3hdj h LEU 194 Cb 1.23 0.00 -0.10 0.00 0.09 0.00 0.00 40.66 41.88 3hdj h LEU 194 CO 0.68 0.21 0.24 0.72 0.09 0.00 0.00 178.44 180.38 3hdj s PHE 195 N -3.29 -0.43 0.13 1.13 -0.12 -1.26 -4.84 117.98 109.30 3hdj s PHE 195 Ca 0.04 0.16 -0.30 0.00 -0.05 0.00 0.00 56.93 56.77 3hdj s PHE 195 Cb 0.07 0.60 -0.07 0.00 -0.63 0.00 0.00 43.02 42.99 3hdj s PHE 195 CO 0.67 -0.93 1.21 0.00 -0.05 0.00 0.00 175.22 176.12 3hdj s ALA 196 N -3.74 3.43 0.35 1.99 0.00 -1.26 -4.58 121.76 117.95 3hdj s ALA 196 Ca 0.04 0.92 0.09 0.00 0.00 0.00 0.00 51.96 53.01 3hdj s ALA 196 Cb -0.02 -3.43 0.81 0.00 0.00 0.00 0.00 23.12 20.48 3hdj s ALA 196 CO -0.07 -0.40 1.86 0.78 0.00 0.00 0.00 175.76 177.92 3hdj h GLY 197 N 5.94 1.26 0.42 0.00 0.00 -1.90 0.90 103.07 109.69 3hdj h GLY 197 Ca -0.43 -0.31 0.22 0.00 0.00 0.00 0.00 47.33 46.81 3hdj h GLY 197 CO 0.78 0.07 0.57 -1.61 0.00 0.00 0.00 176.54 176.35 3hdj h GLN 198 N 0.70 0.13 0.00 4.80 5.75 -1.91 -2.45 115.11 122.13 3hdj h GLN 198 Ca 0.47 -0.01 0.00 0.00 -0.15 0.00 0.00 58.65 58.96 3hdj h GLN 198 Cb 0.76 -0.03 0.00 0.00 1.07 0.00 0.00 27.48 29.28 3hdj h GLN 198 CO -0.22 0.09 0.00 0.00 -2.65 0.00 0.00 178.83 176.04 3hdj h ALA 199 N 1.61 1.00 -2.64 3.38 0.00 -1.18 -3.47 119.26 117.97 3hdj h ALA 199 Ca 0.40 0.00 -0.55 0.00 0.00 0.00 0.00 54.91 54.76 3hdj h ALA 199 Cb 1.36 0.00 0.08 0.00 0.00 0.00 0.00 17.79 19.23 3hdj h ALA 199 CO -0.06 0.00 0.83 1.28 0.00 0.00 0.00 179.25 181.30 3hdj n LEU 200 N -2.59 3.98 -4.77 0.00 4.77 -0.92 -3.10 117.00 114.36 3hdj n LEU 200 Ca 0.05 1.13 -0.41 0.00 -0.03 0.00 0.00 56.01 56.75 3hdj n LEU 200 Cb 0.46 -1.55 0.00 0.00 -2.33 0.00 0.00 43.42 40.00 3hdj n LEU 200 CO 0.31 -0.01 1.12 -1.14 -1.33 0.00 0.00 177.39 176.34 3hdj n ARG 201 N 2.35 2.63 -1.76 3.23 0.63 -0.57 -4.92 116.66 118.26 3hdj n ARG 201 Ca 0.10 0.92 -0.42 0.00 -0.92 0.00 0.00 57.85 57.54 3hdj n ARG 201 Cb 0.35 -2.65 -0.02 0.00 0.45 0.00 0.00 32.46 30.59 3hdj n ARG 201 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 3hdj s ALA 202 N -1.12 3.78 0.00 5.13 0.00 -1.26 -2.13 121.76 126.15 3hdj s ALA 202 Ca 0.54 1.59 0.00 0.00 0.00 0.00 0.00 51.96 54.09 3hdj s ALA 202 Cb -0.48 -3.66 0.00 0.00 0.00 0.00 0.00 23.12 18.98 3hdj s ALA 202 CO 0.64 -1.00 0.00 0.41 0.00 0.00 0.00 175.76 175.81 3hdj n GLY 203 N 2.35 1.26 3.76 0.00 0.00 -0.03 -4.92 105.19 107.61 3hdj n GLY 203 Ca 0.09 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.73 3hdj n GLY 203 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hdj s ALA 204 N -2.44 2.97 -0.19 4.61 0.00 -0.91 -4.43 121.76 121.37 3hdj s ALA 204 Ca 0.00 1.23 -0.06 0.00 0.00 0.00 0.00 51.96 53.13 3hdj s ALA 204 Cb 0.00 -3.51 -0.03 0.00 0.00 0.00 0.00 23.12 19.58 3hdj s ALA 204 CO 0.00 -1.08 0.03 0.12 0.00 0.00 0.00 175.76 174.82 3hdj s PHE 205 N -1.35 3.12 -0.17 0.00 5.36 -0.49 -1.33 117.98 123.12 3hdj s PHE 205 Ca 0.66 -0.21 -0.02 0.00 -0.96 0.00 0.00 56.93 56.40 3hdj s PHE 205 Cb -0.37 -2.08 -0.01 0.00 -0.34 0.00 0.00 43.02 40.21 3hdj s PHE 205 CO 0.45 -0.06 -0.08 0.08 -1.46 0.00 0.00 175.22 174.16 3hdj s VAL 206 N 0.71 3.36 -0.46 3.12 1.01 0.06 -0.90 120.40 127.29 3hdj s VAL 206 Ca 0.01 -0.53 -0.09 0.00 0.00 0.00 0.00 61.98 61.38 3hdj s VAL 206 Cb -0.14 -2.47 0.12 0.00 0.00 0.00 0.00 36.38 33.89 3hdj s VAL 206 CO 0.02 0.48 0.33 -0.83 0.00 0.00 0.00 175.10 175.10 3hdj s GLY 207 N 0.79 2.03 -0.63 4.51 0.00 0.11 0.04 107.32 114.17 3hdj s GLY 207 Ca -0.03 -2.52 -0.20 0.00 0.00 0.00 0.00 44.72 41.97 3hdj s GLY 207 CO 0.01 1.10 0.81 0.00 0.00 0.00 0.00 173.10 175.02 3hdj s ALA 208 N 1.35 3.31 -0.22 3.20 0.00 0.17 -1.29 121.76 128.28 3hdj s ALA 208 Ca 0.06 -2.13 -0.20 0.00 0.00 0.00 0.00 51.96 49.69 3hdj s ALA 208 Cb -0.26 -3.67 -0.18 0.00 0.00 0.00 0.00 23.12 19.02 3hdj s ALA 208 CO -0.01 -2.52 0.10 -0.89 0.00 0.00 0.00 175.76 172.44 3hdj n ILE 209 N 5.66 1.54 -2.01 0.00 2.08 0.12 -1.52 119.36 125.23 3hdj n ILE 209 Ca -0.06 -0.12 0.00 0.00 0.56 0.00 0.00 