#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hjv n LYS 8 N 0.00 1.98 -4.07 1.43 4.81 -1.26 -4.88 118.16 116.17 3hjv n LYS 8 Ca 0.00 0.71 -0.09 0.00 -0.87 0.00 0.00 58.31 58.07 3hjv n LYS 8 Cb 0.00 -2.44 -0.09 0.00 0.02 0.00 0.00 35.03 32.52 3hjv n LYS 8 CO 0.00 0.00 0.00 -0.59 1.17 0.00 0.00 177.40 177.98 3hjv s PHE 9 N 0.62 0.60 0.21 5.64 -0.12 -1.26 -0.52 117.98 123.15 3hjv s PHE 9 Ca 0.77 -1.04 0.11 0.00 -0.05 0.00 0.00 56.93 56.72 3hjv s PHE 9 Cb -0.71 -0.35 -0.05 0.00 -0.63 0.00 0.00 43.02 41.29 3hjv s PHE 9 CO 0.42 -0.49 -0.22 0.00 -0.05 0.00 0.00 175.22 174.87 3hjv s ALA 10 N -3.97 2.50 -0.13 1.99 0.00 -0.38 -0.45 121.76 121.32 3hjv s ALA 10 Ca 0.15 -1.68 -0.01 0.00 0.00 0.00 0.00 51.96 50.42 3hjv s ALA 10 Cb 0.07 -0.29 -0.02 0.00 0.00 0.00 0.00 23.12 22.88 3hjv s ALA 10 CO -0.04 0.36 -0.10 0.42 0.00 0.00 0.00 175.76 176.40 3hjv s ILE 11 N -1.94 3.34 0.05 0.00 1.01 -0.98 -0.41 121.20 122.26 3hjv s ILE 11 Ca 0.22 -0.57 0.09 0.00 0.00 0.00 0.00 60.65 60.39 3hjv s ILE 11 Cb -0.07 -2.41 -0.03 0.00 0.01 0.00 0.00 42.46 39.96 3hjv s ILE 11 CO 0.10 0.52 -0.24 0.68 0.00 0.00 0.00 174.94 176.01 3hjv s VAL 12 N 0.23 1.95 -0.09 2.92 -7.23 -0.17 -2.33 120.40 115.69 3hjv s VAL 12 Ca -0.07 -1.35 0.03 0.00 -1.81 0.00 0.00 61.98 58.78 3hjv s VAL 12 Cb -0.15 -1.69 -0.01 0.00 0.56 0.00 0.00 36.38 35.09 3hjv s VAL 12 CO 0.04 0.26 -0.20 -0.36 -0.31 0.00 0.00 175.10 174.54 3hjv s PHE 13 N -0.84 2.61 0.68 2.82 0.08 -0.70 -4.30 117.98 118.34 3hjv s PHE 13 Ca 0.10 -0.75 -0.10 0.00 0.12 0.00 0.00 56.93 56.30 3hjv s PHE 13 Cb -0.10 -1.71 0.02 0.00 -0.57 0.00 0.00 43.02 40.66 3hjv s PHE 13 CO 0.02 -0.24 1.05 -1.25 -0.10 0.00 0.00 175.22 174.71 3hjv s PRO 14 N 0.09 2.84 0.00 0.24 0.04 -1.26 -1.38 135.00 135.57 3hjv s PRO 14 Ca -0.09 0.33 0.00 0.00 0.04 0.00 0.00 61.00 61.28 3hjv s PRO 14 Cb -0.15 -2.08 0.00 0.00 0.04 0.00 0.00 34.50 32.31 3hjv s PRO 14 CO 0.06 -0.97 0.00 0.41 0.04 0.00 0.00 177.00 176.53 3hjv n GLY 15 N -2.92 6.52 3.55 0.56 0.00 -1.23 -3.63 105.19 108.04 3hjv n GLY 15 Ca 0.06 -2.04 -0.46 0.00 0.00 0.00 0.00 46.02 43.58 3hjv n GLY 15 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3hjv n GLN 16 N -0.01 1.04 0.00 1.61 6.02 -1.26 -2.36 117.38 122.41 3hjv n GLN 16 Ca 0.00 0.37 0.00 0.00 -0.01 0.00 0.00 57.00 57.36 3hjv n GLN 16 Cb 0.00 -1.68 0.00 0.00 1.02 0.00 0.00 30.24 29.58 3hjv n GLN 16 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3hjv n GLY 17 N 1.47 1.93 0.08 1.08 0.00 -1.26 -4.91 105.19 103.59 3hjv n GLY 17 Ca 0.12 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.27 3hjv n GLY 17 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3hjv n SER 18 N 0.00 0.61 -4.75 1.61 7.64 -1.00 -4.85 113.62 112.88 3hjv n SER 18 Ca 0.00 0.57 -0.35 0.00 1.01 0.00 0.00 58.87 60.09 3hjv n SER 18 Cb 0.00 -0.73 0.04 0.00 -1.01 0.00 0.00 64.21 62.52 3hjv n SER 18 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3hjv s GLN 19 N -3.09 2.82 -0.18 1.43 0.00 -1.26 -4.33 119.66 115.04 3hjv s GLN 19 Ca 0.11 1.75 -0.19 0.00 -0.00 0.00 0.00 55.36 57.02 3hjv s GLN 19 Cb 0.13 -1.92 0.05 0.00 0.00 0.00 0.00 33.01 31.28 3hjv s GLN 19 CO 0.56 -1.31 0.53 0.00 0.00 0.00 0.00 175.29 175.07 3hjv s ALA 20 N -1.77 -1.31 0.19 2.60 0.00 -1.26 -5.07 121.76 115.13 3hjv s ALA 20 Ca 0.75 1.43 -0.32 0.00 0.00 0.00 0.00 51.96 53.82 3hjv s ALA 20 Cb -0.28 -0.78 -0.12 0.00 0.00 0.00 0.00 23.12 21.94 3hjv s ALA 20 CO 0.36 -0.26 1.75 0.08 0.00 0.00 0.00 175.76 177.69 3hjv s VAL 21 N 0.13 2.16 0.00 0.00 1.01 -1.26 -4.92 120.40 117.52 3hjv s VAL 21 Ca -0.01 0.03 0.00 0.00 0.00 0.00 0.00 61.98 62.00 3hjv s VAL 21 Cb -0.04 -3.02 0.00 0.00 0.00 0.00 0.00 36.38 33.33 3hjv s VAL 21 CO 0.01 0.00 0.00 0.61 0.00 0.00 0.00 175.10 175.73 3hjv n GLY 22 N 4.04 -0.66 0.05 4.51 0.00 0.47 -4.99 105.19 108.61 3hjv n GLY 22 Ca 0.16 -0.68 0.00 0.00 0.00 0.00 0.00 46.02 45.51 3hjv n GLY 22 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3hjv n LEU 24 N 0.00 0.00 -0.15 0.99 4.32 -1.26 -4.75 117.00 116.15 3hjv n LEU 24 Ca 0.00 0.00 -0.03 0.00 -0.02 0.00 0.00 56.01 55.96 3hjv n LEU 24 Cb 0.00 -0.01 0.05 0.00 -1.62 0.00 0.00 43.42 41.84 3hjv n LEU 24 CO 0.00 0.00 0.84 0.00 -1.22 0.00 0.00 177.39 177.01 3hjv h ALA 25 N 0.00 0.44 0.38 -1.18 0.00 -1.98 -0.49 119.26 116.43 3hjv h ALA 25 Ca 0.00 0.14 -0.01 0.00 0.00 0.00 0.00 54.91 55.04 3hjv h ALA 25 Cb 0.00 0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 3hjv h ALA 25 CO 0.00 -0.39 -0.27 0.22 0.00 0.00 0.00 179.25 178.81 3hjv h ASP 26 N 0.11 -0.69 -0.72 0.00 3.58 -1.95 -2.24 116.42 114.50 3hjv h ASP 26 Ca 0.24 0.05 0.06 0.00 0.42 0.00 0.00 57.03 57.80 3hjv h ASP 26 Cb 0.35 0.22 -0.06 0.00 1.72 0.00 0.00 39.33 41.56 3hjv h ASP 26 CO -0.39 -0.41 0.41 -0.07 -2.88 0.00 0.00 179.24 175.89 3hjv h LEU 27 N -0.64 0.61 -1.89 2.28 3.38 -1.82 -2.51 115.31 114.73 3hjv h LEU 27 Ca -0.03 0.03 -0.03 0.00 0.09 0.00 0.00 57.88 57.94 3hjv h LEU 27 Cb 0.54 -0.09 -0.00 0.00 0.09 0.00 0.00 40.66 41.20 3hjv h LEU 27 CO 0.01 0.39 -0.13 0.00 0.09 0.00 0.00 178.44 178.80 3hjv h ALA 28 N 1.37 1.32 -0.00 1.53 0.00 -0.87 -0.31 119.26 122.29 3hjv h ALA 28 Ca 0.33 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 55.12 3hjv h ALA 28 Cb 0.21 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.98 3hjv h ALA 28 CO -0.19 0.16 -0.14 0.39 0.00 0.00 0.00 179.25 179.46 3hjv n GLU 29 N -3.70 0.46 -0.05 0.00 -0.58 -0.86 -4.16 120.64 111.74 3hjv n GLU 29 Ca -0.02 -0.15 -0.06 0.00 -0.42 0.00 0.00 57.16 56.51 3hjv n GLU 29 Cb 0.24 -1.50 -0.06 0.00 -0.57 0.00 0.00 31.44 29.55 3hjv n GLU 29 CO 0.00 0.00 0.00 0.94 -0.48 0.00 0.00 177.13 177.59 3hjv n GLN 30 N -1.14 1.50 -4.01 3.49 7.27 -0.59 -4.99 117.38 118.91 3hjv n GLN 30 Ca 0.12 0.03 -0.30 0.00 0.07 0.00 0.00 57.00 56.91 3hjv n GLN 30 Cb 0.30 -1.23 -0.16 0.00 2.41 0.00 0.00 30.24 31.56 3hjv n GLN 30 CO 0.00 0.00 0.00 0.71 0.07 0.00 0.00 177.06 177.84 3hjv s TYR 31 N -2.22 2.34 0.46 3.69 2.02 -0.23 -5.02 117.35 118.40 3hjv s TYR 31 Ca -0.09 -1.45 0.27 0.00 -0.37 0.00 0.00 57.07 55.42 3hjv s TYR 31 Cb 0.03 -1.64 1.32 0.00 -0.40 0.00 0.00 41.96 41.27 3hjv s TYR 31 CO 0.32 -0.72 1.77 0.00 -1.57 0.00 0.00 175.55 175.35 3hjv h ALA 32 N 8.00 2.65 0.00 3.71 0.00 -1.87 -2.57 119.26 129.18 3hjv h ALA 32 Ca -0.33 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.60 3hjv h ALA 32 Cb 1.11 0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.97 3hjv h ALA 32 CO 0.51 -1.04 -0.03 -0.24 0.00 0.00 0.00 179.25 178.44 3hjv h VAL 33 N 0.20 0.16 0.66 0.00 3.04 -1.95 -1.96 116.25 116.41 3hjv h VAL 33 Ca 0.60 -0.31 -0.03 0.00 -1.01 0.00 0.00 66.70 65.95 3hjv h VAL 33 Cb 1.91 1.26 0.01 0.00 -2.01 0.00 0.00 31.29 32.45 3hjv h VAL 33 CO -0.18 0.03 -0.32 0.58 -1.01 0.00 0.00 177.57 176.67 3hjv h VAL 34 N 0.00 0.19 0.00 1.51 2.07 -1.74 -0.28 116.25 118.00 3hjv h VAL 34 Ca -0.00 -0.28 -0.06 0.00 0.82 0.00 0.00 66.70 67.18 3hjv h VAL 34 Cb 0.25 0.25 -0.01 0.00 -1.52 0.00 0.00 31.29 30.26 3hjv h VAL 34 CO 0.00 0.02 -0.26 0.11 0.02 0.00 0.00 177.57 177.46 3hjv h LYS 35 N -1.12 0.00 -0.68 1.57 1.57 -1.72 -2.23 116.57 113.96 3hjv h LYS 35 Ca -0.09 0.00 -0.06 0.00 -1.87 0.00 0.00 60.65 58.63 3hjv h LYS 35 Cb 0.71 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 33.00 3hjv h LYS 35 CO 0.15 0.26 0.19 0.37 -0.57 0.00 0.00 179.45 179.85 3hjv h GLN 36 N 0.00 1.08 -0.30 3.15 4.15 -1.26 0.66 115.11 122.59 3hjv h GLN 36 Ca -0.00 -0.25 -0.02 0.00 0.77 0.00 0.00 58.65 59.15 3hjv h GLN 36 Cb 0.54 -0.15 -0.01 0.00 0.21 0.00 0.00 27.48 28.07 3hjv h GLN 36 CO 0.03 0.95 0.10 1.15 -1.93 0.00 0.00 178.83 179.13 3hjv h THR 37 N 1.01 1.19 -0.11 2.39 2.02 -0.52 -2.01 112.91 116.88 3hjv h THR 37 Ca 0.22 -0.61 -0.06 0.00 0.77 0.00 0.00 66.41 66.73 3hjv h THR 37 Cb 0.34 1.04 -0.01 0.00 -1.74 0.00 0.00 68.15 67.78 3hjv h THR 37 CO -0.00 0.20 -0.19 -0.26 0.37 0.00 0.00 175.52 175.64 3hjv h PHE 38 N 0.32 0.20 -0.55 3.16 0.04 -1.27 -2.34 116.94 116.50 3hjv h PHE 38 Ca 0.10 -0.03 -0.09 0.00 2.80 0.00 0.00 57.97 60.75 3hjv h PHE 38 Cb 0.22 -0.05 -0.02 0.00 2.20 0.00 0.00 35.95 38.30 3hjv h PHE 38 CO 0.00 0.38 -0.02 0.00 -0.60 0.00 0.00 178.31 178.07 3hjv h ALA 39 N 1.63 0.75 -0.62 2.45 0.00 -0.59 -0.14 119.26 122.74 3hjv h ALA 39 Ca 0.03 -0.31 0.00 0.00 0.00 0.00 0.00 54.91 54.63 3hjv h ALA 39 Cb 0.45 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 18.01 3hjv h ALA 39 CO 0.03 0.59 0.38 0.93 0.00 0.00 0.00 179.25 181.19 3hjv h GLU 40 N 0.87 0.83 -0.47 0.00 5.08 -1.07 -1.73 114.58 118.08 3hjv h GLU 40 Ca 0.15 -0.07 -0.00 0.00 -1.00 0.00 0.00 59.36 58.45 3hjv h GLU 40 Cb 0.57 -0.18 -0.02 0.00 0.50 0.00 0.00 28.75 29.62 3hjv h GLU 40 CO 0.03 0.58 0.29 0.00 -1.00 0.00 0.00 179.01 178.91 3hjv h ALA 41 N 1.20 0.60 -0.68 3.43 0.00 -1.10 -2.89 119.26 119.83 3hjv h ALA 41 Ca 0.22 -0.06 0.01 0.00 0.00 0.00 0.00 54.91 55.09 3hjv h ALA 41 Cb -0.05 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.52 3hjv h ALA 41 CO -0.04 0.08 0.45 0.77 0.00 0.00 0.00 179.25 180.51 3hjv h SER 42 N 0.63 0.75 0.10 0.00 0.02 -0.69 -0.84 113.55 113.53 3hjv h SER 42 Ca 0.17 -0.02 -0.06 0.00 -0.84 0.00 0.00 61.79 61.04 3hjv h SER 42 Cb -0.02 -0.18 -0.01 0.00 0.14 0.00 0.00 62.40 62.32 3hjv h SER 42 CO -0.03 0.54 -0.21 1.05 -1.14 0.00 0.00 176.83 177.04 3hjv h GLU 43 N 0.88 0.21 0.01 3.45 4.11 -1.11 0.16 114.58 122.29 3hjv h GLU 43 Ca 0.25 -0.06 -0.27 0.00 0.07 0.00 0.00 59.36 59.36 3hjv h GLU 43 Cb -0.06 -0.02 0.02 0.00 0.50 0.00 0.00 28.75 29.19 3hjv h GLU 43 CO -0.06 0.42 -1.04 0.28 0.07 0.00 0.00 179.01 178.68 3hjv h VAL 44 N 0.20 1.28 0.00 -1.06 2.07 -1.31 -3.36 116.25 114.07 3hjv h VAL 44 Ca 0.04 -2.25 -0.14 0.00 0.82 0.00 0.00 66.70 65.17 3hjv h VAL 44 Cb 0.48 2.40 -0.02 0.00 -1.52 0.00 0.00 31.29 32.64 3hjv h VAL 44 CO 0.03 0.69 -0.74 -0.07 0.02 0.00 0.00 177.57 177.51 3hjv h LEU 45 N 0.37 0.00 0.00 2.57 3.38 -0.95 -3.48 115.31 117.21 3hjv h LEU 45 Ca -0.13 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.84 3hjv h LEU 45 Cb 1.70 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.45 