62.75 63.13 3hdj n ILE 209 Cb 0.44 -2.00 0.00 0.00 -0.75 0.00 0.00 39.64 37.33 3hdj n ILE 209 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 3hdj n GLY 210 N 1.41 2.66 3.04 7.39 0.00 -0.73 -4.72 105.19 114.25 3hdj n GLY 210 Ca -0.37 -0.23 -0.08 0.00 0.00 0.00 0.00 46.02 45.33 3hdj n GLY 210 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3hdj s SER 211 N -4.00 0.30 0.32 1.61 0.15 -1.22 -4.29 113.70 106.57 3hdj s SER 211 Ca 0.00 -0.66 0.26 0.00 0.70 0.00 0.00 55.95 56.25 3hdj s SER 211 Cb 0.00 0.16 0.80 0.00 -1.71 0.00 0.00 66.02 65.27 3hdj s SER 211 CO 0.00 -0.43 1.75 0.28 1.20 0.00 0.00 173.24 176.04 3hdj h SER 212 N 3.99 0.00 -4.04 5.45 0.02 -1.92 -3.47 113.55 113.59 3hdj h SER 212 Ca -0.33 0.00 -0.50 0.00 -0.84 0.00 0.00 61.79 60.12 3hdj h SER 212 Cb 1.18 0.00 0.07 0.00 0.14 0.00 0.00 62.40 63.79 3hdj h SER 212 CO 0.51 0.00 0.46 -0.76 -1.14 0.00 0.00 176.83 175.90 3hdj s LEU 213 N -5.15 3.90 0.45 5.07 1.43 -1.26 -4.97 118.68 118.16 3hdj s LEU 213 Ca 0.07 2.25 -0.23 0.00 -1.03 0.00 0.00 54.13 55.19 3hdj s LEU 213 Cb 0.09 -4.38 -0.09 0.00 0.03 0.00 0.00 46.19 41.84 3hdj s LEU 213 CO 0.57 -1.04 1.04 -2.65 0.23 0.00 0.00 176.35 174.50 3hdj n PRO 214 N -0.82 1.36 -0.92 1.29 -0.02 -1.26 -3.23 135.00 131.40 3hdj n PRO 214 Ca 0.09 0.49 0.00 0.00 -2.02 0.00 0.00 63.50 62.06 3hdj n PRO 214 Cb 0.49 -2.12 0.00 0.00 -0.02 0.00 0.00 33.50 31.86 3hdj n PRO 214 CO 0.00 0.00 0.00 0.72 1.98 0.00 0.00 175.50 178.20 3hdj n HIS 215 N -0.66 0.00 -2.93 6.00 8.25 -1.26 -5.00 115.22 119.62 3hdj n HIS 215 Ca 0.10 0.00 -0.40 0.00 -0.26 0.00 0.00 57.72 57.16 3hdj n HIS 215 Cb 0.41 -0.24 -0.06 0.00 1.12 0.00 0.00 29.99 31.21 3hdj n HIS 215 CO 0.00 0.00 0.00 0.95 0.64 0.00 0.00 176.34 177.93 3hdj s THR 216 N -3.43 4.33 -0.08 1.59 -4.23 -1.20 -4.56 115.64 108.06 3hdj s THR 216 Ca 0.00 1.78 -0.30 0.00 -1.18 0.00 0.00 61.69 61.99 3hdj s THR 216 Cb 0.00 -4.18 0.09 0.00 1.34 0.00 0.00 72.50 69.75 3hdj s THR 216 CO 0.00 0.51 0.79 0.00 -0.54 0.00 0.00 174.62 175.38 3hdj s ARG 217 N -1.08 0.91 0.00 3.99 1.70 -0.40 -3.97 118.95 120.10 3hdj s ARG 217 Ca 0.37 0.18 0.00 0.00 -0.47 0.00 0.00 55.73 55.81 3hdj s ARG 217 Cb -0.24 0.43 0.00 0.00 -0.57 0.00 0.00 34.95 34.57 3hdj s ARG 217 CO 0.27 -0.29 0.00 0.39 -1.08 0.00 0.00 175.30 174.59 3hdj n GLU 218 N 0.76 1.81 -4.33 3.89 1.02 -1.26 -3.12 120.64 119.41 3hdj n GLU 218 Ca -0.16 0.00 -0.32 0.00 -0.02 0.00 0.00 57.16 56.67 3hdj n GLU 218 Cb 0.58 -0.92 -0.09 0.00 -0.02 0.00 0.00 31.44 30.98 3hdj n GLU 218 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 3hdj s LEU 219 N -2.90 3.29 0.58 -4.62 1.43 -1.26 -0.50 118.68 114.69 3hdj s LEU 219 Ca 0.00 -0.15 -0.03 0.00 -1.03 0.00 0.00 54.13 52.93 3hdj s LEU 219 Cb 0.00 -1.94 0.03 0.00 0.03 0.00 0.00 46.19 44.31 3hdj s LEU 219 CO 0.00 0.25 0.84 1.51 0.23 0.00 0.00 176.35 179.18 3hdj s ASP 220 N -1.71 5.36 0.37 2.29 1.47 -1.26 -4.72 116.67 118.47 3hdj s ASP 220 Ca 0.20 0.34 0.11 0.00 1.18 0.00 0.00 52.55 54.38 3hdj s ASP 220 Cb -0.11 -1.28 0.88 0.00 -0.34 0.00 0.00 42.92 42.07 3hdj s ASP 220 CO 0.11 -1.14 1.88 0.44 0.68 0.00 0.00 175.17 177.14 3hdj h ASP 221 N -0.08 0.59 -0.68 2.11 3.32 -1.99 -2.49 116.42 117.20 3hdj h ASP 221 Ca -0.44 0.04 -0.01 0.00 0.02 0.00 0.00 57.03 56.63 3hdj h ASP 221 Cb 1.28 -0.08 -0.03 0.00 0.22 0.00 0.00 39.33 40.72 3hdj h ASP 221 CO 0.57 0.29 0.39 -0.08 -1.72 0.00 0.00 179.24 178.70 3hdj h GLU 222 N 0.62 0.93 -0.85 3.56 4.57 -1.96 0.97 114.58 122.42 3hdj h GLU 222 Ca 0.43 -0.10 -0.01 0.00 -1.18 0.00 0.00 59.36 58.50 3hdj h GLU 222 Cb 0.77 -0.19 -0.04 0.00 -0.16 0.00 0.00 28.75 29.13 3hdj h GLU 222 CO -0.19 0.68 0.47 0.00 -1.18 0.00 0.00 179.01 178.80 3hdj h ALA 223 N 1.20 1.09 -0.20 2.92 0.00 -1.71 0.11 119.26 122.66 3hdj h ALA 223 Ca 0.24 -0.12 -0.19 0.00 0.00 0.00 0.00 54.91 54.84 3hdj h ALA 223 Cb 0.01 -0.34 0.00 0.00 0.00 0.00 0.00 17.79 17.46 3hdj h ALA 223 CO -0.04 0.59 -0.63 -0.07 0.00 0.00 0.00 179.25 179.10 3hdj h LEU 224 N 1.18 0.82 -0.62 0.00 3.38 -1.39 -1.63 115.31 117.07 3hdj h LEU 224 Ca 0.30 -0.48 -0.04 0.00 0.09 0.00 0.00 57.88 57.75 3hdj h LEU 224 Cb 0.02 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.50 3hdj h LEU 224 CO -0.05 1.25 0.23 -0.09 0.09 0.00 0.00 178.44 179.87 3hdj h ARG 225 N 0.53 0.93 -0.02 1.13 2.43 -0.53 -3.12 114.38 115.73 3hdj h ARG 225 Ca -0.01 -0.18 -0.11 0.00 -0.81 0.00 0.00 59.98 58.87 3hdj h ARG 225 Cb 1.23 -0.15 -0.01 0.00 -0.42 0.00 0.00 29.97 30.62 3hdj h ARG 225 CO 0.13 0.81 -0.48 0.00 -1.51 0.00 0.00 179.97 178.91 3hdj h ARG 226 N 0.87 0.06 -6.88 0.20 3.08 -0.60 -3.46 114.38 107.64 3hdj h ARG 226 Ca 0.20 -0.03 -0.54 0.00 0.07 0.00 0.00 59.98 59.68 3hdj h ARG 226 Cb 0.23 0.00 0.10 0.00 0.08 0.00 0.00 29.97 30.39 3hdj h ARG 226 CO -0.01 0.53 0.82 0.00 -1.07 0.00 0.00 179.97 180.24 3hdj n ALA 227 N -2.45 2.45 -0.17 0.04 0.00 -0.63 -4.63 120.51 115.12 3hdj n ALA 227 Ca -0.02 0.35 -0.10 0.00 0.00 0.00 0.00 53.44 53.68 3hdj n ALA 227 Cb 0.51 -2.44 0.00 0.00 0.00 0.00 0.00 19.45 17.53 3hdj n ALA 227 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.50 177.41 3hdj h ARG 228 N 3.66 0.92 -3.12 0.00 9.65 -0.63 -3.47 114.38 121.38 3hdj h ARG 228 Ca -0.49 -0.32 -0.11 0.00 -1.10 0.00 0.00 59.98 57.96 3hdj h ARG 228 Cb 1.24 -0.07 -0.19 0.00 -1.39 0.00 0.00 29.97 29.56 3hdj h ARG 228 CO 0.70 0.97 -0.26 0.00 2.80 0.00 0.00 179.97 184.18 3hdj s ALA 229 N -4.93 -0.76 -0.22 2.80 0.00 -1.24 -4.87 121.76 112.54 3hdj s ALA 229 Ca -0.12 0.21 0.02 0.00 0.00 0.00 0.00 51.96 52.07 3hdj s ALA 229 Cb 0.12 0.17 0.05 0.00 0.00 0.00 0.00 23.12 23.46 3hdj s ALA 229 CO 0.84 -0.32 -0.11 0.08 0.00 0.00 0.00 175.76 176.24 3hdj s VAL 230 N -1.81 1.85 -0.15 0.00 1.01 -0.59 -1.93 120.40 118.79 3hdj s VAL 230 Ca -0.10 -1.23 -0.14 0.00 0.00 0.00 0.00 61.98 60.51 3hdj s VAL 230 Cb -0.03 -1.93 -0.05 0.00 0.00 0.00 0.00 36.38 34.37 3hdj s VAL 230 CO 0.01 0.12 0.31 -0.69 0.00 0.00 0.00 175.10 174.85 3hdj s VAL 231 N 1.29 5.29 0.22 2.92 1.01 0.17 -0.94 120.40 130.36 3hdj s VAL 231 Ca -0.03 0.58 0.07 0.00 0.00 0.00 0.00 61.98 62.60 3hdj s VAL 231 Cb -0.17 -3.64 -0.05 0.00 0.00 0.00 0.00 36.38 32.51 3hdj s VAL 231 CO -0.08 0.39 -0.12 0.68 0.00 0.00 0.00 175.10 175.98 3hdj s VAL 232 N 0.40 1.65 0.20 2.92 -7.23 -0.11 -1.17 120.40 117.06 3hdj s VAL 232 Ca 0.17 -2.18 0.02 0.00 -1.81 0.00 0.00 61.98 58.18 3hdj s VAL 232 Cb -0.13 -2.13 -0.08 0.00 0.56 0.00 0.00 36.38 34.59 3hdj s VAL 232 CO 0.05 -0.53 1.48 -0.33 -0.31 0.00 0.00 175.10 175.46 3hdj h GLU 233 N 2.51 0.31 -1.31 4.82 5.08 -1.88 0.16 114.58 124.27 3hdj h GLU 233 Ca -0.38 -0.24 0.08 0.00 -1.00 0.00 0.00 59.36 57.81 3hdj h GLU 233 Cb 1.22 0.05 -0.21 0.00 0.50 0.00 0.00 28.75 30.31 3hdj h GLU 233 CO 0.63 0.88 -0.24 -0.46 -1.00 0.00 0.00 179.01 178.82 3hdj s TRP 234 N -3.64 -1.51 0.10 4.33 -0.00 -1.26 -4.42 118.94 112.54 3hdj s TRP 234 Ca -0.05 1.86 -0.19 0.00 -0.00 0.00 0.00 56.10 57.73 3hdj s TRP 234 Cb 0.11 0.62 -0.04 0.00 -0.00 0.00 0.00 33.47 34.16 3hdj s TRP 234 CO 0.82 -0.81 0.99 2.89 -0.00 0.00 0.00 176.95 180.83 3hdj n ARG 235 N 5.43 -0.26 0.00 5.86 1.85 -1.26 -1.92 116.66 126.36 3hdj n ARG 235 Ca -0.04 0.97 0.00 0.00 -1.00 0.00 0.00 57.85 57.78 3hdj n ARG 235 Cb 0.50 -1.43 0.00 0.00 -1.05 0.00 0.00 32.46 30.49 3hdj n ARG 235 CO 0.00 0.00 0.00 0.39 -0.01 0.00 0.00 177.63 178.01 3hdj n GLU 236 N -4.61 0.00 0.07 2.89 -0.58 -1.26 -2.95 120.64 114.19 3hdj n GLU 236 Ca 0.01 0.63 -0.13 0.00 -0.42 0.00 0.00 57.16 57.25 3hdj n GLU 236 Cb 0.16 -1.21 -0.09 0.00 -0.57 0.00 0.00 31.44 29.73 3hdj n GLU 236 CO 0.00 0.00 0.00 0.37 -0.48 0.00 0.00 177.13 177.02 3hdj h GLN 237 N 0.00 -0.16 0.00 3.49 4.15 -1.95 -3.26 115.11 117.37 3hdj h GLN 237 Ca 0.00 0.01 -0.01 0.00 0.77 0.00 0.00 58.65 59.42 3hdj h GLN 237 Cb 0.00 0.04 -0.00 0.00 0.21 0.00 0.00 27.48 27.73 3hdj h GLN 237 CO 0.00 0.16 -0.03 1.15 -1.93 0.00 0.00 178.83 178.18 3hdj