3hjv h LEU 45 CO 0.20 0.63 -0.00 0.61 0.09 0.00 0.00 178.44 179.97 3hjv n GLY 46 N 1.28 0.43 3.39 0.83 0.00 0.02 -5.03 105.19 106.11 3hjv n GLY 46 Ca -0.00 -0.67 -0.10 0.00 0.00 0.00 0.00 46.02 45.26 3hjv n GLY 46 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3hjv s TYR 47 N -2.00 0.36 -0.77 1.61 -0.85 -1.23 -5.08 117.35 109.39 3hjv s TYR 47 Ca 0.00 -0.71 -0.25 0.00 -0.52 0.00 0.00 57.07 55.59 3hjv s TYR 47 Cb 0.00 0.02 0.05 0.00 0.38 0.00 0.00 41.96 42.41 3hjv s TYR 47 CO 0.00 -0.78 1.21 0.34 -1.52 0.00 0.00 175.55 174.80 3hjv s ASP 48 N -2.97 6.25 0.23 -0.18 -1.08 -1.26 -4.44 116.67 113.22 3hjv s ASP 48 Ca 0.18 -0.85 -0.04 0.00 -0.52 0.00 0.00 52.55 51.32 3hjv s ASP 48 Cb 0.02 -2.51 0.25 0.00 -1.46 0.00 0.00 42.92 39.22 3hjv s ASP 48 CO 0.02 -1.63 1.70 0.25 0.52 0.00 0.00 175.17 176.02 3hjv h LEU 49 N 12.37 0.80 -0.68 -1.34 5.85 -1.91 -2.36 115.31 128.04 3hjv h LEU 49 Ca -0.18 -0.23 -0.07 0.00 0.84 0.00 0.00 57.88 58.24 3hjv h LEU 49 Cb 1.05 -0.22 -0.03 0.00 0.37 0.00 0.00 40.66 41.83 3hjv h LEU 49 CO 1.27 0.92 0.16 -0.25 -0.34 0.00 0.00 178.44 180.19 3hjv h TRP 50 N 0.74 1.15 -0.67 1.25 2.91 -1.90 -1.43 115.95 118.01 3hjv h TRP 50 Ca 0.13 -0.14 -0.04 0.00 1.13 0.00 0.00 58.89 59.97 3hjv h TRP 50 Cb 0.57 -0.32 -0.03 0.00 -0.51 0.00 0.00 29.16 28.87 3hjv h TRP 50 CO 0.03 0.94 0.28 0.00 -1.03 0.00 0.00 178.44 178.66 3hjv h ALA 51 N 1.07 0.87 -0.36 2.65 0.00 -1.92 -0.34 119.26 121.22 3hjv h ALA 51 Ca 0.21 -0.17 -0.00 0.00 0.00 0.00 0.00 54.91 54.95 3hjv h ALA 51 Cb 0.38 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 3hjv h ALA 51 CO 0.00 0.47 0.22 1.25 0.00 0.00 0.00 179.25 181.20 3hjv h LEU 52 N 0.94 0.42 -0.84 0.00 5.85 -1.17 -0.07 115.31 120.45 3hjv h LEU 52 Ca 0.22 -0.04 -0.08 0.00 0.84 0.00 0.00 57.88 58.81 3hjv h LEU 52 Cb 0.19 -0.11 -0.02 0.00 0.37 0.00 0.00 40.66 41.09 3hjv h LEU 52 CO -0.02 0.34 -0.05 0.58 -0.34 0.00 0.00 178.44 178.95 3hjv h VAL 53 N 0.47 1.25 0.11 1.05 2.07 -0.88 0.67 116.25 120.99 3hjv h VAL 53 Ca 0.13 -1.09 -0.28 0.00 0.82 0.00 0.00 66.70 66.27 3hjv h VAL 53 Cb -0.01 0.94 -0.00 0.00 -1.52 0.00 0.00 31.29 30.70 3hjv h VAL 53 CO -0.02 0.38 -1.35 1.56 0.02 0.00 0.00 177.57 178.15 3hjv h GLN 54 N 0.75 0.23 0.00 1.57 1.08 -0.94 0.13 115.11 117.93 3hjv h GLN 54 Ca 0.14 -0.40 0.00 0.00 -1.45 0.00 0.00 58.65 56.94 3hjv h GLN 54 Cb 0.52 0.15 0.00 0.00 -0.05 0.00 0.00 27.48 28.10 3hjv h GLN 54 CO 0.03 1.14 -0.31 -0.25 -0.95 0.00 0.00 178.83 178.49 3hjv n ASP 55 N -3.47 0.58 0.00 1.46 8.00 -0.05 -4.04 116.55 119.03 3hjv n ASP 55 Ca -0.11 -0.54 0.00 0.00 0.71 0.00 0.00 54.79 54.85 3hjv n ASP 55 Cb 1.03 1.02 0.00 0.00 -0.02 0.00 0.00 41.12 43.15 3hjv n ASP 55 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3hjv n GLY 56 N 1.22 -1.68 3.76 0.44 0.00 0.23 -4.73 105.19 104.42 3hjv n GLY 56 Ca 0.01 -1.51 -0.41 0.00 0.00 0.00 0.00 46.02 44.10 3hjv n GLY 56 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 3hjv s PRO 57 N 0.00 4.14 0.46 1.61 0.02 -1.26 -4.42 135.00 135.56 3hjv s PRO 57 Ca 0.00 2.53 0.13 0.00 0.02 0.00 0.00 61.00 63.68 3hjv s PRO 57 Cb 0.00 -3.01 1.06 0.00 0.02 0.00 0.00 34.50 32.57 3hjv s PRO 57 CO 0.00 -0.55 2.07 -0.24 -0.33 0.00 0.00 177.00 177.95 3hjv h VAL 58 N 3.22 1.07 -0.11 3.83 3.04 -1.89 -1.41 116.25 124.00 3hjv h VAL 58 Ca -0.49 -0.25 -0.08 0.00 -1.01 0.00 0.00 66.70 64.88 3hjv h VAL 58 Cb 1.23 0.96 -0.01 0.00 -2.01 0.00 0.00 31.29 31.46 3hjv h VAL 58 CO 0.72 0.09 -0.28 -0.33 -1.01 0.00 0.00 177.57 176.76 3hjv h GLU 59 N 0.17 0.19 -0.07 4.17 3.07 -1.98 -0.77 114.58 119.34 3hjv h GLU 59 Ca 0.04 -0.06 -0.14 0.00 -0.50 0.00 0.00 59.36 58.69 3hjv h GLU 59 Cb 0.09 -0.02 0.01 0.00 -0.84 0.00 0.00 28.75 27.99 3hjv h GLU 59 CO -0.00 0.46 -0.52 -0.44 -1.40 0.00 0.00 179.01 177.12 3hjv h ASP 60 N 0.17 0.58 -0.58 1.42 3.32 -1.74 -3.22 116.42 116.37 3hjv h ASP 60 Ca 0.03 -0.67 0.08 0.00 0.02 0.00 0.00 57.03 56.48 3hjv h ASP 60 Cb 0.59 -0.17 -0.03 0.00 0.22 0.00 0.00 39.33 39.93 3hjv h ASP 60 CO 0.04 1.16 0.39 0.25 -1.72 0.00 0.00 179.24 179.36 3hjv h LEU 61 N 0.05 0.43 -0.01 1.55 5.85 -0.76 -2.29 115.31 120.13 3hjv h LEU 61 Ca -0.04 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.68 3hjv h LEU 61 Cb 1.18 -0.09 0.00 0.00 0.37 0.00 0.00 40.66 42.12 3hjv h LEU 61 CO 0.11 0.27 0.00 0.59 -0.34 0.00 0.00 178.44 179.07 3hjv n ASN 62 N -4.47 0.10 -4.73 1.25 3.02 -0.34 -2.77 115.26 107.31 3hjv n ASN 62 Ca 0.09 0.51 -0.42 0.00 -0.03 0.00 0.00 54.58 54.73 3hjv n ASN 62 Cb 0.29 -0.54 -0.03 0.00 -0.61 0.00 0.00 39.78 38.89 3hjv n ASN 62 CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 3hjv s GLN 63 N -3.02 4.30 0.36 3.52 -1.52 -0.86 -4.81 119.66 117.62 3hjv s GLN 63 Ca 0.13 2.21 0.03 0.00 -1.95 0.00 0.00 55.36 55.77 3hjv s GLN 63 Cb 0.17 -3.16 0.66 0.00 -0.22 0.00 0.00 33.01 30.46 3hjv s GLN 63 CO 0.51 -0.41 2.01 0.00 -0.25 0.00 0.00 175.29 177.14 3hjv h THR 64 N 3.80 1.14 0.00 -0.19 1.03 -1.88 0.15 112.91 116.95 3hjv h THR 64 Ca -0.44 -0.28 0.00 0.00 -0.01 0.00 0.00 66.41 65.67 3hjv h THR 64 Cb 1.21 0.24 0.00 0.00 -1.07 0.00 0.00 68.15 68.53 3hjv h THR 64 CO 0.81 0.15 0.00 2.22 -0.01 0.00 0.00 175.52 178.70 3hjv n PHE 65 N -4.45 0.16 -0.12 0.00 1.16 -1.26 -1.59 117.46 111.36 3hjv n PHE 65 Ca 0.07 0.06 -0.18 0.00 -1.87 0.00 0.00 57.45 55.52 3hjv n PHE 65 Cb 0.07 -0.60 -0.11 0.00 -1.61 0.00 0.00 39.48 37.23 3hjv n PHE 65 CO 0.00 0.00 0.00 0.54 -1.87 0.00 0.00 176.76 175.43 3hjv n ARG 66 N -1.64 0.59 -0.28 3.97 1.74 -0.72 -4.51 116.66 115.82 3hjv n ARG 66 Ca 0.04 0.15 -0.01 0.00 -0.77 0.00 0.00 57.85 57.25 3hjv n ARG 66 Cb 0.19 -1.46 0.11 0.00 -1.02 0.00 0.00 32.46 30.28 3hjv n ARG 66 CO 0.00 0.00 0.00 1.15 -1.52 0.00 0.00 177.63 177.26 3hjv h THR 67 N -0.15 1.07 0.15 0.55 2.02 -0.55 -2.05 112.91 113.95 3hjv h THR 67 Ca -0.55 -0.31 -0.00 0.00 0.77 0.00 0.00 66.41 66.31 3hjv h THR 67 Cb 1.78 0.08 -0.01 0.00 -1.74 0.00 0.00 68.15 68.26 3hjv h THR 67 CO -0.13 0.17 -0.10 1.56 0.37 0.00 0.00 175.52 177.38 3hjv h GLN 68 N 0.91 -0.25 -0.27 6.66 4.20 -1.55 0.58 115.11 125.40 3hjv h GLN 68 Ca 0.33 0.02 -0.08 0.00 0.06 0.00 0.00 58.65 58.98 3hjv h GLN 68 Cb 0.09 0.06 -0.02 0.00 0.30 0.00 0.00 27.48 27.91 3hjv h GLN 68 CO -0.14 -0.16 -0.15 -1.00 -0.67 0.00 0.00 178.83 176.70 3hjv h PRO 69 N -0.26 0.47 -0.37 1.46 0.13 -1.78 -1.26 132.00 130.40 3hjv h PRO 69 Ca -0.01 -0.14 0.01 0.00 -0.87 0.00 0.00 66.00 64.98 3hjv h PRO 69 Cb 0.22 -0.05 -0.02 0.00 0.13 0.00 0.00 31.00 31.29 3hjv h PRO 69 CO 0.00 0.62 0.24 0.00 -0.23 0.00 0.00 178.00 178.64 3hjv h ALA 70 N 1.40 0.47 -0.34 -0.56 0.00 -1.00 0.20 119.26 119.44 3hjv h ALA 70 Ca 0.08 -0.02 -0.15 0.00 0.00 0.00 0.00 54.91 54.82 3hjv h ALA 70 Cb 0.53 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.17 3hjv h ALA 70 CO 0.03 -0.08 -0.38 -0.07 0.00 0.00 0.00 179.25 178.75 3hjv h LEU 71 N 0.49 0.86 -0.09 0.00 3.38 -0.71 -1.61 115.31 117.62 3hjv h LEU 71 Ca 0.14 -0.38 -0.00 0.00 0.09 0.00 0.00 57.88 57.72 3hjv h LEU 71 Cb -0.04 -0.24 -0.00 0.00 0.09 0.00 0.00 40.66 40.46 3hjv h LEU 71 CO -0.04 1.14 0.05 0.25 0.09 0.00 0.00 178.44 179.93 3hjv h LEU 72 N 0.66 0.12 -0.68 1.67 5.85 -1.02 -1.37 115.31 120.54 3hjv h LEU 72 Ca 0.06 -0.08 0.04 0.00 0.84 0.00 0.00 57.88 58.73 3hjv h LEU 72 Cb 0.94 -0.03 -0.05 0.00 0.37 0.00 0.00 40.66 41.90 3hjv h LEU 72 CO 0.09 0.17 0.41 0.00 -0.34 0.00 0.00 178.44 178.76 3hjv h ALA 73 N 0.96 0.90 -0.14 1.25 0.00 -0.94 -1.43 119.26 119.85 3hjv h ALA 73 Ca 0.03 -0.01 0.01 0.00 0.00 0.00 0.00 54.91 54.94 3hjv h ALA 73 Cb 0.07 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 3hjv h ALA 73 CO -0.01 0.15 0.06 0.00 0.00 0.00 0.00 179.25 179.45 3hjv h ALA 74 N 1.31 0.16 -0.42 0.00 0.00 -0.99 -0.14 119.26 119.20 3hjv h ALA 74 Ca 0.28 0.01 -0.11 0.00 0.00 0.00 0.00 54.91 55.10 3hjv h ALA 74 Cb 0.08 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 3hjv h ALA 74 CO -0.13 -0.38 -0.15 0.77 0.00 0.00 0.00 179.25 179.35 3hjv h SER 75 N 0.14 0.85 -0.25 0.00 0.02 -1.06 -2.18 113.55 111.07 3hjv h SER 75 Ca 0.06 -0.39 -0.10 0.00 -0.84 0.00 0.00 61.79 60.52 3hjv h SER 75 Cb 0.02 -0.23 -0.02 0.00 0.14 0.00 0.00 62.40 62.31 3hjv h SER 75 CO -0.05 1.05 -0.20 0.58 -1.14 0.00 0.00 176.83 177.07 3hjv h VAL 76 N 0.66 1.27 -0.44 2.27 2.07 -1.17 -1.15 116.25 119.76 3hjv h VAL 76 Ca 0.10 -1.27 0.04 0.00 0.82 0.00 0.00 66.70 66.38 3hjv h VAL 76 Cb 0.70 1.20 -0.04 0.00 -1.52 0.00 0.00 31.29 31.63 3hjv h VAL 76 CO 0.05 0.42 0.21 0.00 0.02 0.00 0.00 177.57 178.28 3hjv h ALA 77 N 1.15 0.55 -0.52 1.67 0.00 -0.80 -0.19 119.26 121.13 3hjv h ALA 77 Ca 0.09 0.02 -0.07 0.00 0.00 0.00 0.00 54.91 54.95 3hjv h ALA 77 Cb 0.68 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.39 3hjv h ALA 77 CO 0.05 -0.14 0.05 0.82 0.00 0.00 0.00 179.25 180.03 3hjv h ILE 78 N 0.43 1.26 -0.82 0.00 2.04 -1.13 -2.15 117.51 117.13 3hjv h ILE 78 Ca 0.19 -1.01 0.05 0.00 1.00 0.00 0.00 64.86 65.09 3hjv h ILE 78 Cb 0.10 0.89 -0.06 0.00 -0.74 0.00 0.00 36.82 37.02 3hjv h ILE 78 CO -0.14 0.36 0.51 -0.25 0.00 0.00 0.00 178.15 178.64 3hjv h TRP 79 N 0.76 0.96 -0.61 1.37 2.91 -0.76 0.23 115.95 120.81 3hjv h TRP 79 Ca 0.15 0.03 -0.07 0.00 1.13 0.00 0.00 58.89 60.13 3hjv h TRP 79 Cb 0.45 -0.31 -0.03 0.00 -0.51 0.00 0.00 29.16 28.77 3hjv h TRP 79 CO 0.03 0.51 0.10 0.00 -1.03 0.00 0.00 178.44 178.06 3hjv h ARG 80 N 0.96 0.98 -0.38 2.65 3.08 -0.75 -0.88 114.38 120.03 3hjv h ARG 80 Ca 0.35 -0.24 -0.04 0.00 0.07 0.00 0.00 59.98 60.12 3hjv h ARG 80 Cb 0.11 -0.13 -0.02 0.00 0.08 0.00 0.00 29.97 30.02 3hjv h ARG 80 CO -0.15 0.90 0.10 0.28 -1.07 0.00 0.00 179.97 180.03 3hjv h VAL 81 N 0.92 1.23 -0.64 2.04 2.07 -0.77 0.16 116.25 121.25 3hjv h VAL 81 Ca 0.19 -0.77 0.09 0.00 0.82 0.00 0.00 66.70 67.03 3hjv h VAL 81 Cb 0.39 0.99 -0.07 0.00 -1.52 0.00 0.00 31.29 31.09 3hjv h VAL 81 CO 0.01 0.26 0.29 -0.25 0.02 0.00 0.00 177.57 177.90 3hjv h TRP 82 N 0.48 0.52 -0.32 1.57 2.91 -0.63 0.18 115.95 120.65 3hjv h TRP 82 Ca 0.12 0.03 -0.15 0.00 1.13 0.00 0.00 58.89 60.02 3hjv h TRP 82 Cb 0.30 -0.13 -0.00 0.00 -0.51 0.00 0.00 29.16 28.81 3hjv h TRP 82 CO 0.02 0.18 -0.37 1.96 -1.03 0.00 0.00 178.44 179.20 3hjv h GLN 83 N 0.51 0.82 -0.91 2.65 1.08 -1.01 -0.80 115.11 117.45 3hjv h GLN 83 Ca 0.32 -0.45 0.03 0.00 -1.45 0.00 0.00 58.65 57.10 3hjv h GLN 83 Cb 0.34 0.02 -0.05 0.00 -0.05 0.00 0.00 27.48 27.75 3hjv h GLN 83 CO -0.27 1.08 0.60 0.37 -0.95 0.00 0.00 178.83 179.66 3hjv h GLN 84 N 0.59 1.14 0.00 1.46 4.15 -0.28 -1.21 115.11 120.96 3hjv h GLN 84 Ca 0.05 -0.07 0.00 0.00 0.77 0.00 0.00 58.65 59.40 3hjv h GLN 84 Cb 0.95 -0.26 0.00 0.00 0.21 0.00 0.00 27.48 28.39 3hjv h GLN 84 CO 0.09 0.75 0.00 1.28 -1.93 0.00 0.00 178.83 179.02 3hjv n LEU 85 N -4.49 0.00 -0.72 -2.39 4.77 -0.01 -4.91 117.00 109.24 3hjv n LEU 85 Ca 0.11 0.44 -0.06 0.00 -0.03 0.00 0.00 56.01 56.47 3hjv n LEU 85 Cb 0.07 -0.44 -0.00 0.00 -2.33 0.00 0.00 43.42 40.72 3hjv n LEU 85 CO 0.35 -0.09 -0.06 0.61 -1.33 0.00 0.00 177.39 176.86 3hjv n GLY 86 N 0.84 0.16 3.78 -0.72 0.00 -0.46 -5.02 105.19 103.77 3hjv n GLY 86 Ca 0.07 -0.62 -0.33 0.00 0.00 0.00 0.00 46.02 45.13 3hjv n GLY 86 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3hjv s LEU 87 N -1.77 3.51 0.48 0.99 1.02 -0.34 -4.97 118.68 117.60 3hjv s LEU 87 Ca 0.01 1.99 -0.22 0.00 0.02 0.00 0.00 54.13 55.93 3hjv s LEU 87 Cb -0.01 -4.55 -0.09 0.00 0.02 0.00 0.00 46.19 41.56 3hjv s LEU 87 CO 0.02 -1.39 1.01 1.21 0.02 0.00 0.00 176.35 177.22 3hjv n GLU 88 N -2.03 1.26 -2.41 1.70 2.13 -1.26 -4.80 120.64 115.23 3hjv n GLU 88 Ca 0.10 0.46 -0.41 0.00 0.66 0.00 0.00 57.16 57.97 3hjv n GLU 88 Cb 0.52 -2.11 -0.03 0.00 0.27 0.00 0.00 31.44 30.08 3hjv n GLU 88 CO 0.00 0.00 0.00 -0.65 -0.41 0.00 0.00 177.13 176.07 3hjv s GLN 89 N -2.27 4.50 0.69 5.31 -1.52 -1.26 -5.05 119.66 120.06 3hjv s GLN 89 Ca 0.67 1.82 -0.12 0.00 -1.95 0.00 0.00 55.36 55.79 3hjv s GLN 89 Cb -0.50 -3.27 0.01 0.00 -0.22 0.00 0.00 33.01 29.03 3hjv s GLN 89 CO 0.54 -0.10 1.07 -1.25 -0.25 0.00 0.00 175.29 175.30 3hjv s PRO 90 N 0.04 2.86 0.20 2.91 0.04 -1.26 -4.89 135.00 134.90 3hjv s PRO 90 Ca 0.54 1.06 0.11 0.00 0.04 0.00 0.00 61.00 62.75 3hjv s PRO 90 Cb -0.31 -1.98 -0.07 0.00 0.04 0.00 0.00 34.50 32.18 3hjv s PRO 90 CO 0.35 -1.16 1.35 0.00 0.04 0.00 0.00 177.00 177.57 3hjv h ALA 91 N -0.55 0.53 -2.70 8.56 0.00 -1.15 -3.48 119.26 120.47 3hjv h ALA 91 Ca -0.44 -0.68 -0.01 0.00 0.00 0.00 0.00 54.91 53.77 3hjv h ALA 91 Cb 1.22 -0.10 -0.14 0.00 0.00 0.00 0.00 17.79 18.77 3hjv h ALA 91 CO 0.56 0.92 0.24 0.54 0.00 0.00 0.00 179.25 181.51 3hjv s VAL 92 N -2.84 0.00 0.18 0.00 0.11 -1.26 -4.27 120.40 112.32 3hjv s VAL 92 Ca 0.02 0.00 0.08 0.00 -2.93 0.00 0.00 61.98 59.15 3hjv s VAL 92 Cb 0.09 -1.00 -0.04 0.00 -1.53 0.00 0.00 36.38 33.89 3hjv s VAL 92 CO 0.78 0.00 -0.16 -0.76 -3.33 0.00 0.00 175.10 171.63 3hjv s LEU 93 N -2.37 2.49 0.12 2.54 1.43 -0.15 -2.32 118.68 120.42 3hjv s LEU 93 Ca -0.01 -0.93 -0.25 0.00 -1.03 0.00 0.00 54.13 51.91 3hjv s LEU 93 Cb -0.01 -0.71 0.07 0.00 0.03 0.00 0.00 46.19 45.57 3hjv s LEU 93 CO -0.08 -0.12 0.80 0.00 0.23 0.00 0.00 176.35 177.19 3hjv s ALA 94 N -2.51 -1.63 0.18 4.21 0.00 -0.98 -1.63 121.76 119.39 3hjv s ALA 94 Ca 0.18 0.46 -0.16 0.00 0.00 0.00 0.00 51.96 52.44 3hjv s ALA 94 Cb -0.03 0.66 0.03 0.00 0.00 0.00 0.00 23.12 23.78 3hjv s ALA 94 CO 0.06 -0.85 0.48 0.20 0.00 0.00 0.00 175.76 175.65 3hjv s GLY 95 N -2.73 -0.06 -0.50 0.00 0.00 -1.26 -1.72 107.32 101.05 3hjv s GLY 95 Ca 0.07 -0.26 -0.20 0.00 0.00 0.00 0.00 44.72 44.33 3hjv s GLY 95 CO -0.05 -0.33 0.65 -1.58 0.00 0.00 0.00 173.10 171.80 3hjv s HIS 96 N -3.87 3.03 0.00 1.90 2.46 -0.48 -3.33 115.29 115.00 3hjv s HIS 96 Ca 0.09 -0.43 0.00 0.00 0.47 0.00 0.00 55.06 55.19 3hjv s HIS 96 Cb -0.00 -3.55 0.00 0.00 -0.13 0.00 0.00 32.58 28.90 3hjv s HIS 96 CO -0.04 -1.04 0.00 0.45 -2.47 0.00 0.00 174.74 171.64 3hjv n SER 97 N 6.29 0.00 -0.25 9.88 2.88 -1.26 -1.55 113.62 129.61 3hjv n SER 97 Ca -0.05 0.00 0.07 0.00 -1.33 0.00 0.00 58.87 57.55 3hjv n SER 97 Cb 0.46 0.00 0.31 0.00 -0.75 0.00 0.00 64.21 64.23 3hjv n SER 97 CO 0.00 0.00 0.00 0.25 -1.23 0.00 0.00 175.04 174.06 3hjv h LEU 98 N 0.00 0.76 -2.12 2.46 7.12 -1.89 -1.92 115.31 119.72 3hjv h LEU 98 Ca 0.00 0.01 0.08 0.00 0.13 0.00 0.00 57.88 58.11 3hjv h LEU 98 Cb 0.00 -0.15 -0.01 0.00 -0.53 0.00 0.00 40.66 39.97 3hjv h LEU 98 CO 0.00 0.47 0.30 1.23 -0.13 0.00 0.00 178.44 180.30 3hjv h GLY 99 N 0.85 0.00 1.48 3.75 0.00 -1.35 -0.01 103.07 107.79 3hjv h GLY 99 Ca 0.37 0.00 -0.03 0.00 0.00 0.00 0.00 47.33 47.67 3hjv h GLY 99 CO -0.14 0.00 0.14 -2.09 0.00 0.00 0.00 176.54 174.45 3hjv h GLU 100 N 0.00 0.67 -0.51 4.80 4.81 -1.34 -1.18 114.58 121.83 3hjv h GLU 100 Ca 0.14 -0.11 -0.07 0.00 -0.13 0.00 0.00 59.36 59.19 3hjv h GLU 100 Cb 0.73 -0.12 -0.02 0.00 0.63 0.00 0.00 28.75 29.98 3hjv h GLU 100 CO -0.00 0.59 0.04 1.88 -0.73 0.00 0.00 179.01 180.78 3hjv h TYR 101 N 0.66 0.94 -0.35 0.92 0.05 -1.15 -1.17 116.97 116.86 3hjv h TYR 101 Ca 0.15 -0.15 0.01 0.00 0.05 0.00 0.00 58.73 58.80 3hjv h TYR 101 Cb 0.20 -0.25 -0.02 0.00 1.01 0.00 0.00 36.73 37.66 3hjv h TYR 101 CO 0.01 0.86 0.21 0.77 -1.05 0.00 0.00 178.16 178.96 3hjv h SER 102 N 0.74 0.34 -0.77 3.88 0.02 -1.37 -1.12 113.55 115.27 3hjv h SER 102 Ca 0.15 0.00 0.06 0.00 -0.84 0.00 0.00 61.79 61.16 3hjv h SER 102 Cb 0.46 -0.07 -0.06 0.00 0.14 0.00 0.00 62.40 62.88 3hjv h SER 102 CO 0.02 0.24 0.46 0.00 -1.14 0.00 0.00 176.83 176.41 3hjv h ALA 103 N 1.16 1.04 -0.31 3.77 0.00 -0.95 -1.59 119.26 122.38 3hjv h ALA 103 Ca 0.14 0.00 -0.10 0.00 0.00 0.00 0.00 54.91 54.95 3hjv h ALA 103 Cb 0.00 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 3hjv h ALA 103 CO -0.06 0.18 -0.23 -0.07 0.00 0.00 0.00 179.25 179.06 3hjv h LEU 104 N 0.84 0.61 -0.22 0.00 3.38 -0.73 0.63 115.31 119.82 3hjv h LEU 104 Ca 0.34 -0.21 -0.05 0.00 0.09 0.00 0.00 57.88 58.05 3hjv h LEU 104 Cb 0.17 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.74 3hjv h LEU 104 CO -0.17 0.83 -0.05 0.58 0.09 0.00 0.00 178.44 179.72 3hjv h VAL 105 N 0.53 1.28 -0.04 1.22 2.07 -0.94 0.27 116.25 120.64 3hjv h VAL 105 Ca 0.08 -1.03 -0.06 0.00 0.82 0.00 0.00 66.70 66.51 3hjv h VAL 105 Cb 0.68 1.50 -0.01 0.00 -1.52 0.00 0.00 31.29 31.95 3hjv h VAL 105 CO 0.05 0.32 -0.25 0.00 0.02 0.00 0.00 177.57 177.70 3hjv n ALA 107 N -2.49 2.66 -1.05 0.00 0.00 0.19 -4.90 120.51 114.92 3hjv n ALA 107 Ca -0.02 -0.19 -0.02 0.00 0.00 0.00 0.00 53.44 53.21 3hjv n ALA 107 Cb 0.32 -1.43 -0.01 0.00 0.00 0.00 0.00 19.45 18.34 3hjv n ALA 107 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3hjv n GLY 108 N 0.95 0.53 0.11 0.00 0.00 -0.53 -0.24 105.19 106.01 3hjv n GLY 108 Ca 0.21 -0.58 -0.18 0.00 0.00 0.00 0.00 46.02 45.47 3hjv n GLY 108 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 3hjv h VAL 109 N 0.00 1.52 -4.14 1.61 2.07 -1.13 -3.41 116.25 112.77 3hjv h VAL 109 Ca -0.03 -2.29 -0.69 0.00 0.82 0.00 0.00 66.70 64.50 3hjv h VAL 109 Cb 0.16 2.98 -0.30 0.00 -1.52 0.00 0.00 31.29 32.61 3hjv h VAL 109 CO 0.05 0.64 -0.87 -0.63 0.02 0.00 0.00 177.57 176.79 3hjv s ILE 110 N -2.74 2.19 0.30 4.57 1.01 -1.17 -1.48 121.20 123.87 3hjv s ILE 110 Ca -0.14 -1.03 -0.29 0.00 0.00 0.00 0.00 60.65 59.18 3hjv s ILE 110 Cb 0.01 -1.79 -0.11 0.00 0.01 0.00 0.00 42.46 40.58 3hjv s ILE 110 CO 0.80 0.57 1.48 -0.62 0.00 0.00 0.00 174.94 177.18 3hjv s ASP 111 N -0.31 6.52 0.12 3.58 2.15 -1.26 -4.37 116.67 123.10 3hjv s ASP 111 Ca 0.01 2.83 -0.20 0.00 0.43 0.00 0.00 52.55 55.62 3hjv s ASP 111 Cb -0.13 -2.64 -0.04 0.00 -0.30 0.00 0.00 42.92 39.81 3hjv s ASP 111 CO 0.02 -0.78 1.71 0.15 -0.17 0.00 0.00 175.17 176.10 3hjv h PHE 112 N 4.41 -0.07 -0.79 -5.34 3.57 -1.99 -0.23 116.94 116.50 3hjv h PHE 112 Ca -0.48 0.01 -0.05 0.00 3.53 0.00 0.00 57.97 60.99 3hjv h PHE 112 Cb 1.22 0.06 -0.03 0.00 2.79 0.00 0.00 35.95 39.99 3hjv h PHE 112 CO 0.58 -0.06 0.31 0.87 -2.23 0.00 0.00 178.31 177.77 3hjv h LYS 113 N 0.02 1.20 -0.69 1.11 1.57 -1.92 -0.86 116.57 116.99 3hjv h LYS 113 Ca 0.08 -0.22 -0.05 0.00 -1.87 0.00 0.00 60.65 58.59 3hjv h LYS 113 Cb 0.12 -0.19 -0.03 0.00 0.08 0.00 0.00 32.23 32.21 3hjv h LYS 113 CO -0.17 0.97 0.24 1.96 -0.57 0.00 0.00 179.45 181.89 3hjv h GLN 114 N 1.16 1.04 -0.77 3.15 4.20 -1.86 -2.70 115.11 119.32 3hjv h GLN 114 Ca 0.26 -0.19 -0.05 0.00 0.06 0.00 0.00 58.65 58.73 3hjv h GLN 114 Cb 0.23 -0.16 -0.03 0.00 0.30 0.00 0.00 27.48 27.81 3hjv h GLN 114 CO -0.02 0.87 0.29 0.00 -0.67 0.00 0.00 178.83 179.30 3hjv h ALA 115 N 1.25 1.00 -0.44 3.87 0.00 -0.46 -0.43 119.26 124.05 3hjv h ALA 115 Ca 0.23 -0.20 0.01 0.00 0.00 0.00 0.00 54.91 54.95 3hjv h ALA 115 Cb 0.24 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 17.71 3hjv h ALA 115 CO -0.01 0.64 0.28 0.82 0.00 0.00 0.00 179.25 180.97 3hjv h ILE 116 N 1.12 1.08 -0.72 0.00 1.08 -0.96 -0.34 117.51 118.76 3hjv h ILE 116 Ca 0.25 -0.19 -0.03 0.00 -0.39 0.00 0.00 64.86 64.50 3hjv h ILE 116 Cb 0.24 0.47 -0.03 0.00 -3.07 0.00 0.00 36.82 34.42 3hjv h ILE 116 CO -0.02 0.10 0.32 0.50 -0.69 0.00 0.00 178.15 178.36 3hjv h LYS 117 N 0.56 1.06 -0.12 2.37 3.64 -1.16 -2.10 116.57 120.82 3hjv h LYS 117 Ca 0.17 -0.17 -0.01 0.00 -1.27 0.00 0.00 60.65 59.37 3hjv h LYS 117 Cb -0.02 -0.18 -0.01 0.00 -0.41 0.00 0.00 32.23 31.61 3hjv h LYS 117 CO -0.06 0.85 0.05 1.25 -2.27 0.00 0.00 179.45 179.27 3hjv h LEU 118 N 1.02 0.16 -0.68 5.20 5.85 -0.75 -2.11 115.31 124.00 3hjv h LEU 118 Ca 0.24 -0.15 -0.14 0.00 0.84 0.00 0.00 57.88 58.68 3hjv h LEU 118 Cb 0.16 -0.04 -0.02 0.00 0.37 0.00 0.00 40.66 41.14 3hjv h LEU 118 CO -0.03 0.27 -0.63 -0.37 -0.34 0.00 0.00 178.44 177.34 3hjv h VAL 119 N 0.05 1.42 -0.24 1.05 -1.51 -0.99 0.80 116.25 116.83 3hjv h VAL 119 Ca 0.04 -2.09 0.02 0.00 -1.23 0.00 0.00 66.70 63.44 3hjv h VAL 119 Cb 0.15 2.10 -0.02 0.00 -2.13 0.00 0.00 31.29 31.39 3hjv h VAL 119 CO -0.00 0.61 0.09 -0.08 -1.23 0.00 0.00 177.57 176.96 3hjv h GLU 120 N 0.09 0.20 -0.64 5.19 4.81 -1.31 -1.35 114.58 121.57 3hjv h GLU 120 Ca -0.01 -0.01 -0.02 0.00 -0.13 0.00 0.00 59.36 59.19 3hjv h GLU 120 Cb 1.13 -0.05 -0.03 0.00 0.63 0.00 0.00 28.75 30.43 3hjv h GLU 120 CO 0.09 0.13 0.31 1.25 -0.73 