h THR 238 N -0.50 0.64 0.00 2.39 2.02 -1.50 0.11 112.91 116.07 3hdj h THR 238 Ca -0.02 -0.14 0.00 0.00 0.77 0.00 0.00 66.41 67.03 3hdj h THR 238 Cb 0.40 1.08 0.00 0.00 -1.74 0.00 0.00 68.15 67.89 3hdj h THR 238 CO 0.03 0.03 0.00 -0.07 0.37 0.00 0.00 175.52 175.88 3hdj h LEU 239 N 0.00 0.00 0.00 2.58 4.07 -1.57 -3.22 115.31 117.17 3hdj h LEU 239 Ca -0.00 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.96 3hdj h LEU 239 Cb 0.08 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.82 3hdj h LEU 239 CO 0.00 0.00 -0.37 0.28 -1.08 0.00 0.00 178.44 177.28 3hdj h SER 240 N 0.00 0.00 -0.02 -0.43 0.02 -1.15 -3.39 113.55 108.58 3hdj h SER 240 Ca 0.00 0.00 0.01 0.00 -0.84 0.00 0.00 61.79 60.96 3hdj h SER 240 Cb 0.81 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 63.33 3hdj h SER 240 CO 0.00 0.56 -0.25 -0.08 -1.14 0.00 0.00 176.83 175.92 3hdj h GLU 241 N -0.74 -0.29 -6.77 3.45 4.81 -1.00 -3.43 114.58 110.61 3hdj h GLU 241 Ca 0.00 0.02 -0.55 0.00 -0.13 0.00 0.00 59.36 58.70 3hdj h GLU 241 Cb 0.37 0.07 0.09 0.00 0.63 0.00 0.00 28.75 29.91 3hdj h GLU 241 CO 0.00 -0.19 0.74 0.00 -0.73 0.00 0.00 179.01 178.83 3hdj n ALA 242 N -2.73 2.01 -0.08 2.92 0.00 -1.21 -4.94 120.51 116.47 3hdj n ALA 242 Ca -0.03 0.37 -0.11 0.00 0.00 0.00 0.00 53.44 53.67 3hdj n ALA 242 Cb 0.18 -2.38 -0.04 0.00 0.00 0.00 0.00 19.45 17.21 3hdj n ALA 242 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 3hdj h GLY 243 N 3.91 0.43 0.80 0.00 0.00 -1.86 -2.81 103.07 103.53 3hdj h GLY 243 Ca -0.47 -0.26 -0.02 0.00 0.00 0.00 0.00 47.33 46.58 3hdj h GLY 243 CO 0.73 0.24 0.01 -1.80 0.00 0.00 0.00 176.54 175.72 3hdj h ASP 244 N 0.24 0.25 -0.22 0.19 3.58 -1.92 -2.32 116.42 116.22 3hdj h ASP 244 Ca 0.08 -0.29 -0.11 0.00 0.42 0.00 0.00 57.03 57.13 3hdj h ASP 244 Cb 0.25 -0.07 -0.01 0.00 1.72 0.00 0.00 39.33 41.22 3hdj h ASP 244 CO -0.00 0.48 -0.25 -0.07 -2.88 0.00 0.00 179.24 176.52 3hdj h LEU 245 N 0.01 0.71 -0.89 2.28 4.07 -1.90 -1.97 115.31 117.63 3hdj h LEU 245 Ca 0.04 -0.26 -0.10 0.00 0.08 0.00 0.00 57.88 57.64 3hdj h LEU 245 Cb 0.34 -0.19 -0.01 0.00 1.08 0.00 0.00 40.66 41.88 3hdj h LEU 245 CO 0.01 0.93 -0.29 1.62 -1.08 0.00 0.00 178.44 179.63 3hdj h VAL 246 N 0.60 1.28 0.01 1.22 3.04 -1.52 -3.23 116.25 117.65 3hdj h VAL 246 Ca 0.08 -1.34 -0.20 0.00 -1.01 0.00 0.00 66.70 64.23 3hdj h VAL 246 Cb 0.74 1.41 -0.02 0.00 -2.01 0.00 0.00 31.29 31.42 3hdj h VAL 246 CO 0.06 0.42 -0.89 -0.07 -1.01 0.00 0.00 177.57 176.08 3hdj h LEU 247 N 0.42 0.17 -9.10 3.16 3.38 -1.16 -3.46 115.31 108.72 3hdj h LEU 247 Ca 0.06 -0.14 -0.68 0.00 0.09 0.00 0.00 57.88 57.20 3hdj h LEU 247 Cb 0.72 -0.05 0.01 0.00 0.09 0.00 0.00 40.66 41.43 3hdj h LEU 247 CO 0.06 0.97 1.06 0.00 0.09 0.00 0.00 178.44 180.62 3hdj n ALA 248 N -2.43 0.41 -1.07 1.53 0.00 -0.76 -4.95 120.51 113.24 3hdj n ALA 248 Ca -0.03 0.28 -0.31 0.00 0.00 0.00 0.00 53.44 53.38 3hdj n ALA 248 Cb 0.82 -2.38 0.12 0.00 0.00 0.00 0.00 19.45 18.01 3hdj n ALA 248 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3hdj s ALA 249 N 4.35 1.98 -0.35 0.00 0.00 -1.26 -4.87 121.76 121.60 3hdj s ALA 249 Ca 0.98 0.41 0.09 0.00 0.00 0.00 0.00 51.96 53.45 3hdj s ALA 249 Cb -0.89 -3.35 0.50 0.00 0.00 0.00 0.00 23.12 19.38 3hdj s ALA 249 CO 0.58 -2.12 1.19 -2.30 0.00 0.00 0.00 175.76 173.11 3hdj n PRO 250 N -3.72 0.06 -0.20 0.00 -0.02 -1.26 -2.18 135.00 127.69 3hdj n PRO 250 Ca 0.10 0.50 -0.07 0.00 -2.02 0.00 0.00 63.50 62.01 3hdj n PRO 250 Cb 0.53 -1.87 0.07 0.00 -0.02 0.00 0.00 33.50 32.21 3hdj n PRO 250 CO 0.00 0.00 0.00 0.22 1.98 0.00 0.00 175.50 177.70 3hdj h ASP 251 N 0.00 0.99 -0.10 2.55 1.82 -2.01 -3.12 116.42 116.55 3hdj h ASP 251 Ca 0.00 -0.25 0.03 0.00 -0.39 0.00 0.00 57.03 56.42 3hdj h ASP 251 Cb 0.33 -0.26 -0.00 0.00 0.68 0.00 0.00 39.33 40.07 3hdj h ASP 251 CO 0.00 1.01 0.09 0.71 -1.61 0.00 0.00 179.24 179.44 3hdj h THR 252 N 0.95 0.60 -0.54 2.25 1.35 -1.77 -3.45 112.91 112.30 3hdj h THR 252 Ca 0.18 