0.00 0.00 179.01 180.06 3hjv h LEU 121 N 0.21 0.84 -0.46 1.64 5.85 -1.08 -1.80 115.31 120.51 3hjv h LEU 121 Ca 0.10 -0.13 0.07 0.00 0.84 0.00 0.00 57.88 58.76 3hjv h LEU 121 Cb 0.06 -0.22 -0.06 0.00 0.37 0.00 0.00 40.66 40.81 3hjv h LEU 121 CO -0.10 0.74 0.10 -0.09 -0.34 0.00 0.00 178.44 178.75 3hjv h ARG 122 N 0.88 0.24 -0.75 1.25 2.43 -0.59 0.08 114.38 117.92 3hjv h ARG 122 Ca 0.22 -0.01 -0.00 0.00 -0.81 0.00 0.00 59.98 59.37 3hjv h ARG 122 Cb 0.12 -0.05 -0.04 0.00 -0.42 0.00 0.00 29.97 29.58 3hjv h ARG 122 CO -0.03 0.16 0.46 0.78 -1.51 0.00 0.00 179.97 179.83 3hjv h GLY 123 N 0.24 1.08 0.90 2.80 0.00 -0.93 -3.04 103.07 104.13 3hjv h GLY 123 Ca 0.22 -0.44 -0.03 0.00 0.00 0.00 0.00 47.33 47.09 3hjv h GLY 123 CO -0.28 0.43 0.08 1.46 0.00 0.00 0.00 176.54 178.22 3hjv h GLN 124 N 1.02 0.49 -1.33 4.80 4.20 -0.47 -1.11 115.11 122.72 3hjv h GLN 124 Ca 0.27 -0.12 0.00 0.00 0.06 0.00 0.00 58.65 58.86 3hjv h GLN 124 Cb -0.06 -0.07 0.00 0.00 0.30 0.00 0.00 27.48 27.66 3hjv h GLN 124 CO -0.05 0.56 0.00 1.28 -0.67 0.00 0.00 178.83 179.95 3hjv n LEU 125 N -4.66 0.50 0.00 1.46 4.77 -0.07 -1.97 117.00 117.04 3hjv n LEU 125 Ca -0.02 -0.25 0.00 0.00 -0.03 0.00 0.00 56.01 55.71 3hjv n LEU 125 Cb 0.19 -0.10 0.00 0.00 -2.33 0.00 0.00 43.42 41.17 3hjv n LEU 125 CO 0.37 0.09 0.00 1.67 -1.33 0.00 0.00 177.39 178.19 3hjv n GLN 127 N 0.75 0.00 0.00 3.23 -0.06 -0.42 -1.74 117.38 119.15 3hjv n GLN 127 Ca 0.00 0.00 0.12 0.00 -2.00 0.00 0.00 57.00 55.12 3hjv n GLN 127 Cb 0.09 0.00 0.10 0.00 -4.06 0.00 0.00 30.24 26.37 3hjv n GLN 127 CO 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 177.06 176.86 3hjv n GLN 128 N 0.00 1.83 -0.12 3.69 10.64 -0.83 -4.59 117.38 128.00 3hjv n GLN 128 Ca 0.00 -1.48 -0.05 0.00 -1.83 0.00 0.00 57.00 53.64 3hjv n GLN 128 Cb 0.00 -1.47 0.02 0.00 -0.86 0.00 0.00 30.24 27.93 3hjv n GLN 128 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 3hjv h ALA 129 N 4.36 0.30 -2.83 2.61 0.00 -1.61 -3.43 119.26 118.65 3hjv h ALA 129 Ca 0.00 0.15 -0.26 0.00 0.00 0.00 0.00 54.91 54.80 3hjv h ALA 129 Cb 0.86 0.28 -0.19 0.00 0.00 0.00 0.00 17.79 18.74 3hjv h ALA 129 CO 0.00 -0.44 -0.72 0.14 0.00 0.00 0.00 179.25 178.23 3hjv s VAL 130 N -6.21 0.60 0.46 0.00 -7.23 -1.26 -4.98 120.40 101.78 3hjv s VAL 130 Ca -0.14 -1.39 -0.24 0.00 -1.81 0.00 0.00 61.98 58.40 3hjv s VAL 130 Cb 0.14 -1.00 -0.07 0.00 0.56 0.00 0.00 36.38 36.01 3hjv s VAL 130 CO 0.71 -0.56 1.32 -2.84 -0.31 0.00 0.00 175.10 173.42 3hjv s PRO 131 N -2.39 3.64 0.32 4.82 0.02 -1.26 -4.90 135.00 135.25 3hjv s PRO 131 Ca -0.02 2.16 -0.29 0.00 0.02 0.00 0.00 61.00 62.87 3hjv s PRO 131 Cb -0.05 -2.54 -0.11 0.00 0.02 0.00 0.00 34.50 31.83 3hjv s PRO 131 CO -0.01 -0.76 1.50 0.00 -0.33 0.00 0.00 177.00 177.39 3hjv s ALA 132 N -1.31 3.64 0.00 -1.55 0.00 -1.26 -2.09 121.76 119.18 3hjv s ALA 132 Ca 0.63 1.51 0.00 0.00 0.00 0.00 0.00 51.96 54.10 3hjv s ALA 132 Cb -0.38 -3.60 0.00 0.00 0.00 0.00 0.00 23.12 19.14 3hjv s ALA 132 CO 0.47 -0.94 0.00 0.41 0.00 0.00 0.00 175.76 175.70 3hjv n GLY 133 N 1.34 0.48 0.01 0.00 0.00 -1.26 -4.91 105.19 100.85 3hjv n GLY 133 Ca 0.04 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.17 3hjv n GLY 133 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3hjv n THR 134 N -2.00 0.04 -4.40 2.61 -2.24 -0.89 -4.87 114.28 102.53 3hjv n THR 134 Ca 0.00 -0.20 -0.25 0.00 -2.27 0.00 0.00 64.05 61.33 3hjv n THR 134 Cb 0.00 0.52 -0.09 0.00 -2.10 0.00 0.00 70.33 68.66 3hjv n THR 134 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 3hjv s GLY 135 N -3.58 2.06 0.00 3.38 0.00 -1.26 -0.76 107.32 107.15 3hjv s GLY 135 Ca 0.02 -1.97 0.00 0.00 0.00 0.00 0.00 44.72 42.78 3hjv s GLY 135 CO 0.86 -1.93 0.00 0.00 0.00 0.00 0.00 173.10 172.03 3hjv n ALA 136 N -0.87 0.00 -3.64 3.20 0.00 -0.32 -4.49 120.51 114.40 3hjv n ALA 136 Ca -0.05 0.00 -0.05 0.00 0.00 0.00 0.00 53.44 53.34 3hjv n ALA 136 Cb 0.62 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 20.01 3hjv n ALA 136 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 3hjv s TYR 138 N -2.42 -0.18 -0.18 0.00 1.51 -0.44 -2.27 117.35 113.37 3hjv s TYR 138 Ca 0.00 0.40 -0.14 0.00 -1.01 0.00 0.00 57.07 56.32 3hjv s TYR 138 Cb 0.00 0.46 -0.04 0.00 -0.11 0.00 0.00 41.96 42.26 3hjv s TYR 138 CO 0.00 -0.11 0.31 0.00 -1.11 0.00 0.00 175.55 174.64 3hjv s ALA 139 N -0.29 3.58 -0.14 3.71 0.00 0.06 -0.97 121.76 127.70 3hjv s ALA 139 Ca 0.06 -0.53 -0.01 0.00 0.00 0.00 0.00 51.96 51.48 3hjv s ALA 139 Cb -0.04 -2.47 -0.01 0.00 0.00 0.00 0.00 23.12 20.60 3hjv s ALA 139 CO -0.10 -0.07 -0.11 0.42 0.00 0.00 0.00 175.76 175.90 3hjv s ILE 140 N 0.82 3.16 -0.08 0.00 -1.09 0.15 -0.38 121.20 123.79 3hjv s ILE 140 Ca 0.16 -0.61 0.05 0.00 -2.23 0.00 0.00 60.65 58.02 3hjv s ILE 140 Cb -0.14 -2.35 -0.01 0.00 -1.58 0.00 0.00 42.46 38.39 3hjv s ILE 140 CO 0.05 0.51 -0.23 -0.63 -1.23 0.00 0.00 174.94 173.41 3hjv s ILE 141 N 0.50 2.22 0.00 2.92 -1.09 -0.08 -1.83 121.20 123.85 3hjv s ILE 141 Ca -0.08 -0.99 0.00 0.00 -2.23 0.00 0.00 60.65 57.35 3hjv s ILE 141 Cb -0.15 -1.84 0.00 0.00 -1.58 0.00 0.00 42.46 38.89 3hjv s ILE 141 CO 0.04 0.56 0.00 0.61 -1.23 0.00 0.00 174.94 174.92 3hjv n GLY 142 N 3.18 0.93 3.26 6.18 0.00 -0.05 0.07 105.19 118.76 3hjv n GLY 142 Ca -0.18 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.57 3hjv n GLY 142 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3hjv s LEU 143 N 0.00 2.12 0.65 0.99 1.43 -1.26 -4.56 118.68 118.04 3hjv s LEU 143 Ca 0.00 -0.48 -0.15 0.00 -1.03 0.00 0.00 54.13 52.46 3hjv s LEU 143 Cb 0.00 -1.09 -0.01 0.00 0.03 0.00 0.00 46.19 45.12 3hjv s LEU 143 CO 0.00 0.22 1.11 -1.61 0.23 0.00 0.00 176.35 176.30 3hjv s GLU 144 N -0.93 2.88 0.26 1.70 2.02 -1.26 -4.10 118.70 119.27 3hjv s GLU 144 Ca 0.09 1.40 -0.02 0.00 0.02 0.00 0.00 54.97 56.45 3hjv s GLU 144 Cb -0.09 -1.96 0.53 0.00 0.10 0.00 0.00 34.13 32.71 3hjv s GLU 144 CO 0.01 -1.19 1.71 -0.44 0.02 0.00 0.00 175.26 175.37 3hjv h ASP 145 N 0.15 0.23 -0.42 -0.19 3.32 -2.00 -1.87 116.42 115.63 3hjv h ASP 145 Ca -0.47 0.13 0.09 0.00 0.02 0.00 0.00 57.03 56.80 3hjv h ASP 145 Cb 1.25 0.13 -0.08 0.00 0.22 0.00 0.00 39.33 40.84 3hjv h ASP 145 CO 0.54 0.04 -0.13 -0.33 -1.72 0.00 0.00 179.24 177.65 3hjv h GLU 146 N 0.39 -0.03 -0.47 3.56 3.07 -2.00 -0.97 114.58 118.13 3hjv h GLU 146 Ca 0.45 0.00 -0.10 0.00 -0.50 0.00 0.00 59.36 59.21 3hjv h GLU 146 Cb 0.76 0.01 -0.02 0.00 -0.84 0.00 0.00 28.75 28.66 3hjv h GLU 146 CO -0.47 -0.02 -0.12 0.00 -1.40 0.00 0.00 179.01 177.00 3hjv h ALA 147 N 1.36 0.90 -0.46 3.43 0.00 -1.72 -1.98 119.26 120.78 3hjv h ALA 147 Ca 0.20 -0.34 -0.04 0.00 0.00 0.00 0.00 54.91 54.74 3hjv h ALA 147 Cb 0.35 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.94 3hjv h ALA 147 CO -0.45 0.63 0.13 0.82 0.00 0.00 0.00 179.25 180.38 3hjv h ILE 148 N 0.78 1.23 -0.87 0.00 1.08 -0.98 -0.91 117.51 117.84 3hjv h ILE 148 Ca 0.13 -0.78 0.02 0.00 -0.39 0.00 0.00 64.86 63.83 3hjv h ILE 148 Cb 0.64 0.87 -0.05 0.00 -3.07 0.00 0.00 36.82 35.21 3hjv h ILE 148 CO 0.04 0.28 0.57 0.00 -0.69 0.00 0.00 178.15 178.36 3hjv h ALA 149 N 0.99 1.12 -0.44 1.87 0.00 -0.92 -0.44 119.26 121.43 3hjv h ALA 149 Ca 0.15 -0.05 -0.05 0.00 0.00 0.00 0.00 54.91 54.95 3hjv h ALA 149 Cb 0.29 -0.34 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 3hjv h ALA 149 CO -0.00 0.48 0.08 -0.22 0.00 0.00 0.00 179.25 179.58 3hjv h LYS 150 N 1.15 0.72 -0.69 0.00 3.64 -1.12 -1.46 116.57 118.81 3hjv h LYS 150 Ca 0.33 -0.19 0.01 0.00 -1.27 0.00 0.00 60.65 59.53 3hjv h LYS 150 Cb -0.09 -0.09 -0.03 0.00 -0.41 0.00 0.00 32.23 31.61 3hjv h LYS 150 CO -0.08 0.74 0.45 0.00 -2.27 0.00 0.00 179.45 178.29 3hjv h ALA 151 N 0.95 0.87 -0.76 5.00 0.00 -0.61 -1.26 119.26 123.45 3hjv h ALA 151 Ca 0.13 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 54.96 3hjv h ALA 151 Cb 0.37 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 17.84 3hjv h ALA 151 CO 0.01 0.30 0.35 0.00 0.00 0.00 0.00 179.25 179.90 3hjv h ALA 153 N 1.18 0.39 -0.49 0.00 0.00 -0.91 -1.36 119.26 118.07 3hjv h ALA 153 Ca 0.26 -0.15 0.01 0.00 0.00 0.00 0.00 54.91 55.03 3hjv h ALA 153 Cb 0.14 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.79 3hjv h ALA 153 CO -0.03 0.03 0.32 -0.44 0.00 0.00 0.00 179.25 179.13 3hjv h ASP 154 N 0.33 0.53 1.15 0.00 3.32 -1.08 -2.81 116.42 117.86 3hjv h ASP 154 Ca 0.10 -0.01 -0.15 0.00 0.02 0.00 0.00 57.03 56.99 3hjv h ASP 154 Cb 0.24 -0.13 -0.02 0.00 0.22 0.00 0.00 39.33 39.64 3hjv h ASP 154 CO -0.00 0.38 -0.70 0.00 -1.72 0.00 0.00 179.24 177.20 3hjv h ALA 155 N 1.70 0.60 -0.31 3.45 0.00 -0.82 -3.40 119.26 120.49 3hjv h ALA 155 Ca 0.18 -0.64 0.07 0.00 0.00 0.00 0.00 54.91 54.53 3hjv h ALA 155 Cb -0.02 -0.11 -0.08 0.00 0.00 0.00 0.00 17.79 17.58 3hjv h ALA 155 CO -0.04 0.87 -0.23 0.00 0.00 0.00 0.00 179.25 179.85 3hjv h ALA 156 N 1.30 -0.04 -6.55 0.00 0.00 -0.98 -3.44 119.26 109.55 3hjv h ALA 156 Ca -0.01 0.10 -0.52 0.00 0.00 0.00 0.00 54.91 54.49 3hjv h ALA 156 Cb 1.46 0.50 -0.11 0.00 0.00 0.00 0.00 17.79 19.64 3hjv h ALA 156 CO 0.09 -0.63 -0.84 1.04 0.00 0.00 0.00 179.25 178.92 3hjv n GLN 157 N -5.38 -3.75 -0.50 0.00 6.02 -1.26 -0.99 117.38 111.52 3hjv n GLN 157 Ca 0.00 0.44 0.00 0.00 -0.01 0.00 0.00 57.00 57.43 3hjv n GLN 157 Cb 0.29 -4.99 0.00 0.00 1.02 0.00 0.00 30.24 26.56 3hjv n GLN 157 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3hjv n GLY 158 N -1.66 1.27 3.79 1.08 0.00 -1.26 -5.04 105.19 103.37 3hjv n GLY 158 Ca -0.07 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.73 3hjv n GLY 158 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3hjv s GLU 159 N -0.27 2.48 -0.15 1.61 2.02 -0.16 -5.09 118.70 119.14 3hjv s GLU 159 Ca 0.00 -1.51 -0.29 0.00 0.02 0.00 0.00 54.97 53.18 3hjv s GLU 159 Cb 0.00 -2.27 -0.01 0.00 0.10 0.00 0.00 34.13 31.95 3hjv s GLU 159 CO 0.00 0.02 1.04 0.08 0.02 0.00 0.00 175.26 176.42 3hjv s VAL 160 N -2.42 4.71 -0.22 2.63 1.01 -1.26 -4.63 120.40 120.21 3hjv s VAL 160 Ca 0.41 2.00 -0.11 0.00 0.00 0.00 0.00 61.98 64.28 3hjv s VAL 160 Cb -0.03 -4.29 0.08 0.00 0.00 0.00 0.00 36.38 32.14 3hjv s VAL 160 CO 0.25 -0.06 0.52 0.54 0.00 0.00 0.00 175.10 176.35 3hjv s VAL 161 N 2.46 -0.23 0.17 2.92 0.11 -1.26 -0.61 120.40 123.96 3hjv s VAL 161 Ca 0.47 0.07 -0.20 0.00 -2.93 0.00 0.00 61.98 59.39 3hjv s VAL 161 Cb -0.18 -0.78 0.05 0.00 -1.53 0.00 0.00 36.38 33.95 3hjv s VAL 161 CO 0.14 0.03 0.56 -0.94 -3.33 0.00 0.00 175.10 171.56 3hjv s SER 162 N 1.84 -0.41 0.27 3.54 1.04 -0.44 -4.72 113.70 114.82 3hjv s SER 162 Ca -0.08 -0.22 -0.29 0.00 0.48 0.00 0.00 55.95 55.84 3hjv s SER 162 Cb -0.08 0.59 -0.10 0.00 0.10 0.00 0.00 66.02 66.52 3hjv s SER 162 CO -0.16 -1.01 1.34 -2.84 0.98 0.00 0.00 173.24 171.56 3hjv s PRO 163 N -3.80 4.35 0.00 4.02 0.02 -1.26 -1.34 135.00 136.99 3hjv s PRO 163 Ca 0.04 2.18 0.00 0.00 0.02 0.00 0.00 61.00 63.24 3hjv s PRO 163 Cb -0.01 -3.12 0.00 0.00 0.02 0.00 0.00 34.50 31.39 3hjv s PRO 163 CO -0.09 -0.25 0.00 1.33 -0.33 0.00 0.00 177.00 177.66 3hjv n VAL 164 N 1.71 0.00 -3.97 3.83 0.24 0.11 -4.49 118.33 115.76 3hjv n VAL 164 Ca 0.03 -0.04 -0.16 0.00 -2.04 0.00 0.00 64.34 62.14 3hjv n VAL 164 Cb 0.42 0.51 -0.15 0.00 -1.47 0.00 0.00 33.84 33.14 3hjv n VAL 164 CO 0.00 0.00 0.00 0.20 -2.14 0.00 0.00 176.83 174.89 3hjv s ASN 165 N -1.74 0.36 -0.53 -1.34 0.02 -0.92 -0.93 114.94 109.87 3hjv s ASN 165 Ca 0.00 -0.04 -0.05 0.00 -1.02 0.00 0.00 52.86 51.76 3hjv s ASN 165 Cb 0.00 -0.13 0.14 0.00 0.02 0.00 0.00 41.25 41.27 3hjv s ASN 165 CO 0.00 -0.04 0.35 -0.36 0.02 0.00 0.00 177.10 177.07 3hjv s PHE 166 N 0.52 3.50 -0.09 2.20 0.08 0.11 -1.27 117.98 123.03 3hjv s PHE 166 Ca -0.05 -2.40 0.03 0.00 0.12 0.00 0.00 56.93 54.63 3hjv s PHE 166 Cb -0.08 -3.30 -0.25 0.00 -0.57 0.00 0.00 43.02 38.82 3hjv s PHE 166 CO -0.01 -0.93 0.47 0.09 -0.10 0.00 0.00 175.22 174.74 3hjv n ASN 167 N 4.20 1.51 -3.62 1.36 3.02 -0.42 -1.12 115.26 120.20 3hjv n ASN 167 Ca 0.01 0.28 -0.08 0.00 -0.03 0.00 0.00 54.58 54.76 3hjv n ASN 167 Cb 0.40 -0.44 -0.02 0.00 -0.61 0.00 0.00 39.78 39.11 3hjv n ASN 167 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 3hjv s SER 168 N -6.56 -0.37 0.09 6.41 1.04 -1.07 -4.17 113.70 109.06 3hjv s SER 168 Ca -0.15 -0.24 -0.32 0.00 0.48 0.00 0.00 55.95 55.73 3hjv s SER 168 Cb 0.07 0.57 -0.11 0.00 0.10 0.00 0.00 66.02 66.65 3hjv s SER 168 CO 0.79 -0.98 1.81 -2.65 0.98 0.00 0.00 173.24 173.19 3hjv n PRO 169 N -0.39 2.59 -0.82 4.02 -0.02 -1.26 -1.00 135.00 138.12 3hjv n PRO 169 Ca -0.10 0.94 0.00 0.00 -2.02 0.00 0.00 63.50 62.33 3hjv n PRO 169 Cb 0.62 -2.81 0.00 0.00 -0.02 0.00 0.00 33.50 31.29 3hjv n PRO 169 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3hjv n GLY 170 N 4.15 0.66 2.61 -1.23 0.00 -1.26 -4.94 105.19 105.17 3hjv n GLY 170 Ca 0.19 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.91 3hjv n GLY 170 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3hjv s GLN 171 N -0.18 0.55 -0.02 1.61 0.74 -0.17 -0.87 119.66 121.33 3hjv s GLN 171 Ca 0.00 -1.03 0.04 0.00 0.05 0.00 0.00 55.36 54.41 3hjv s GLN 171 Cb 0.00 -1.59 -0.01 0.00 1.10 0.00 0.00 33.01 32.52 3hjv s GLN 171 CO 0.00 -1.06 -0.13 0.08 -0.55 0.00 0.00 175.29 173.63 3hjv s VAL 172 N 1.54 1.04 -0.09 1.34 1.01 -0.76 -1.30 120.40 123.18 3hjv s VAL 172 Ca 0.12 -0.54 -0.02 0.00 0.00 0.00 0.00 61.98 61.54 3hjv s VAL 172 Cb -0.19 -0.88 -0.03 0.00 0.00 0.00 0.00 36.38 35.28 3hjv s VAL 172 CO -0.21 0.30 -0.00 -0.69 0.00 0.00 0.00 175.10 174.49 3hjv s VAL 173 N -0.17 4.25 0.16 2.92 1.01 -0.39 0.31 120.40 128.49 3hjv s VAL 173 Ca 0.03 -0.27 0.11 0.00 0.00 0.00 0.00 61.98 61.85 3hjv s VAL 173 Cb -0.06 -2.79 -0.04 0.00 0.00 0.00 0.00 36.38 33.48 3hjv s VAL 173 CO -0.00 0.60 -0.25 0.27 0.00 0.00 0.00 175.10 175.72 3hjv s ILE 174 N -0.78 2.25 0.28 2.22 -4.36 -0.15 0.08 121.20 120.74 3hjv s ILE 174 Ca 0.12 -1.89 -0.14 0.00 -0.26 0.00 0.00 60.65 58.48 3hjv s ILE 174 Cb -0.11 -2.02 0.01 0.00 1.25 0.00 0.00 42.46 41.58 3hjv s ILE 174 CO 0.02 -0.04 0.57 0.00 0.24 0.00 0.00 174.94 175.73 3hjv s ALA 175 N -1.42 -0.41 0.00 2.27 0.00 -0.45 -1.32 121.76 120.43 3hjv s ALA 175 Ca 0.17 -0.81 0.00 0.00 0.00 0.00 0.00 51.96 51.32 3hjv s ALA 175 Cb -0.09 0.98 0.00 0.00 0.00 0.00 0.00 23.12 24.01 3hjv s ALA 175 CO 0.08 -0.91 0.00 0.41 0.00 0.00 0.00 175.76 175.34 3hjv n GLY 176 N -0.44 0.36 3.75 0.00 0.00 -0.96 -1.33 105.19 106.57 3hjv n GLY 176 Ca -0.03 -1.35 -0.41 0.00 0.00 0.00 0.00 46.02 44.23 3hjv n GLY 176 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3hjv s GLN 177 N -2.00 4.21 0.14 1.61 -0.44 0.22 -1.17 119.66 122.23 3hjv s GLN 177 Ca 0.00 2.41 -0.32 0.00 -2.50 0.00 0.00 55.36 54.96 3hjv s GLN 177 Cb 0.00 -3.07 -0.08 0.00 -1.64 0.00 0.00 33.01 28.22 3hjv s GLN 177 CO 0.00 -0.49 1.55 -0.22 0.50 0.00 0.00 175.29 176.64 3hjv h LYS 178 N 4.70 -0.35 -0.29 1.67 3.64 -1.17 -0.27 116.57 124.49 3hjv h LYS 178 Ca -0.47 0.02 -0.01 0.00 -1.27 0.00 0.00 60.65 58.93 3hjv h LYS 178 Cb 1.22 0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 33.11 3hjv h LYS 178 CO 0.76 -0.23 0.16 -0.44 -2.27 0.00 0.00 179.45 177.43 3hjv h ASP 179 N -0.36 0.37 -0.76 4.20 3.32 -1.92 -1.69 116.42 119.59 3hjv h ASP 179 Ca 0.09 -0.09 0.03 0.00 0.02 0.00 0.00 57.03 57.08 3hjv h ASP 179 Cb 0.59 -0.09 -0.05 0.00 0.22 0.00 0.00 39.33 39.99 3hjv h ASP 179 CO -0.62 0.36 0.48 0.00 -1.72 0.00 0.00 179.24 177.74 3hjv h ALA 180 N 1.03 0.99 -0.64 3.45 0.00 -1.69 0.10 119.26 122.50 3hjv h ALA 180 Ca 0.10 -0.03 -0.06 0.00 0.00 0.00 0.00 54.91 54.93 3hjv h ALA 180 Cb 0.07 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 17.58 3hjv h ALA 180 CO -0.02 0.28 0.18 0.28 0.00 0.00 0.00 179.25 179.97 3hjv h VAL 181 N 0.94 1.25 -0.73 0.00 2.07 -0.93 -0.37 116.25 118.48 3hjv h VAL 181 Ca 0.30 -0.90 -0.04 0.00 0.82 0.00 0.00 66.70 66.88 3hjv h VAL 181 Cb 0.01 0.61 -0.03 0.00 -1.52 0.00 0.00 31.29 30.36 3hjv h VAL 181 CO -0.11 0.34 0.28 -0.33 0.02 0.00 0.00 177.57 177.77 3hjv h GLU 182 N 0.94 1.10 -0.78 1.57 5.08 -0.28 -0.86 114.58 121.35 3hjv h GLU 182 Ca 0.20 -0.21 -0.01 0.00 -1.00 0.00 0.00 59.36 58.35 3hjv h GLU 182 Cb 0.33 -0.17 -0.04 0.00 0.50 0.00 0.00 28.75 29.37 3hjv h GLU 182 CO -0.00 0.91 0.45 0.00 -1.00 0.00 0.00 179.01 179.37 3hjv h ARG 183 N 1.05 1.07 -0.71 2.33 3.08 -0.52 -2.72 114.38 117.97 3hjv h ARG 183 Ca 0.24 -0.11 -0.02 0.00 0.07 0.00 0.00 59.98 60.16 3hjv h ARG 183 Cb 0.23 -0.22 -0.03 0.00 0.08 0.00 0.00 29.97 30.03 3hjv h ARG 183 CO -0.02 0.78 0.37 0.00 -1.07 0.00 0.00 179.97 180.02 3hjv h ALA 184 N 1.24 1.31 -0.59 0.04 0.00 -0.35 -0.67 119.26 120.25 3hjv h ALA 184 Ca 0.28 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 55.07 3hjv h ALA 184 Cb -0.01 -0.29 -0.03 0.00 0.00 0.00 0.00 17.79 17.47 3hjv h ALA 184 CO -0.05 0.55 0.38 0.78 0.00 0.00 0.00 179.25 180.91 3hjv h GLY 185 N 1.05 0.83 0.87 0.00 0.00 -0.89 0.95 103.07 105.88 3hjv h GLY 185 Ca 0.25 -0.31 -0.02 0.00 0.00 0.00 0.00 47.33 47.24 3hjv h GLY 185 CO -0.04 0.31 0.06 -2.08 0.00 0.00 0.00 176.54 174.79 3hjv h VAL 186 N 0.79 1.20 -0.74 4.60 2.07 -1.18 -2.13 116.25 120.87 3hjv h VAL 186 Ca 0.21 -0.65 -0.02 0.00 0.82 0.00 0.00 66.70 67.07 3hjv h VAL 186 Cb -0.08 1.21 -0.04 0.00 -1.52 0.00 0.00 31.29 30.86 3hjv h VAL 186 CO -0.05 0.21 0.39 -0.07 0.02 0.00 0.00 177.57 178.07 3hjv h LEU 187 N 0.18 0.93 -0.49 2.57 3.38 -0.92 -0.90 115.31 120.06 3hjv h LEU 187 Ca 0.07 -0.08 -0.03 0.00 0.09 0.00 0.00 57.88 57.93 3hjv h LEU 187 Cb 0.26 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.75 3hjv h LEU 187 CO -0.00 0.76 0.20 0.00 0.09 0.00 0.00 178.44 179.49 3hjv h LYS 189 N 0.65 0.78 0.00 0.00 1.79 -0.94 -0.93 116.57 117.92 3hjv h LYS 189 Ca 0.16 -0.05 -0.03 0.00 -2.18 0.00 0.00 60.65 58.55 3hjv h LYS 189 Cb 0.18 -0.17 -0.00 0.00 -1.58 0.00 0.00 32.23 30.65 3hjv h LYS 189 CO -0.01 0.52 -0.15 0.93 -1.08 0.00 0.00 179.45 179.66 3hjv h GLU 190 N 0.80 0.00 0.00 3.15 4.39 -0.87 -1.39 114.58 120.66 3hjv h GLU 190 Ca 0.22 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.92 3hjv h GLU 190 Cb -0.08 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.57 3hjv h GLU 190 CO -0.05 0.15 0.00 0.00 -1.16 0.00 0.00 179.01 177.95 3hjv n ALA 191 N -2.50 2.45 0.00 3.43 0.00 -0.31 -4.90 120.51 118.68 3hjv n ALA 191 Ca -0.03 -0.14 0.00 0.00 0.00 0.00 0.00 53.44 53.28 3hjv n ALA 191 Cb 0.22 -1.48 0.00 0.00 0.00 0.00 0.00 19.45 18.19 3hjv n ALA 191 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3hjv n GLY 192 N 1.23 1.29 3.77 0.00 0.00 -0.52 -5.07 105.19 105.88 3hjv n GLY 192 Ca 0.14 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.75 3hjv n GLY 192 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hjv n ALA 193 N -0.96 2.20 -0.07 4.61 0.00 -0.42 -4.82 120.51 121.05 3hjv n ALA 193 Ca 0.00 0.30 -0.14 0.00 0.00 0.00 0.00 53.44 53.60 3hjv n ALA 193 Cb 0.00 -2.40 -0.06 0.00 0.00 0.00 0.00 19.45 16.99 3hjv n ALA 193 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 3hjv h LYS 194 N 2.65 0.64 -3.62 0.00 1.57 -0.60 -3.44 116.57 113.76 3hjv h LYS 194 Ca -0.51 -0.38 -0.18 0.00 -1.87 0.00 0.00 60.65 57.71 3hjv h LYS 194 Cb 1.26 0.04 -0.24 0.00 0.08 0.00 0.00 32.23 33.36 3hjv h LYS 194 CO 0.63 0.99 -0.60 1.03 -0.57 0.00 0.00 179.45 180.93 3hjv s ARG 195 N -4.17 0.26 -0.27 3.15 0.52 -1.09 -5.01 118.95 112.34 3hjv s ARG 195 Ca -0.12 -0.20 -0.01 0.00 -0.52 0.00 0.00 55.73 54.87 3hjv s ARG 195 Cb 0.08 0.11 0.08 0.00 0.52 0.00 0.00 34.95 35.74 3hjv s ARG 195 CO 0.83 -0.05 0.07 0.00 0.02 0.00 0.00 175.30 176.16 3hjv s ALA 196 N -0.72 1.41 -0.28 2.13 0.00 -1.26 -0.90 121.76 122.14 3hjv s ALA 196 Ca -0.08 -1.35 -0.08 0.00 0.00 0.00 0.00 51.96 50.45 3hjv s ALA 196 Cb -0.05 -1.47 -0.02 0.00 0.00 0.00 0.00 23.12 21.58 3hjv s ALA 196 CO 0.00 -1.48 0.11 -0.51 0.00 0.00 0.00 175.76 173.88 3hjv s LEU 197 N 1.68 3.81 0.13 0.00 1.43 0.49 -4.94 118.68 121.28 3hjv s LEU 197 Ca 0.05 -0.40 -0.31 0.00 -1.03 0.00 0.00 54.13 52.45 3hjv s LEU 197 Cb -0.17 -1.96 -0.08 0.00 0.03 0.00 0.00 46.19 44.01 3hjv s LEU 197 CO -0.19 -0.12 1.31 -2.84 0.23 0.00 0.00 176.35 174.74 3hjv s PRO 198 N 1.61 4.38 -0.11 1.29 0.02 -1.26 -0.76 135.00 140.15 3hjv s PRO 198 Ca 0.05 1.99 -0.08 0.00 