0.00 -0.23 0.00 -0.55 0.00 0.00 66.41 65.81 3hdj h THR 252 Cb 0.47 0.93 -0.09 0.00 -1.73 0.00 0.00 68.15 67.73 3hdj h THR 252 CO 0.02 0.00 -0.21 0.61 -0.25 0.00 0.00 175.52 175.69 3hdj n GLY 253 N -1.41 1.20 0.27 5.82 0.00 -1.18 -4.33 105.19 105.57 3hdj n GLY 253 Ca -0.01 -0.24 -0.01 0.00 0.00 0.00 0.00 46.02 45.77 3hdj n GLY 253 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3hdj h LEU 254 N 0.00 -0.73 -0.80 0.99 5.85 -1.86 -2.69 115.31 116.07 3hdj h LEU 254 Ca -0.23 0.21 0.07 0.00 0.84 0.00 0.00 57.88 58.76 3hdj h LEU 254 Cb 0.92 0.45 -0.10 0.00 0.37 0.00 0.00 40.66 42.30 3hdj h LEU 254 CO 0.34 -0.24 -0.47 -0.67 -0.34 0.00 0.00 178.44 177.06 3hdj n ASP 255 N -5.45 -0.85 0.01 1.25 -0.08 -1.26 -1.23 116.55 108.94 3hdj n ASP 255 Ca 0.08 1.59 0.09 0.00 -1.51 0.00 0.00 54.79 55.03 3hdj n ASP 255 Cb 0.35 -0.26 0.39 0.00 2.34 0.00 0.00 41.12 43.93 3hdj n ASP 255 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 3hdj n ALA 256 N -3.23 1.80 0.50 -1.67 0.00 -1.02 -2.78 120.51 114.13 3hdj n ALA 256 Ca 0.02 -0.05 0.06 0.00 0.00 0.00 0.00 53.44 53.47 3hdj n ALA 256 Cb 0.21 -1.30 0.05 0.00 0.00 0.00 0.00 19.45 18.42 3hdj n ALA 256 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.50 177.86 3hdj n LYS 257 N -1.58 0.75 -2.39 0.00 2.85 -0.36 -4.96 118.16 112.47 3hdj n LYS 257 Ca 0.04 -1.25 -0.41 0.00 -1.05 0.00 0.00 58.31 55.64 3hdj n LYS 257 Cb 0.21 -1.24 -0.03 0.00 -0.65 0.00 0.00 35.03 33.32 3hdj n LYS 257 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 177.40 177.43 3hdj s VAL 258 N -1.03 3.68 0.06 0.58 1.01 -0.81 -1.54 120.40 122.35 3hdj s VAL 258 Ca 0.15 1.36 0.02 0.00 0.00 0.00 0.00 61.98 63.51 3hdj s VAL 258 Cb 0.10 -3.87 -0.03 0.00 0.00 0.00 0.00 36.38 32.59 3hdj s VAL 258 CO 0.15 0.19 -0.08 0.68 0.00 0.00 0.00 175.10 176.05 3hdj s VAL 259 N 0.20 0.60 0.05 2.92 -7.23 -0.12 -4.92 120.40 111.90 3hdj s VAL 259 Ca 0.54 -1.29 -0.13 0.00 -1.81 0.00 0.00 61.98 59.29 3hdj s VAL 259 Cb -0.32 -0.87 -0.06 0.00 0.56 0.00 0.00 36.38 35.69 3hdj s VAL 259 CO 0.35 -0.49 0.43 -1.61 -0.31 0.00 0.00 175.10 173.47 3hdj s GLU 260 N -2.10 3.88 0.22 4.82 2.02 -1.26 -0.94 118.70 125.34 3hdj s GLU 260 Ca -0.05 0.35 -0.08 0.00 0.02 0.00 0.00 54.97 55.21 3hdj s GLU 260 Cb -0.07 -3.11 0.29 0.00 0.10 0.00 0.00 34.13 31.34 3hdj s GLU 260 CO -0.01 0.62 1.78 1.25 0.02 0.00 0.00 175.26 178.93 3hdj h LEU 261 N 4.24 0.43 -0.97 1.80 5.85 -0.89 -1.27 115.31 124.51 3hdj h LEU 261 Ca -0.50 0.05 0.11 0.00 0.84 0.00 0.00 57.88 58.38 3hdj h LEU 261 Cb 1.21 -0.02 -0.08 0.00 0.37 0.00 0.00 40.66 42.14 3hdj h LEU 261 CO 0.64 0.26 0.60 0.00 -0.34 0.00 0.00 178.44 179.59 3hdj h ALA 262 N 1.40 1.43 -0.29 1.25 0.00 -1.84 0.47 119.26 121.68 3hdj h ALA 262 Ca 0.32 0.02 -0.10 0.00 0.00 0.00 0.00 54.91 55.15 3hdj h ALA 262 Cb 0.31 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 3hdj h ALA 262 CO -0.25 0.22 -0.23 -0.44 0.00 0.00 0.00 179.25 178.55 3hdj h ASP 263 N 0.97 0.57 0.23 0.00 3.32 -1.61 -0.39 116.42 119.51 3hdj h ASP 263 Ca 0.47 -0.19 -0.01 0.00 0.02 0.00 0.00 57.03 57.32 3hdj h ASP 263 Cb 0.43 -0.15 0.00 0.00 0.22 0.00 0.00 39.33 39.83 3hdj h ASP 263 CO -0.25 0.79 -0.11 0.58 -1.72 0.00 0.00 179.24 178.53 3hdj h VAL 264 N 0.50 0.82 -0.20 -1.35 2.07 -0.79 0.98 116.25 118.29 3hdj h VAL 264 Ca 0.07 -0.36 -0.03 0.00 0.82 0.00 0.00 66.70 67.21 3hdj h VAL 264 Cb 0.67 1.03 -0.01 0.00 -1.52 0.00 0.00 31.29 31.46 3hdj h VAL 264 CO 0.05 0.08 0.01 -0.07 0.02 0.00 0.00 177.57 177.66 3hdj h LEU 265 N -0.49 0.26 0.00 2.57 3.38 -0.83 -1.45 115.31 118.74 3hdj h LEU 265 Ca -0.03 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.91 3hdj h LEU 265 Cb 0.37 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.05 3hdj h LEU 265 CO 0.05 0.31 0.00 0.00 0.09 0.00 0.00 178.44 178.89 3hdj n ALA 266 N -2.50 2.20 -2.53 1.53 0.00 -0.17 -4.92 120.51 114.13 3hdj n ALA 266 Ca -0.00 -0.10 -0.11 0.00 0.00 0.00 0.00 53.44 53.23 3hdj n ALA 266 Cb 0.18 -1.41 0.01 0.00 0.00 0.00 0.00 19.45 18.23 3hdj n ALA 266 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3hdj n GLY 267 N 1.01 0.05 0.01 0.00 0.00 -0.55 -4.95 105.19 100.76 3hdj n GLY 267 Ca 0.08 -0.36 0.10 0.00 0.00 0.00 0.00 46.02 45.84 3hdj n GLY 267 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3hdj n ARG 268 N -2.29 0.61 0.03 1.61 1.74 0.31 -4.70 116.66 113.96 3hdj n ARG 268 Ca -0.07 -0.16 -0.10 0.00 -0.77 0.00 0.00 57.85 56.75 3hdj n ARG 268 Cb 0.57 -1.45 -0.13 0.00 -1.02 0.00 0.00 32.46 30.42 3hdj n ARG 268 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3hdj h ALA 269 N 1.86 0.49 -6.82 7.54 0.00 -1.76 -3.48 119.26 117.09 3hdj h ALA 269 Ca 0.00 -1.17 -0.57 0.00 0.00 0.00 0.00 54.91 53.17 3hdj h ALA 269 Cb 0.84 0.19 -0.08 0.00 0.00 0.00 0.00 17.79 18.75 3hdj h ALA 269 CO 0.00 1.35 -0.97 0.00 0.00 0.00 0.00 179.25 179.64 3hdj n ALA 270 N -2.51 -2.28 -0.11 0.00 0.00 -1.26 -4.88 120.51 109.47 3hdj n ALA 270 Ca -0.10 -0.43 -0.13 0.00 0.00 0.00 0.00 53.44 52.78 3hdj n ALA 270 Cb 1.01 -1.94 -0.03 0.00 0.00 0.00 0.00 19.45 18.48 3hdj n ALA 270 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3hdj h ALA 271 N 1.09 0.49 -2.54 0.00 0.00 -1.96 -3.41 119.26 112.93 3hdj h ALA 271 Ca -0.67 -0.41 -0.61 0.00 0.00 0.00 0.00 54.91 53.22 3hdj h ALA 271 Cb 1.39 -0.11 -0.11 0.00 0.00 0.00 0.00 17.79 18.96 3hdj h ALA 271 CO 0.60 0.52 0.09 0.50 0.00 0.00 0.00 179.25 180.97 3hdj s ARG 272 N -4.42 4.13 -0.07 0.00 3.52 -1.26 -4.76 118.95 116.09 3hdj s ARG 272 Ca -0.12 0.50 0.15 0.00 -0.13 0.00 0.00 55.73 56.13 3hdj s ARG 272 Cb 0.10 -3.63 -0.22 0.00 -1.56 0.00 0.00 34.95 29.64 3hdj s ARG 272 CO 0.85 -0.34 0.53 1.04 -0.81 0.00 0.00 175.30 176.57 3hdj n GLN 273 N 5.45 0.65 -3.62 5.12 6.02 -1.26 -5.02 117.38 124.70 3hdj n GLN 273 Ca -0.02 0.19 -0.13 0.00 -0.01 0.00 0.00 57.00 57.03 3hdj n GLN 273 Cb 0.49 -1.72 -0.06 0.00 1.02 0.00 0.00 30.24 29.98 3hdj n GLN 273 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3hdj s ALA 274 N -2.66 -1.13 0.55 -1.58 0.00 -1.26 -5.04 121.76 110.64 3hdj s ALA 274 Ca -0.06 0.39 0.23 0.00 0.00 0.00 0.00 51.96 52.52 3hdj s ALA 274 Cb 0.08 0.40 1.45 0.00 0.00 0.00 0.00 23.12 25.05 3hdj s ALA 274 CO 0.83 -0.50 2.10 0.22 0.00 0.00 0.00 175.76 178.41 3hdj h ASP 275 N 2.85 0.00 1.53 0.00 3.58 -1.99 -2.31 116.42 120.09 3hdj h ASP 275 Ca -0.31 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.14 3hdj h ASP 275 Cb 1.21 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.26 3hdj h ASP 275 CO 0.43 0.00 0.00 1.05 -2.88 0.00 0.00 179.24 177.84 3hdj h GLU 276 N 0.00 0.00 -6.82 0.28 4.11 -1.93 -3.32 114.58 106.90 3hdj h GLU 276 Ca 0.10 0.00 -0.53 0.00 0.07 0.00 0.00 59.36 59.00 3hdj h GLU 276 Cb 0.44 0.00 0.08 0.00 0.50 0.00 0.00 28.75 29.77 3hdj h GLU 276 CO -0.00 0.00 0.83 -0.51 0.07 0.00 0.00 179.01 179.40 3hdj s ASP 277 N -5.30 6.44 -0.04 3.06 1.01 -0.87 -0.85 116.67 120.12 3hdj s ASP 277 Ca 0.07 2.90 -0.21 0.00 0.71 0.00 0.00 52.55 56.02 3hdj s ASP 277 Cb 0.09 -2.64 -0.05 0.00 1.01 0.00 0.00 42.92 41.33 3hdj s ASP 277 CO 0.59 -0.84 0.61 -0.63 0.21 0.00 0.00 175.17 175.12 3hdj s ILE 278 N -0.29 4.98 -0.06 0.77 1.01 -1.26 -3.22 121.20 123.13 3hdj s ILE 278 Ca 0.60 1.27 0.04 0.00 0.00 0.00 0.00 60.65 62.56 3hdj s ILE 278 Cb -0.46 -3.95 -0.00 0.00 0.01 0.00 0.00 42.46 38.06 3hdj s ILE 278 CO 0.50 0.36 -0.20 -0.69 0.00 0.00 0.00 174.94 174.91 3hdj s VAL 279 N 0.20 1.70 -0.12 2.92 1.01 -0.44 0.14 120.40 125.82 3hdj s VAL 279 Ca 0.32 -0.85 0.00 0.00 0.00 0.00 0.00 61.98 61.46 3hdj s VAL 279 Cb -0.18 -1.47 -0.02 0.00 0.00 0.00 0.00 36.38 34.72 3hdj s VAL 279 CO 0.17 0.48 -0.13 -0.63 0.00 0.00 0.00 175.10 174.99 3hdj s ILE 280 N 0.15 3.06 -0.18 2.22 1.01 -0.81 -0.76 121.20 125.88 3hdj s ILE 280 Ca -0.09 -0.67 -0.02 0.00 0.00 0.00 0.00 60.65 59.87 3hdj s ILE 280 Cb -0.14 -2.27 -0.01 0.00 0.01 0.00 0.00 42.46 40.05 3hdj s ILE 280 CO 0.04 0.54 -0.08 -0.47 0.00 0.00 0.00 