0.02 0.00 0.00 61.00 62.98 3hjv s PRO 198 Cb -0.16 -3.25 -0.04 0.00 0.02 0.00 0.00 34.50 31.06 3hjv s PRO 198 CO 0.05 -0.32 0.17 -0.51 -0.33 0.00 0.00 177.00 176.06 3hjv s LEU 199 N 0.63 4.38 -1.19 -5.54 1.43 -1.26 -4.93 118.68 112.21 3hjv s LEU 199 Ca 0.60 0.50 -0.21 0.00 -1.03 0.00 0.00 54.13 53.99 3hjv s LEU 199 Cb -0.35 -2.12 -0.01 0.00 0.03 0.00 0.00 46.19 43.74 3hjv s LEU 199 CO 0.33 0.38 1.82 -2.16 0.23 0.00 0.00 176.35 176.95 3hjv s PRO 200 N -0.93 3.16 -0.10 1.29 0.04 -1.26 -4.85 135.00 132.34 3hjv s PRO 200 Ca 0.15 -1.39 -0.07 0.00 0.04 0.00 0.00 61.00 59.73 3hjv s PRO 200 Cb -0.12 -5.35 0.03 0.00 0.04 0.00 0.00 34.50 29.10 3hjv s PRO 200 CO 0.04 -3.12 0.25 0.14 0.04 0.00 0.00 177.00 174.35 3hjv s VAL 201 N 7.86 -0.02 -0.07 -0.36 -7.23 -1.26 -5.05 120.40 114.26 3hjv s VAL 201 Ca 0.61 0.06 -0.06 0.00 -1.81 0.00 0.00 61.98 60.78 3hjv s VAL 201 Cb 0.01 -0.37 -0.28 0.00 0.56 0.00 0.00 36.38 36.30 3hjv s VAL 201 CO 0.08 0.03 0.55 0.77 -0.31 0.00 0.00 175.10 176.21 3hjv h SER 202 N 6.37 0.45 -3.34 4.85 4.64 -1.89 -3.44 113.55 121.18 3hjv h SER 202 Ca -0.32 -0.82 -0.60 0.00 -0.47 0.00 0.00 61.79 59.58 3hjv h SER 202 Cb 1.18 -0.15 -0.09 0.00 -0.31 0.00 0.00 62.40 63.03 3hjv h SER 202 CO 0.36 1.72 0.46 -0.69 -0.87 0.00 0.00 176.83 177.80 3hjv s VAL 203 N -2.58 4.81 -1.35 0.95 1.01 -1.26 -4.37 120.40 117.62 3hjv s VAL 203 Ca -0.17 1.44 -0.15 0.00 0.00 0.00 0.00 61.98 63.10 3hjv s VAL 203 Cb 0.06 -4.13 0.09 0.00 0.00 0.00 0.00 36.38 32.39 3hjv s VAL 203 CO 0.81 -0.15 1.90 -0.81 0.00 0.00 0.00 175.10 176.86 3hjv n PRO 204 N 6.10 3.15 -1.32 2.72 -0.04 -1.26 -4.94 135.00 139.42 3hjv n PRO 204 Ca 0.05 -3.14 -0.33 0.00 -0.04 0.00 0.00 63.50 60.05 3hjv n PRO 204 Cb 0.48 -3.28 0.10 0.00 -0.04 0.00 0.00 33.50 30.76 3hjv n PRO 204 CO 0.00 0.00 0.00 -1.12 -0.04 0.00 0.00 175.50 174.34 3hjv s SER 205 N 3.18 4.19 -1.72 3.54 0.01 -1.26 -3.95 113.70 117.69 3hjv s SER 205 Ca 0.48 2.14 0.00 0.00 1.31 0.00 0.00 55.95 59.88 3hjv s SER 205 Cb 0.08 -2.56 0.00 0.00 0.21 0.00 0.00 66.02 63.74 3hjv s SER 205 CO -0.00 -2.25 0.00 1.41 0.41 0.00 0.00 173.24 172.80 3hjv n HIS 206 N -3.12 -0.96 -4.45 2.43 8.25 -1.01 -4.82 115.22 111.54 3hjv n HIS 206 Ca 0.12 0.00 -0.22 0.00 -0.26 0.00 0.00 57.72 57.35 3hjv n HIS 206 Cb 0.52 -3.73 -0.09 0.00 1.12 0.00 0.00 29.99 27.80 3hjv n HIS 206 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3hjv h ALA 208 N 2.02 1.16 0.00 0.00 0.00 -1.90 -3.38 119.26 117.17 3hjv h ALA 208 Ca -0.37 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.53 3hjv h ALA 208 Cb 1.26 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 19.04 3hjv h ALA 208 CO 0.61 -0.08 0.09 1.28 0.00 0.00 0.00 179.25 181.16 3hjv n LEU 209 N -3.17 1.01 0.00 0.00 4.77 -1.26 -4.65 117.00 113.70 3hjv n LEU 209 Ca -0.03 -0.61 0.00 0.00 -0.03 0.00 0.00 56.01 55.35 3hjv n LEU 209 Cb 0.14 -0.23 0.00 0.00 -2.33 0.00 0.00 43.42 41.00 3hjv n LEU 209 CO 0.20 0.12 0.00 0.29 -1.33 0.00 0.00 177.39 176.67 3hjv n LYS 211 N 2.18 0.00 -0.33 3.23 5.02 -1.26 -4.74 118.16 122.26 3hjv n LYS 211 Ca 0.02 0.00 0.16 0.00 -2.02 0.00 0.00 58.31 56.47 3hjv n LYS 211 Cb 0.12 0.00 0.39 0.00 -0.02 0.00 0.00 35.03 35.52 3hjv n LYS 211 CO 0.00 0.00 0.00 -1.35 -0.52 0.00 0.00 177.40 175.53 3hjv h PRO 212 N 0.00 0.62 -0.70 1.97 0.11 -1.97 0.15 132.00 132.17 3hjv h PRO 212 Ca 0.00 -0.04 -0.08 0.00 0.11 0.00 0.00 66.00 66.00 3hjv h PRO 212 Cb 0.00 -0.14 -0.03 0.00 0.11 0.00 0.00 31.00 30.94 3hjv h PRO 212 CO 0.00 0.41 0.14 0.00 -0.21 0.00 0.00 178.00 178.34 3hjv h ALA 213 N 1.64 0.93 -0.68 -0.75 0.00 -1.88 -2.49 119.26 116.02 3hjv h ALA 213 Ca 0.56 -0.26 -0.06 0.00 0.00 0.00 0.00 54.91 55.15 3hjv h ALA 213 Cb 1.05 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 18.55 3hjv h ALA 213 CO -0.33 0.67 0.17 0.00 0.00 0.00 0.00 179.25 179.76 3hjv h ALA 214 N 1.07 1.01 -0.82 0.00 0.00 -1.38 -0.15 119.26 119.00 3hjv h ALA 214 Ca 0.22 -0.24 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 3hjv h ALA 214 Cb 0.41 -0.26 -0.04 0.00 0.00 0.00 0.00 17.79 17.90 3hjv h ALA 214 CO 0.01 0.64 0.48 -0.44 0.00 0.00 0.00 179.25 179.95 3hjv h ASP 215 N 1.02 0.99 -0.26 0.00 3.32 -0.77 -1.44 116.42 119.29 3hjv h ASP 215 Ca 0.22 -0.06 -0.07 0.00 0.02 0.00 0.00 57.03 57.14 3hjv h ASP 215 Cb 0.35 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 39.64 3hjv h ASP 215 CO 0.00 0.77 -0.09 -0.33 -1.72 0.00 0.00 179.24 177.87 3hjv h GLU 216 N 1.14 0.52 -0.50 3.56 4.39 -0.98 -3.14 114.58 119.57 3hjv h GLU 216 Ca 0.29 -0.21 0.02 0.00 0.34 0.00 0.00 59.36 59.80 3hjv h GLU 216 Cb -0.03 -0.02 -0.03 0.00 -0.10 0.00 0.00 28.75 28.57 3hjv h GLU 216 CO -0.05 0.76 0.33 1.25 -1.16 0.00 0.00 179.01 180.14 3hjv h LEU 217 N 0.26 0.52 -1.29 1.33 5.85 -0.59 -1.55 115.31 119.85 3hjv h LEU 217 Ca 0.06 -0.01 0.06 0.00 0.84 0.00 0.00 57.88 58.83 3hjv h LEU 217 Cb 0.58 -0.12 -0.05 0.00 0.37 0.00 0.00 40.66 41.44 3hjv h LEU 217 CO 0.03 0.37 0.51 0.00 -0.34 0.00 0.00 178.44 179.01 3hjv h ALA 218 N 1.70 1.61 -0.67 1.25 0.00 -1.22 -0.94 119.26 120.99 3hjv h ALA 218 Ca 0.20 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 55.05 3hjv h ALA 218 Cb 0.03 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 17.56 3hjv h ALA 218 CO -0.05 0.27 0.28 0.87 0.00 0.00 0.00 179.25 180.63 3hjv h LYS 219 N 0.87 0.97 -0.01 0.00 1.57 -1.32 -1.97 116.57 116.68 3hjv h LYS 219 Ca 0.33 -0.15 -0.24 0.00 -1.87 0.00 0.00 60.65 58.72 3hjv h LYS 219 Cb 0.19 -0.17 0.01 0.00 0.08 0.00 0.00 32.23 32.34 3hjv h LYS 219 CO -0.11 0.78 -0.97 1.15 -0.57 0.00 0.00 179.45 179.73 3hjv h THR 220 N 0.95 1.35 0.00 -0.16 2.02 -1.38 -3.22 112.91 112.48 3hjv h THR 220 Ca 0.23 -2.35 -0.01 0.00 0.77 0.00 0.00 66.41 65.05 3hjv h THR 220 Cb 0.16 2.38 -0.00 0.00 -1.74 0.00 0.00 68.15 68.94 3hjv h THR 220 CO -0.02 0.71 -0.06 -0.07 0.37 0.00 0.00 175.52 176.45 3hjv h LEU 221 N 0.30 0.00 -2.34 2.58 3.38 -0.86 -0.54 115.31 117.83 3hjv h LEU 221 Ca -0.09 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.87 3hjv h LEU 221 Cb 1.60 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.35 3hjv h LEU 221 CO 0.18 0.06 -0.00 0.00 0.09 0.00 0.00 178.44 178.76 3hjv h ALA 222 N 1.94 1.01 -0.02 1.53 0.00 -1.38 -2.71 119.26 119.64 3hjv h ALA 222 Ca -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3hjv h ALA 222 Cb 0.11 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.90 3hjv h ALA 222 CO 0.01 0.00 -0.39 0.39 0.00 0.00 0.00 179.25 179.26 3hjv n GLU 223 N -3.10 1.32 -4.29 0.00 1.02 -0.21 -4.94 120.64 110.43 3hjv n GLU 223 Ca -0.02 -1.07 -0.35 0.00 -0.02 0.00 0.00 57.16 55.71 3hjv n GLU 223 Cb 0.17 -1.48 -0.10 0.00 -0.02 0.00 0.00 31.44 30.02 3hjv n GLU 223 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 3hjv s LEU 224 N -2.41 3.62 -0.05 -4.62 1.02 -1.02 -5.09 118.68 110.12 3hjv s LEU 224 Ca 0.21 0.11 -0.30 0.00 0.02 0.00 0.00 54.13 54.17 3hjv s LEU 224 Cb 0.18 -1.85 -0.02 0.00 0.02 0.00 0.00 46.19 44.52 3hjv s LEU 224 CO 0.53 0.32 1.01 -0.70 0.02 0.00 0.00 176.35 177.53 3hjv s GLU 225 N -0.51 4.48 -0.10 1.70 2.12 -1.26 -4.99 118.70 120.14 3hjv s GLU 225 Ca 0.09 1.43 0.02 0.00 0.36 0.00 0.00 54.97 56.87 3hjv s GLU 225 Cb -0.12 -3.50 -0.02 0.00 0.26 0.00 0.00 34.13 30.76 3hjv s GLU 225 CO 0.02 -0.19 -0.15 -0.06 -0.54 0.00 0.00 175.26 174.33 3hjv s PHE 226 N 1.52 2.73 0.40 5.30 0.40 -1.26 -4.50 117.98 122.57 3hjv s PHE 226 Ca 0.51 -0.57 0.07 0.00 -0.60 0.00 0.00 56.93 56.34 3hjv s PHE 226 Cb -0.20 -1.76 -0.07 0.00 0.51 0.00 0.00 43.02 41.50 3hjv s PHE 226 CO 0.23 -0.13 0.06 0.54 0.70 0.00 0.00 175.22 176.62 3hjv s ASN 227 N 0.04 4.08 0.41 1.36 6.03 -0.55 -4.83 114.94 121.48 3hjv s ASN 227 Ca -0.06 -1.23 -0.27 0.00 -1.03 0.00 0.00 52.86 50.28 3hjv s ASN 227 Cb -0.15 -0.44 -0.10 0.00 -3.03 0.00 0.00 41.25 37.54 3hjv s ASN 227 CO 0.05 -0.45 1.44 0.00 -2.03 0.00 0.00 177.10 176.11 3hjv s ALA 228 N -2.65 3.42 0.41 3.54 0.00 -1.26 -4.29 121.76 120.93 3hjv s ALA 228 Ca 0.37 1.49 -0.26 0.00 0.00 0.00 0.00 51.96 53.57 3hjv s ALA 228 Cb 0.07 -3.59 -0.08 0.00 0.00 0.00 0.00 23.12 19.51 3hjv s ALA 228 CO 0.20 -1.07 1.27 -1.25 0.00 0.00 0.00 175.76 174.90 3hjv s PRO 229 N -2.23 3.96 0.29 0.00 0.04 -1.26 -4.64 135.00 131.16 3hjv s PRO 229 Ca 0.56 2.08 0.22 0.00 0.04 0.00 0.00 61.00 63.90 3hjv s PRO 229 Cb -0.44 -2.72 0.12 0.00 0.04 0.00 0.00 34.50 31.50 3hjv s PRO 229 CO 0.59 -0.48 1.25 1.96 0.04 0.00 0.00 177.00 180.37 3hjv h GLN 230 N 2.62 0.00 -4.13 4.56 1.08 -0.94 -3.45 115.11 114.85 3hjv h GLN 230 Ca -0.49 0.00 -0.38 0.00 -1.45 0.00 0.00 58.65 56.33 3hjv h GLN 230 Cb 1.25 0.00 -0.32 0.00 -0.05 0.00 0.00 27.48 28.36 3hjv h GLN 230 CO 0.62 0.02 -0.76 0.42 -0.95 0.00 0.00 178.83 178.18 3hjv s ILE 231 N -3.29 0.47 0.40 2.54 1.01 -1.26 -5.09 121.20 115.99 3hjv s ILE 231 Ca 0.02 -0.15 -0.26 0.00 0.00 0.00 0.00 60.65 60.27 3hjv s ILE 231 Cb 0.08 -0.47 -0.11 0.00 0.01 0.00 0.00 42.46 41.97 3hjv s ILE 231 CO 0.75 0.18 1.19 -2.65 0.00 0.00 0.00 174.94 174.40 3hjv n PRO 232 N 3.63 1.76 -4.03 2.79 -0.02 -1.26 -4.80 135.00 133.07 3hjv n PRO 232 Ca -0.21 0.63 -0.28 0.00 -2.02 0.00 0.00 63.50 61.62 3hjv n PRO 232 Cb 0.53 -2.25 -0.17 0.00 -0.02 0.00 0.00 33.50 31.60 3hjv n PRO 232 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 3hjv s VAL 233 N -1.19 1.25 -0.19 -1.45 1.01 -1.26 -0.98 120.40 117.59 3hjv s VAL 233 Ca 0.61 -0.44 -0.21 0.00 0.00 0.00 0.00 61.98 61.93 3hjv s VAL 233 Cb -0.54 -1.21 -0.03 0.00 0.00 0.00 0.00 36.38 34.60 3hjv s VAL 233 CO 0.58 0.40 0.63 -0.63 0.00 0.00 0.00 175.10 176.09 3hjv s ILE 234 N 1.51 5.03 0.37 2.22 1.01 -0.65 -3.66 121.20 127.02 3hjv s ILE 234 Ca 0.03 1.20 -0.15 0.00 0.00 0.00 0.00 60.65 61.72 3hjv s ILE 234 Cb -0.13 -3.95 -0.09 0.00 0.01 0.00 0.00 42.46 38.30 3hjv s ILE 234 CO -0.08 0.13 0.80 0.54 0.00 0.00 0.00 174.94 176.33 3hjv s ASN 235 N 1.15 6.75 0.26 3.58 2.20 -0.38 -4.59 114.94 123.91 3hjv s ASN 235 Ca 0.29 1.35 0.03 0.00 -0.94 0.00 0.00 52.86 53.59 3hjv s ASN 235 Cb -0.16 -2.40 0.34 0.00 -2.00 0.00 0.00 41.25 37.03 3hjv s ASN 235 CO 0.11 -0.29 1.65 0.78 -2.94 0.00 0.00 