174.94 174.97 3hdj s TYR 281 N 0.16 2.90 -0.26 3.97 5.04 0.11 0.45 117.35 129.71 3hdj s TYR 281 Ca -0.07 -0.80 -0.05 0.00 -2.44 0.00 0.00 57.07 53.71 3hdj s TYR 281 Cb -0.15 -1.98 0.01 0.00 0.35 0.00 0.00 41.96 40.19 3hdj s TYR 281 CO 0.05 -0.38 0.02 0.21 -1.34 0.00 0.00 175.55 174.10 3hdj s LYS 282 N 0.92 3.13 -0.20 4.97 2.47 -0.31 -0.66 119.74 130.05 3hdj s LYS 282 Ca -0.02 -0.81 -0.10 0.00 -1.56 0.00 0.00 55.97 53.48 3hdj s LYS 282 Cb -0.15 -3.19 -0.05 0.00 -1.46 0.00 0.00 37.83 32.98 3hdj s LYS 282 CO 0.00 -0.36 0.14 0.45 0.16 0.00 0.00 175.35 175.74 3hdj s SER 283 N 1.46 6.21 -0.01 1.43 0.15 -0.57 -4.29 113.70 118.08 3hdj s SER 283 Ca 0.03 0.23 0.06 0.00 0.70 0.00 0.00 55.95 56.97 3hdj s SER 283 Cb -0.16 -2.09 -0.09 0.00 -1.71 0.00 0.00 66.02 61.97 3hdj s SER 283 CO -0.00 0.17 0.15 1.33 1.20 0.00 0.00 173.24 176.08 3hdj n VAL 284 N 3.58 0.00 -0.40 4.45 0.24 -1.26 -4.65 118.33 120.28 3hdj n VAL 284 Ca -0.16 -0.18 0.00 0.00 -2.04 0.00 0.00 64.34 61.97 3hdj n VAL 284 Cb 0.52 0.48 0.00 0.00 -1.47 0.00 0.00 33.84 33.37 3hdj n VAL 284 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3hdj n GLY 285 N 1.98 -3.28 3.36 7.63 0.00 -1.26 -4.94 105.19 108.68 3hdj n GLY 285 Ca -0.01 -0.83 -0.19 0.00 0.00 0.00 0.00 46.02 44.99 3hdj n GLY 285 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3hdj s VAL 286 N -0.13 1.47 0.27 1.61 -7.23 -1.26 -5.01 120.40 110.11 3hdj s VAL 286 Ca 0.00 -2.12 0.24 0.00 -1.81 0.00 0.00 61.98 58.30 3hdj s VAL 286 Cb 0.00 -2.26 0.24 0.00 0.56 0.00 0.00 36.38 34.92 3hdj s VAL 286 CO 0.00 -0.43 1.92 1.23 -0.31 0.00 0.00 175.10 177.51 3hdj h GLY 287 N 2.45 0.00 0.38 2.32 0.00 -1.78 -2.01 103.07 104.42 3hdj h GLY 287 Ca -0.39 0.00 0.15 0.00 0.00 0.00 0.00 47.33 47.10 3hdj h GLY 287 CO 0.65 0.00 0.61 -2.00 0.00 0.00 0.00 176.54 175.80 3hdj h LEU 288 N 0.00 0.77 0.00 3.11 5.85 -1.90 -2.92 115.31 120.23 3hdj h LEU 288 Ca -0.00 0.06 -0.05 0.00 0.84 0.00 0.00 57.88 58.72 3hdj h LEU 288 Cb 0.59 -0.09 0.00 0.00 0.37 0.00 0.00 40.66 41.53 3hdj h LEU 288 CO 0.03 0.36 -0.21 -0.33 -0.34 0.00 0.00 178.44 177.95 3hdj h GLU 289 N 0.80 0.13 -0.05 1.25 5.08 -1.75 -1.55 114.58 118.49 3hdj h GLU 289 Ca 0.50 -0.15 -0.15 0.00 -1.00 0.00 0.00 59.36 58.57 3hdj h GLU 289 Cb 0.73 0.04 -0.01 0.00 0.50 0.00 0.00 28.75 30.01 3hdj h GLU 289 CO -0.27 0.91 -0.63 -0.44 -1.00 0.00 0.00 179.01 177.58 3hdj h ASP 290 N -0.58 0.21 -0.16 1.42 3.32 -1.69 -1.90 116.42 117.04 3hdj h ASP 290 Ca -0.03 -0.13 -0.01 0.00 0.02 0.00 0.00 57.03 56.89 3hdj h ASP 290 Cb 0.99 -0.06 -0.01 0.00 0.22 0.00 0.00 39.33 40.47 3hdj h ASP 290 CO 0.04 0.79 0.06 0.58 -1.72 0.00 0.00 179.24 178.99 3hdj h VAL 291 N 0.13 1.17 -0.60 -1.35 2.07 -1.56 -1.00 116.25 115.11 3hdj h VAL 291 Ca -0.01 -0.51 0.05 0.00 0.82 0.00 0.00 66.70 67.05 3hdj h VAL 291 Cb 1.14 1.21 -0.05 0.00 -1.52 0.00 0.00 31.29 32.07 3hdj h VAL 291 CO 0.09 0.16 0.32 0.00 0.02 0.00 0.00 177.57 178.16 3hdj h ALA 292 N 0.89 0.79 -0.11 1.67 0.00 -1.19 -0.37 119.26 120.95 3hdj h ALA 292 Ca 0.05 0.02 -0.22 0.00 0.00 0.00 0.00 54.91 54.76 3hdj h ALA 292 Cb 0.20 -0.10 0.01 0.00 0.00 0.00 0.00 17.79 17.90 3hdj h ALA 292 CO -0.00 -0.01 -0.81 -0.07 0.00 0.00 0.00 179.25 178.35 3hdj h LEU 293 N 0.60 0.81 -0.97 0.00 3.38 -1.22 -1.93 115.31 115.98 3hdj h LEU 293 Ca 0.27 -0.55 -0.07 0.00 0.09 0.00 0.00 57.88 57.61 3hdj h LEU 293 Cb 0.17 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.66 3hdj h LEU 293 CO -0.18 1.34 -0.04 0.00 0.09 0.00 0.00 178.44 179.65 3hdj h ALA 294 N 0.64 1.14 -0.46 1.53 0.00 -1.10 -0.70 119.26 120.31 3hdj h ALA 294 Ca -0.06 -0.27 -0.08 0.00 0.00 0.00 0.00 54.91 54.51 3hdj h ALA 294 Cb 1.43 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 19.03 3hdj h ALA 294 CO 0.16 0.55 -0.02 0.78 0.00 0.00 0.00 179.25 180.72 3hdj h GLY 295 N 0.95 0.88 0.96 0.00 0.00 -0.87 0.06 103.07 105.06 3hdj h GLY 295 Ca 0.13 -0.67 -0.01 0.00 0.00 0.00 0.00 47.33 46.78 3hdj h GLY 295 CO 0.02 0.61 0.20 -1.82 0.00 0.00 0.00 176.54 175.55 3hdj h TYR 296 N 0.66 0.57 -0.69 5.60 3.20 -1.15 0.22 116.97 125.38 3hdj h TYR 296 Ca 0.13 -0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.98 3hdj h TYR 296 Cb 0.53 -0.18 -0.03 0.00 1.54 0.00 0.00 36.73 38.59 3hdj h TYR 296 CO 0.04 0.47 0.45 0.00 -1.64 0.00 0.00 178.16 177.47 3hdj h ALA 297 N 1.05 0.88 -0.18 1.82 0.00 -0.90 0.07 119.26 122.00 3hdj h ALA 297 Ca 0.14 -0.06 0.02 0.00 0.00 0.00 0.00 54.91 55.01 3hdj h ALA 297 Cb 0.11 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.59 3hdj h ALA 297 CO -0.02 0.32 0.04 -0.92 0.00 0.00 0.00 179.25 178.67 3hdj h TYR 298 N 0.94 0.07 -0.55 0.00 3.20 -0.54 0.13 116.97 120.23 3hdj h TYR 298 Ca 0.25 0.01 -0.03 0.00 3.14 0.00 0.00 58.73 62.10 3hdj h TYR 298 Cb -0.09 -0.01 -0.02 0.00 1.54 0.00 0.00 36.73 38.15 3hdj h TYR 298 CO -0.02 0.03 0.23 -0.09 -1.64 0.00 0.00 178.16 176.67 3hdj h ARG 299 N 0.12 0.82 -0.08 1.82 2.43 -0.50 0.25 114.38 119.24 3hdj h ARG 299 Ca 0.08 -0.14 -0.00 0.00 -0.81 0.00 0.00 59.98 59.10 3hdj h ARG 299 Cb 0.06 -0.14 -0.00 0.00 -0.42 0.00 0.00 29.97 29.47 3hdj h ARG 299 CO -0.10 0.70 0.03 0.00 -1.51 0.00 0.00 179.97 179.10 3hdj h ARG 300 N 0.75 0.12 -0.38 0.20 3.08 -0.80 -2.26 114.38 115.09 3hdj h ARG 300 Ca 0.19 -0.02 -0.12 0.00 0.07 0.00 0.00 59.98 60.10 3hdj h ARG 300 Cb 0.18 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.20 3hdj h ARG 300 CO -0.02 0.23 -0.25 -0.07 -1.07 0.00 0.00 179.97 178.80 3hdj h LEU 301 N -0.03 0.78 -0.26 3.04 3.38 -0.44 -2.31 115.31 119.49 3hdj h LEU 301 Ca 0.03 -0.29 0.03 0.00 0.09 0.00 0.00 57.88 57.73 3hdj h LEU 301 Cb 0.16 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 40.66 3hdj h LEU 301 CO -0.00 1.00 0.08 0.00 0.09 0.00 0.00 178.44 179.60 3hdj h ALA 302 N 1.06 0.28 -0.94 1.53 0.00 -0.45 0.15 119.26 120.90 3hdj h ALA 302 Ca 0.09 0.03 0.03 0.00 0.00 0.00 0.00 54.91 55.06 3hdj h ALA 302 Cb 0.76 0.03 -0.05 0.00 0.00 0.00 0.00 17.79 18.52 3hdj h ALA 302 CO 0.06 -0.34 0.61 0.00 0.00 0.00 0.00 179.25 179.59 3hdj h ALA 303 N 1.17 1.23 -0.07 0.00 0.00 -1.31 0.30 119.26 120.58 3hdj h ALA 303 Ca 0.12 -0.05 -0.14 0.00 0.00 0.00 0.00 54.91 54.84 3hdj h ALA 303 Cb 0.09 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.53 3hdj h ALA 303 CO -0.13 0.50 -0.56 1.96 0.00 0.00 0.00 179.25 181.02 3hdj h GLN 304 N 1.20 0.22 -0.03 0.00 4.20 -0.91 -3.36 115.11 116.43 3hdj h GLN 304 Ca 0.37 -0.14 0.00 0.00 0.06 0.00 0.00 58.65 58.94 3hdj h GLN 304 Cb -0.03 0.02 0.00 0.00 0.30 0.00 0.00 27.48 27.77 3hdj h GLN 304 CO -0.11 0.72 0.00 0.54 -0.67 0.00 0.00 178.83 179.31 3hdj n ARG 305 N -3.90 0.23 -2.27 1.46 1.74 0.49 -5.00 116.66 109.41 3hdj n ARG 305 Ca -0.02 -1.00 -0.09 0.00 -0.77 0.00 0.00 57.85 55.96 3hdj n ARG 305 Cb 0.58 -1.14 -0.00 0.00 -1.02 0.00 0.00 32.46 30.89 3hdj n ARG 305 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3hdj n GLY 306 N 0.38 0.02 3.84 -0.13 0.00 0.98 -5.02 105.19 105.25 3hdj n GLY 306 Ca 0.04 -0.47 -0.31 0.00 0.00 0.00 0.00 46.02 45.28 3hdj n GLY 306 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 3hdj s TRP 307 N -2.54 3.29 0.44 1.61 0.51 -0.80 -5.02 118.94 116.44 3hdj s TRP 307 Ca 0.03 1.38 -0.25 0.00 -2.12 0.00 0.00 56.10 55.14 3hdj s TRP 307 Cb -0.01 -2.83 -0.08 0.00 -0.81 0.00 0.00 33.47 29.74 3hdj s TRP 307 CO 0.04 -1.03 1.34 -2.14 -0.51 0.00 0.00 176.95 174.64 3hdj s PRO 308 N -5.04 3.74 0.60 4.98 0.02 -1.26 -4.69 135.00 133.34 3hdj s PRO 308 Ca 0.57 2.21 -0.20 0.00 0.02 0.00 0.00 61.00 63.61 3hdj s PRO 308 Cb -0.13 -2.62 -0.03 0.00 0.02 0.00 0.00 34.50 31.74 3hdj s PRO 308 CO 0.54 -0.70 1.30 0.00 -0.33 0.00 0.00 177.00 177.81 3hdj s ALA 309 N -1.28 2.58 -1.85 -1.55 0.00 -1.26 -4.96 121.76 113.45 3hdj s ALA 309 Ca 0.61 1.22 0.00 0.00 0.00 0.00 0.00 51.96 53.79 3hdj s ALA 309 Cb -0.39 -3.54 0.00 0.00 0.00 0.00 0.00 23.12 19.19 3hdj s ALA 309 CO 0.50 -1.42 0.46 -2.30 0.00 0.00 0.00 175.76 173.00