177.10 176.41 3hjv h ASN 236 N 1.94 0.41 -0.09 3.54 -0.26 -1.91 -1.49 115.58 117.72 3hjv h ASN 236 Ca -0.48 -0.18 -0.15 0.00 -0.56 0.00 0.00 56.30 54.93 3hjv h ASN 236 Cb 1.18 -0.11 0.01 0.00 -1.06 0.00 0.00 38.32 38.33 3hjv h ASN 236 CO 0.64 0.77 -0.53 1.62 -1.06 0.00 0.00 177.43 178.87 3hjv h VAL 237 N 0.32 1.37 -0.00 2.81 3.04 -1.86 -2.20 116.25 119.72 3hjv h VAL 237 Ca 0.03 -1.86 0.00 0.00 -1.01 0.00 0.00 66.70 63.86 3hjv h VAL 237 Cb 0.85 2.22 0.00 0.00 -2.01 0.00 0.00 31.29 32.35 3hjv h VAL 237 CO 0.07 0.56 -0.13 0.47 -1.01 0.00 0.00 177.57 177.53 3hjv n ASP 238 N -4.21 0.29 -3.56 3.17 8.00 -1.26 -4.89 116.55 114.10 3hjv n ASP 238 Ca -0.08 -0.65 -0.24 0.00 0.71 0.00 0.00 54.79 54.54 3hjv n ASP 238 Cb 0.62 0.87 0.08 0.00 -0.02 0.00 0.00 41.12 42.67 3hjv n ASP 238 CO 0.00 0.00 0.00 0.52 -0.39 0.00 0.00 177.20 177.33 3hjv n VAL 239 N -0.91 -3.04 -5.16 2.53 0.31 -0.56 -5.01 118.33 106.50 3hjv n VAL 239 Ca 0.01 -0.01 -0.31 0.00 -0.01 0.00 0.00 64.34 64.01 3hjv n VAL 239 Cb 0.05 -3.99 -0.15 0.00 -0.91 0.00 0.00 33.84 28.84 3hjv n VAL 239 CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 3hjv s VAL 240 N -3.32 2.27 -1.17 2.52 1.01 -1.25 -4.80 120.40 115.66 3hjv s VAL 240 Ca 0.57 -1.08 -0.16 0.00 0.00 0.00 0.00 61.98 61.31 3hjv s VAL 240 Cb -0.25 -1.83 0.14 0.00 0.00 0.00 0.00 36.38 34.44 3hjv s VAL 240 CO 0.72 0.55 1.45 0.00 0.00 0.00 0.00 175.10 177.81 3hjv s ALA 241 N -0.67 3.68 0.23 5.51 0.00 -1.26 -1.25 121.76 128.00 3hjv s ALA 241 Ca 0.11 -3.11 -0.30 0.00 0.00 0.00 0.00 51.96 48.66 3hjv s ALA 241 Cb -0.10 -4.25 -0.09 0.00 0.00 0.00 0.00 23.12 18.68 3hjv s ALA 241 CO -0.00 -2.97 1.00 -2.00 0.00 0.00 0.00 175.76 171.79 3hjv s GLU 242 N 2.52 4.76 -0.00 0.00 2.56 -1.24 -4.91 118.70 122.38 3hjv s GLU 242 Ca 0.44 1.59 0.06 0.00 0.00 0.00 0.00 54.97 57.06 3hjv s GLU 242 Cb -0.02 -3.27 -0.08 0.00 2.00 0.00 0.00 34.13 32.77 3hjv s GLU 242 CO -0.00 0.36 0.19 0.25 -0.56 0.00 0.00 175.26 175.50 3hjv n THR 243 N 1.62 0.00 -2.75 -1.70 -2.24 -1.26 -4.73 114.28 103.22 3hjv n THR 243 Ca -0.01 -0.25 -0.43 0.00 -2.27 0.00 0.00 64.05 61.09 3hjv n THR 243 Cb 0.47 0.69 -0.03 0.00 -2.10 0.00 0.00 70.33 69.35 3hjv n THR 243 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3hjv s ASP 244 N -2.11 6.76 0.52 3.42 -1.08 -1.26 -4.47 116.67 118.45 3hjv s ASP 244 Ca 0.00 0.75 0.22 0.00 -0.52 0.00 0.00 52.55 52.99 3hjv s ASP 244 Cb 0.04 -2.49 1.34 0.00 -1.46 0.00 0.00 42.92 40.35 3hjv s ASP 244 CO 0.24 -0.87 2.04 -0.65 0.52 0.00 0.00 175.17 176.45 3hjv h PRO 245 N 8.36 0.02 -0.22 4.34 0.11 -1.88 -0.00 132.00 142.73 3hjv h PRO 245 Ca -0.22 -0.00 -0.13 0.00 0.11 0.00 0.00 66.00 65.76 3hjv h PRO 245 Cb 1.07 -0.01 -0.01 0.00 0.11 0.00 0.00 31.00 32.17 3hjv h PRO 245 CO 1.00 0.02 -0.39 0.28 -0.21 0.00 0.00 178.00 178.69 3hjv h VAL 246 N 0.03 1.30 -0.03 3.15 2.07 -1.92 -0.88 116.25 119.97 3hjv h VAL 246 Ca 0.18 -1.54 -0.14 0.00 0.82 0.00 0.00 66.70 66.02 3hjv h VAL 246 Cb 0.70 1.56 -0.02 0.00 -1.52 0.00 0.00 31.29 32.01 3hjv h VAL 246 CO -0.01 0.48 -0.63 0.11 0.02 0.00 0.00 177.57 177.55 3hjv h LYS 247 N 0.42 0.12 -0.27 1.57 1.57 -1.47 -1.11 116.57 117.41 3hjv h LYS 247 Ca 0.04 -0.09 -0.04 0.00 -1.87 0.00 0.00 60.65 58.69 3hjv h LYS 247 Cb 0.87 0.02 -0.01 0.00 0.08 0.00 0.00 32.23 33.19 3hjv h LYS 247 CO 0.07 0.71 0.03 0.82 -0.57 0.00 0.00 179.45 180.51 3hjv h ILE 248 N 0.09 1.24 -0.17 1.86 2.04 -0.90 0.09 117.51 121.76 3hjv h ILE 248 Ca -0.01 -0.83 0.04 0.00 1.00 0.00 0.00 64.86 65.06 3hjv h ILE 248 Cb 1.12 1.25 -0.03 0.00 -0.74 0.00 0.00 36.82 38.42 3hjv h ILE 248 CO 0.09 0.27 -0.05 0.11 0.00 0.00 0.00 178.15 178.56 3hjv h LYS 249 N 0.27 -0.02 -0.86 2.37 1.57 -1.02 -1.53 116.57 117.35 3hjv h LYS 249 Ca 0.08 0.00 0.06 0.00 -1.87 0.00 0.00 60.65 58.92 3hjv h LYS 249 Cb 0.36 0.00 -0.05 0.00 0.08 0.00 0.00 32.23 32.62 3hjv h LYS 249 CO 0.01 -0.01 0.56 0.22 -0.57 0.00 0.00 179.45 179.66 3hjv h ASP 250 N -0.02 0.86 -0.07 0.86 3.58 -1.06 -1.43 116.42 119.14 3hjv h ASP 250 Ca 0.08 0.00 -0.06 0.00 0.42 0.00 0.00 57.03 57.48 3hjv h ASP 250 Cb 0.15 -0.18 -0.01 0.00 1.72 0.00 0.00 39.33 41.00 3hjv h ASP 250 CO -0.18 0.56 -0.11 0.00 -2.88 0.00 0.00 179.24 176.63 3hjv h ALA 251 N 1.53 1.40 -0.37 -0.78 0.00 -0.39 -0.63 119.26 120.01 3hjv h ALA 251 Ca 0.37 -0.22 -0.12 0.00 0.00 0.00 0.00 54.91 54.93 3hjv h ALA 251 Cb 0.19 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 3hjv h ALA 251 CO -0.13 0.41 -0.25 -0.07 0.00 0.00 0.00 179.25 179.21 3hjv h LEU 252 N 0.35 0.86 0.55 0.00 3.38 -0.29 -0.21 115.31 119.95 3hjv h LEU 252 Ca 0.07 -0.43 -0.02 0.00 0.09 0.00 0.00 57.88 57.58 3hjv h LEU 252 Cb 0.40 -0.24 -0.00 0.00 0.09 0.00 0.00 40.66 40.91 3hjv h LEU 252 CO 0.02 1.11 -0.30 0.40 0.09 0.00 0.00 178.44 179.76 3hjv h ILE 253 N 0.62 0.38 -0.22 1.22 2.04 -0.97 -3.03 117.51 117.55 3hjv h ILE 253 Ca 0.07 0.00 -0.05 0.00 1.00 0.00 0.00 64.86 65.89 3hjv h ILE 253 Cb 0.82 0.38 -0.01 0.00 -0.74 0.00 0.00 36.82 37.26 3hjv h ILE 253 CO 0.07 0.00 -0.07 0.03 0.00 0.00 0.00 178.15 178.18 3hjv h ARG 254 N -0.79 0.34 -0.89 2.37 3.08 -1.14 -1.69 114.38 115.65 3hjv h ARG 254 Ca -0.07 -0.07 0.17 0.00 0.07 0.00 0.00 59.98 60.08 3hjv h ARG 254 Cb 0.63 -0.05 -0.07 0.00 0.08 0.00 0.00 29.97 30.56 3hjv h ARG 254 CO 0.09 0.42 0.58 0.37 -1.07 0.00 0.00 179.97 180.37 3hjv h GLN 255 N 0.33 0.55 -0.25 0.04 4.15 -0.91 -2.35 115.11 116.66 3hjv h GLN 255 Ca 0.07 -0.03 -0.05 0.00 0.77 0.00 0.00 58.65 59.41 3hjv h GLN 255 Cb 0.33 -0.12 -0.01 0.00 0.21 0.00 0.00 27.48 27.88 3hjv h GLN 255 CO 0.02 0.36 -0.06 1.25 -1.93 0.00 0.00 178.83 178.47 3hjv h LEU 256 N 0.56 0.37 -2.98 -2.39 5.85 -1.25 -2.82 115.31 112.65 3hjv h LEU 256 Ca 0.46 -0.07 0.00 0.00 0.84 0.00 0.00 57.88 59.11 3hjv h LEU 256 Cb 0.92 -0.10 0.00 0.00 0.37 0.00 0.00 40.66 41.85 3hjv h LEU 256 CO -0.20 0.48 0.00 0.00 -0.34 0.00 0.00 178.44 178.38 3hjv n TYR 257 N -4.28 0.52 -4.39 1.25 0.18 -0.98 -2.40 117.16 107.07 3hjv n TYR 257 Ca 0.00 -0.60 -0.21 0.00 1.88 0.00 0.00 57.90 58.97 3hjv n TYR 257 Cb 0.26 -0.10 -0.10 0.00 -0.38 0.00 0.00 39.34 39.02 3hjv n TYR 257 CO 0.00 0.00 0.00 -1.12 -2.08 0.00 0.00 176.86 173.66 3hjv s SER 258 N -1.26 2.96 0.49 9.48 0.01 -0.92 -3.36 113.70 121.10 3hjv s SER 258 Ca 0.26 -0.99 -0.22 0.00 1.31 0.00 0.00 55.95 56.31 3hjv s SER 258 Cb 0.16 -0.20 -0.07 0.00 0.21 0.00 0.00 66.02 66.13 3hjv s SER 258 CO 0.12 -0.07 1.18 -2.16 0.41 0.00 0.00 173.24 172.72 3hjv s PRO 259 N -3.42 3.57 -0.46 12.44 0.04 -1.22 -4.65 135.00 141.30 3hjv s PRO 259 Ca 0.24 1.78 -0.28 0.00 0.04 0.00 0.00 61.00 62.78 3hjv s PRO 259 Cb -0.03 -2.28 0.03 0.00 0.04 0.00 0.00 34.50 32.25 3hjv s PRO 259 CO 0.10 -0.71 1.09 0.08 0.04 0.00 0.00 177.00 177.60 3hjv s VAL 260 N -1.57 4.29 -1.28 -0.36 1.01 -0.10 -4.49 120.40 117.89 3hjv s VAL 260 Ca 0.67 1.20 -0.07 0.00 0.00 0.00 0.00 61.98 63.78 3hjv s VAL 260 Cb -0.29 -4.55 0.16 0.00 0.00 0.00 0.00 36.38 31.70 3hjv s VAL 260 CO 0.34 -0.92 2.12 0.54 0.00 0.00 0.00 175.10 177.18 3hjv n ARG 261 N 7.61 4.24 -0.09 2.72 1.74 -0.83 -0.71 116.66 131.34 3hjv n ARG 261 Ca 0.11 -3.59 -0.12 0.00 -0.77 0.00 0.00 57.85 53.48 3hjv n ARG 261 Cb 0.49 -2.73 -0.04 0.00 -1.02 0.00 0.00 32.46 29.15 3hjv n ARG 261 CO 0.00 0.00 0.00 2.35 -1.52 0.00 0.00 177.63 178.46 3hjv h TRP 262 N 5.08 0.66 -0.50 -1.55 2.91 -1.62 -1.39 115.95 119.54 3hjv h TRP 262 Ca 0.55 -0.17 0.10 0.00 1.13 0.00 0.00 58.89 60.50 3hjv h TRP 262 Cb 0.45 -0.15 -0.10 0.00 -0.51 0.00 0.00 29.16 28.84 3hjv h TRP 262 CO 1.43 0.83 -0.24 1.15 -1.03 0.00 0.00 178.44 180.58 3hjv h THR 263 N 0.30 0.31 -0.49 2.65 2.02 -1.28 -1.24 112.91 115.18 3hjv h THR 263 Ca 0.06 0.00 -0.05 0.00 0.77 0.00 0.00 66.41 67.18 3hjv h THR 263 Cb 0.67 0.31 -0.02 0.00 -1.74 0.00 0.00 68.15 67.37 3hjv h THR 263 CO 0.04 0.00 0.09 -0.33 0.37 0.00 0.00 175.52 175.69 3hjv h GLU 264 N -0.12 0.76 -0.45 6.66 5.08 -1.81 -1.51 114.58 123.20 3hjv h GLU 264 Ca 0.23 -0.16 0.03 0.00 -1.00 0.00 0.00 59.36 58.46 3hjv h GLU 264 Cb 0.49 -0.11 -0.03 0.00 0.50 0.00 0.00 28.75 29.59 3hjv h GLU 264 CO -0.58 0.71 0.25 0.00 -1.00 0.00 0.00 179.01 178.38 3hjv h VAL 266 N 0.49 1.23 -0.78 0.00 2.07 -1.00 -2.65 116.25 115.63 3hjv h VAL 266 Ca 0.19 -0.78 -0.02 0.00 0.82 0.00 0.00 66.70 66.90 3hjv h VAL 266 Cb 0.05 0.73 -0.04 0.00 -1.52 0.00 0.00 31.29 30.51 3hjv h VAL 266 CO -0.11 0.29 0.39 -0.33 0.02 0.00 0.00 177.57 177.84 3hjv h GLU 267 N 0.75 1.10 -1.86 1.57 5.08 -0.89 -2.34 114.58 118.00 3hjv h GLU 267 Ca 0.17 -0.15 0.00 0.00 -1.00 0.00 0.00 59.36 58.39 3hjv h GLU 267 Cb 0.27 -0.21 0.00 0.00 0.50 0.00 0.00 28.75 29.32 3hjv h GLU 267 CO -0.01 0.84 0.00 0.94 -1.00 0.00 0.00 179.01 179.78 3hjv n GLN 268 N -4.40 0.20 0.00 2.33 -0.06 0.63 -1.14 117.38 114.95 3hjv n GLN 268 Ca 0.07 0.00 0.00 0.00 -2.00 0.00 0.00 57.00 55.07 3hjv n GLN 268 Cb 0.12 -1.40 0.00 0.00 -4.06 0.00 0.00 30.24 24.90 3hjv n GLN 268 CO 0.00 0.00 0.00 0.45 -0.20 0.00 0.00 177.06 177.31 3hjv n SER 270 N 1.19 0.00 0.11 1.69 2.88 -0.88 -1.74 113.62 116.87 3hjv n SER 270 Ca 0.00 0.00 0.04 0.00 -1.33 0.00 0.00 58.87 57.58 3hjv n SER 270 Cb 0.10 0.00 0.44 0.00 -0.75 0.00 0.00 64.21 64.01 3hjv n SER 270 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3hjv h ALA 271 N 0.00 1.65 -0.11 -1.46 0.00 -1.41 -2.06 119.26 115.87 3hjv h ALA 271 Ca 0.00 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.79 3hjv h ALA 271 Cb 0.00 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.70 3hjv h ALA 271 CO 0.00 0.27 0.00 1.04 0.00 0.00 0.00 179.25 180.56 3hjv n GLN 272 N -4.38 1.31 -0.23 0.00 6.02 -0.71 -4.88 117.38 114.50 3hjv n GLN 272 Ca -0.00 -0.48 0.00 0.00 -0.01 0.00 0.00 57.00 56.51 3hjv n GLN 272 Cb 0.18 -1.20 0.00 0.00 1.02 0.00 0.00 30.24 30.23 3hjv n GLN 272 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3hjv n GLY 273 N 0.81 0.71 3.73 1.08 0.00 -0.77 -5.06 105.19 105.69 3hjv n GLY 273 Ca 0.09 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.69 3hjv n GLY 273 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3hjv s VAL 274 N -2.31 2.93 -0.11 1.61 1.01 -1.25 -4.75 120.40 117.53 3hjv s VAL 274 Ca 0.00 0.72 0.19 0.00 0.00 0.00 0.00 61.98 62.90 3hjv s VAL 274 Cb 0.00 -3.46 -0.29 0.00 0.00 0.00 0.00 36.38 32.62 3hjv s VAL 274 CO 0.00 0.09 0.46 -0.62 0.00 0.00 0.00 175.10 175.03 3hjv n GLU 275 N 3.10 0.60 -3.71 2.72 1.02 0.33 -4.42 120.64 120.27 3hjv n GLU 275 Ca 0.09 -0.16 -0.14 0.00 -0.02 0.00 0.00 57.16 56.93 3hjv n GLU 275 Cb 0.41 -1.46 -0.08 0.00 -0.02 0.00 0.00 31.44 30.29 3hjv n GLU 275 CO 0.00 0.00 0.00 -1.59 1.18 0.00 0.00 177.13 176.72 3hjv s LYS 276 N -3.30 0.74 -0.16 3.49 -2.85 -1.22 -4.15 119.74 112.30 3hjv s LYS 276 Ca -0.06 -0.10 -0.03 0.00 -1.00 0.00 0.00 55.97 54.78 3hjv s LYS 276 Cb 0.13 0.33 -0.02 0.00 -2.06 0.00 0.00 37.83 36.21 3hjv s LYS 276 CO 0.81 -0.21 -0.05 -0.51 0.10 0.00 0.00 175.35 175.48 3hjv s LEU 277 N -1.30 3.11 -0.21 2.77 1.02 0.24 -1.24 118.68 123.06 3hjv s LEU 277 Ca -0.13 -0.20 -0.06 0.00 0.02 0.00 0.00 54.13 53.76 3hjv s LEU 277 Cb -0.04 -1.75 -0.03 0.00 0.02 0.00 0.00 46.19 44.39 3hjv s LEU 277 CO 0.05 0.14 0.03 -0.63 0.02 0.00 0.00 176.35 175.97 3hjv s ILE 278 N 0.50 4.21 0.33 -0.59 1.01 0.45 -1.97 121.20 125.14 3hjv s ILE 278 Ca -0.04 -0.22 -0.03 0.00 0.00 0.00 0.00 60.65 60.36 3hjv s ILE 278 Cb -0.15 -2.93 0.07 0.00 0.01 0.00 0.00 42.46 39.47 3hjv s ILE 278 CO 0.03 0.40 0.45 1.21 0.00 0.00 0.00 174.94 177.03 3hjv n GLU 279 N 4.37 -0.03 -0.37 2.79 2.13 -0.03 -1.00 120.64 128.50 3hjv n GLU 279 Ca -0.17 -0.97 0.05 0.00 0.66 0.00 0.00 57.16 56.74 3hjv n GLU 279 Cb 0.52 -0.38 -0.01 0.00 0.27 0.00 0.00 31.44 31.83 3hjv n GLU 279 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 3hjv n GLY 281 N 1.78 -1.96 3.77 8.31 0.00 -1.20 -0.53 105.19 115.36 3hjv n GLY 281 Ca 0.07 -1.34 -0.36 0.00 0.00 0.00 0.00 46.02 44.38 3hjv n GLY 281 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3hjv s PRO 282 N -0.96 3.31 0.69 1.61 0.04 -1.26 -4.54 135.00 133.89 3hjv s PRO 282 Ca 0.00 1.74 0.00 0.00 0.04 0.00 0.00 61.00 62.78 3hjv s PRO 282 Cb 0.00 -2.08 0.00 0.00 0.04 0.00 0.00 34.50 32.46 3hjv s PRO 282 CO 0.00 -0.91 0.00 0.41 0.04 0.00 0.00 177.00 176.54 3hjv n GLY 283 N 0.35 -2.02 0.89 0.56 0.00 -1.26 -4.74 105.19 98.97 3hjv n GLY 283 Ca 0.11 -1.40 0.04 0.00 0.00 0.00 0.00 46.02 44.78 3hjv n GLY 283 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3hjv n LYS 284 N -0.96 0.54 0.09 1.61 5.02 -1.26 -4.92 118.16 118.28 3hjv n LYS 284 Ca 0.00 -2.17 -0.13 0.00 -2.02 0.00 0.00 58.31 54.00 3hjv n LYS 284 Cb 0.06 -0.68 -0.07 0.00 -0.02 0.00 0.00 35.03 34.32 3hjv n LYS 284 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 3hjv h VAL 285 N 4.71 0.84 0.00 -0.18 2.07 -1.98 -2.79 116.25 118.92 3hjv h VAL 285 Ca -0.10 0.00 -0.06 0.00 0.82 0.00 0.00 66.70 67.36 3hjv h VAL 285 Cb 1.47 0.84 -0.01 0.00 -1.52 0.00 0.00 31.29 32.07 3hjv h VAL 285 CO 0.04 0.00 -0.29 -0.07 0.02 0.00 0.00 177.57 177.27 3hjv h LEU 286 N -0.18 0.00 -0.74 2.57 3.38 -1.95 -2.68 115.31 115.71 3hjv h LEU 286 Ca -0.01 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 3hjv h LEU 286 Cb 0.15 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 40.87 3hjv h LEU 286 CO 0.00 0.29 0.43 0.74 0.09 0.00 0.00 178.44 179.99 3hjv h THR 287 N 0.00 1.22 -0.23 0.22 2.02 -1.88 -1.83 112.91 112.43 3hjv h THR 287 Ca -0.00 -0.51 -0.09 0.00 0.77 0.00 0.00 66.41 66.58 3hjv h THR 287 Cb 0.66 0.21 -0.01 0.00 -1.74 0.00 0.00 68.15 67.27 3hjv h THR 287 CO 0.04 0.23 -0.23 1.23 0.37 0.00 0.00 175.52 177.16 3hjv h GLY 288 N 1.02 0.45 1.05 2.16 0.00 -1.31 -2.97 103.07 103.47 3hjv h GLY 288 Ca 0.26 -0.35 -0.12 0.00 0.00 0.00 0.00 47.33 47.12 3hjv h GLY 288 CO -0.05 0.33 -0.22 1.41 0.00 0.00 0.00 176.54 178.00 3hjv h LEU 289 N 0.38 0.90 -0.56 3.11 3.38 -1.33 -3.21 115.31 117.96 3hjv h LEU 289 Ca 0.06 -0.41 0.09 0.00 0.09 0.00 0.00 57.88 57.70 3hjv h LEU 289 Cb 0.62 -0.25 -0.07 0.00 0.09 0.00 0.00 40.66 41.05 3hjv h LEU 289 CO 0.04 1.11 0.18 0.74 0.09 0.00 0.00 178.44 180.61 3hjv h THR 290 N 0.68 0.76 -1.00 0.22 2.02 -1.19 -0.50 112.91 113.91 3hjv h THR 290 Ca 0.09 -0.12 0.21 0.00 0.77 0.00 0.00 66.41 67.36 3hjv h THR 290 Cb 0.79 0.38 -0.10 0.00 -1.74 0.00 0.00 68.15 67.48 3hjv h THR 290 CO 0.06 0.06 0.62 0.50 0.37 0.00 0.00 175.52 177.14 3hjv h LYS 291 N 0.35 0.62 -0.01 6.66 3.64 -1.54 -0.38 116.57 125.91 3hjv h LYS 291 Ca 0.28 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.63 3hjv h LYS 291 Cb 0.35 -0.14 0.00 0.00 -0.41 0.00 0.00 32.23 32.03 3hjv h LYS 291 CO -0.31 0.41 -0.13 0.54 -2.27 0.00 0.00 179.45 177.69 3hjv n ARG 292 N -4.74 0.97 -0.07 1.90 1.74 -0.23 -3.69 116.66 112.53 3hjv n ARG 292 Ca 0.24 -0.46 -0.11 0.00 -0.77 0.00 0.00 57.85 56.74 3hjv n ARG 292 Cb 0.66 -1.49 -0.04 0.00 -1.02 0.00 0.00 32.46 30.57 3hjv n ARG 292 CO 0.00 0.00 0.00 -0.89 -1.52 0.00 0.00 177.63 175.22 3hjv n ILE 293 N -0.61 1.36 -3.53 0.55 5.41 -0.28 -4.28 119.36 117.97 3hjv n ILE 293 Ca 0.15 0.07 -0.23 0.00 1.00 0.00 0.00 62.75 63.74 3hjv n ILE 293 Cb 0.31 -2.06 -0.14 0.00 -0.71 0.00 0.00 39.64 37.04 3hjv n ILE 293 CO 0.00 0.00 0.00 -0.69 0.00 0.00 0.00 176.55 175.86 3hjv s VAL 294 N -2.60 -0.19 0.24 1.39 1.01 -0.47 -4.99 120.40 114.78 3hjv s VAL 294 Ca -0.24 -0.33 -0.05 0.00 0.00 0.00 0.00 61.98 61.36 3hjv s VAL 294 Cb 0.05 -0.75 0.20 0.00 0.00 0.00 0.00 36.38 35.88 3hjv s VAL 294 CO 0.34 -0.39 1.75 0.50 0.00 0.00 0.00 175.10 177.30 3hjv h LYS 295 N 8.37 0.51 0.00 2.72 3.64 -1.72 -1.72 116.57 128.37 3hjv h LYS 295 Ca -0.17 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.18 3hjv h LYS 295 Cb 1.11 -0.12 0.00 0.00 -0.41 0.00 0.00 32.23 32.81 3hjv h LYS 295 CO 0.33 0.34 0.00 0.25 -2.27 0.00 0.00 179.45 178.10 3hjv n THR 296 N -4.93 0.89 1.30 1.00 -2.24 -1.26 -2.53 114.28 106.50 3hjv n THR 296 Ca 0.13 0.22 0.14 0.00 -2.27 0.00 0.00 64.05 62.27 3hjv n THR 296 Cb 0.35 -0.96 0.60 0.00 -2.10 0.00 0.00 70.33 68.22 3hjv n THR 296 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 3hjv n LEU 297 N -1.47 0.30 -4.65 3.22 4.77 -0.65 -4.71 117.00 113.81 3hjv n LEU 297 Ca 0.04 0.15 -0.42 0.00 -0.03 0.00 0.00 56.01 55.75 3hjv n LEU 297 Cb 0.17 -0.27 -0.03 0.00 -2.33 0.00 0.00 43.42 40.97 3hjv n LEU 297 CO 0.14 0.06 1.43 -0.70 -1.33 0.00 0.00 177.39 176.99 3hjv s GLU 298 N -2.64 4.06 0.00 3.23 2.12 -1.05 -0.59 118.70 123.83 3hjv s GLU 298 Ca 0.24 2.17 0.00 0.00 0.36 0.00 0.00 54.97 57.74 3hjv s GLU 298 Cb 0.20 -4.04 0.00 0.00 0.26 0.00 0.00 34.13 30.55 3hjv s GLU 298 CO 0.51 -0.99 0.00 0.41 -0.54 0.00 0.00 175.26 174.64 3hjv n GLY 299 N 4.35 3.70 3.79 -1.50 0.00 -0.83 -4.81 105.19 109.89 3hjv n GLY 299 Ca 0.18 -1.82 -0.24 0.00 0.00 0.00 0.00 46.02 44.15 3hjv n GLY 299 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3hjv s VAL 300 N 2.76 2.29 -0.23 1.61 -7.23 -1.25 -4.93 120.40 113.42 3hjv s VAL 300 Ca 0.00 -1.59 -0.07 0.00 -1.81 0.00 0.00 61.98 58.51 3hjv s VAL 300 Cb 0.00 -2.88 -0.03 0.00 0.56 0.00 0.00 36.38 34.02 3hjv s VAL 300 CO 0.00 0.00 0.07 0.00 -0.31 0.00 0.00 175.10 174.86 3hjv s ALA 301 N -2.59 3.24 -0.40 1.32 0.00 -1.26 -0.85 121.76 121.21 3hjv s ALA 301 Ca 0.41 -1.02 -0.15 0.00 0.00 0.00 0.00 51.96 51.21 3hjv s ALA 301 Cb 0.01 -2.05 0.02 0.00 0.00 0.00 0.00 23.12 21.10 3hjv s ALA 301 CO 0.23 -0.30 0.29 0.08 0.00 0.00 0.00 175.76 176.06 3hjv s VAL 302 N 1.27 5.23 0.00 0.00 1.01 0.32 -4.86 120.40 123.37 3hjv s VAL 302 Ca 0.05 -0.64 0.00 0.00 0.00 0.00 0.00 61.98 61.39 3hjv s VAL 302 Cb -0.15 -3.90 0.00 0.00 0.00 0.00 0.00 36.38 32.34 3hjv s VAL 302 CO 0.04 -0.29 0.02 -0.46 0.00 0.00 0.00 175.10 174.41 3hjv n ASN 303 N 5.15 0.00 -3.68 3.32 0.23 -1.26 -3.23 115.26 115.79 3hjv n ASN 303 Ca -0.11 -1.00 -0.16 0.00 -0.53 0.00 0.00 54.58 52.78 3hjv n ASN 303 Cb 0.47 0.00 -0.08 0.00 -2.08 0.00 0.00 39.78 38.09 3hjv n ASN 303 CO 0.00 0.00 0.00 1.51 -0.93 0.00 0.00 177.26 177.84 3hjv s ASP 304 N 0.00 0.95 0.17 0.53 1.47 -1.26 -4.68 116.67 113.85 3hjv s ASP 304 Ca 0.00 -1.55 -0.14 0.00 1.18 0.00 0.00 52.55 52.04 3hjv s ASP 304 Cb 0.00 0.51 0.07 0.00 -0.34 0.00 0.00 42.92 43.15 3hjv s ASP 304 CO 0.00 -1.02 1.84 0.58 0.68 0.00 0.00 175.17 177.25 3hjv h VAL 305 N 2.31 1.13 -0.79 2.11 2.07 -1.96 -2.95 116.25 118.17 3hjv h VAL 305 Ca -0.29 -0.24 -0.03 0.00 0.82 0.00 0.00 66.70 66.96 3hjv h VAL 305 Cb 1.24 0.37 -0.04 0.00 -1.52 0.00 0.00 31.29 31.34 3hjv h VAL 305 CO 0.43 0.13 0.38 0.00 0.02 0.00 0.00 177.57 178.52 3hjv h ALA 306 N 1.20 1.01 0.00 1.67 0.00 -2.00 -2.40 119.26 118.74 3hjv h ALA 306 Ca 0.19 -0.15 -0.02 0.00 0.00 0.00 0.00 54.91 54.93 3hjv h ALA 306 Cb -0.07 -0.31 -0.00 0.00 0.00 0.00 0.00 17.79 17.41 3hjv h ALA 306 CO -0.05 0.58 -0.08 0.66 0.00 0.00 0.00 179.25 180.36 3hjv h SER 307 N 1.11 0.00 -0.02 0.00 4.64 -1.86 -2.00 113.55 115.43 3hjv h SER 307 Ca 0.27 0.00 0.01 0.00 -0.47 0.00 0.00 61.79 61.60 3hjv h SER 307 Cb 0.12 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.21 3hjv h SER 307 CO -0.03 0.08 0.03 -0.07 -0.87 0.00 0.00 176.83 175.97 3hjv h LEU 308 N 0.00 0.00 -1.12 5.97 -0.00 -1.37 -1.75 115.31 117.04 3hjv h LEU 308 Ca -0.00 0.00 -0.07 0.00 -0.00 0.00 0.00 57.88 57.81 3hjv h LEU 308 Cb 0.38 0.00 -0.02 0.00 -0.00 0.00 0.00 40.66 41.02 3hjv h LEU 308 CO 0.01 0.00 -0.12 0.44 -0.00 0.00 0.00 178.44 178.77 3hjv h ASP 309 N 0.00 0.46 0.24 -0.43 3.32 -1.51 -2.63 116.42 115.86 3hjv h ASP 309 Ca 0.01 -0.11 -0.02 0.00 0.02 0.00 0.00 57.03 56.93 3hjv h ASP 309 Cb 0.07 -0.12 -0.00 0.00 0.22 0.00 0.00 39.33 39.50 3hjv h ASP 309 CO -0.00 0.61 -0.07 0.00 -1.72 0.00 0.00 179.24 178.06 3hjv h ALA 310 N 1.44 1.34 -0.12 3.45 0.00 -1.49 -2.91 119.26 120.96 3hjv h ALA 310 Ca 0.08 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.93 3hjv h ALA 310 Cb 0.48 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.26 3hjv h ALA 310 CO 0.03 0.09 0.00 1.33 0.00 0.00 0.00 179.25 180.70 3hjv n VAL 311 N -3.67 0.37 1.77 0.00 0.24 -1.05 -5.11 118.33 110.89 3hjv n VAL 311 Ca -0.02 -0.69 0.15 0.00 -2.04 0.00 0.00 64.34 61.74 3hjv n VAL 311 Cb 0.18 0.94 0.75 0.00 -1.47 0.00 0.00 33.84 34.24 3hjv n VAL 311 CO 0.00 0.00 0.00 0.29 -2.14 0.00 0.00 176.83 174.98