#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hjz s LYS 2 N 0.00 -0.01 0.97 1.61 1.02 -1.26 -5.32 119.74 116.75 3hjz s LYS 2 Ca 0.00 0.28 -0.11 0.00 0.02 0.00 0.00 55.97 56.16 3hjz s LYS 2 Cb 0.00 -0.86 0.17 0.00 -0.52 0.00 0.00 37.83 36.63 3hjz s LYS 2 CO 0.00 -0.43 1.10 -1.54 -0.92 0.00 0.00 175.35 173.55 3hjz s SER 3 N 2.19 2.63 0.25 2.83 1.04 -1.26 -4.63 113.70 116.75 3hjz s SER 3 Ca 0.04 1.85 -0.05 0.00 0.48 0.00 0.00 55.95 58.27 3hjz s SER 3 Cb -0.13 -2.42 0.35 0.00 0.10 0.00 0.00 66.02 63.92 3hjz s SER 3 CO -0.06 -3.22 1.86 0.40 0.98 0.00 0.00 173.24 173.20 3hjz h ILE 4 N -1.95 1.05 -0.66 -1.02 1.08 -1.35 -1.57 117.51 113.09 3hjz h ILE 4 Ca -0.49 -0.35 0.02 0.00 -0.39 0.00 0.00 64.86 63.65 3hjz h ILE 4 Cb 1.28 -0.05 -0.04 0.00 -3.07 0.00 0.00 36.82 34.94 3hjz h ILE 4 CO 0.47 0.18 0.42 0.25 -0.69 0.00 0.00 178.15 178.79 3hjz h LEU 5 N 1.01 0.72 -0.51 1.44 5.85 -1.60 0.37 115.31 122.59 3hjz h LEU 5 Ca 0.39 -0.01 -0.09 0.00 0.84 0.00 0.00 57.88 59.01 3hjz h LEU 5 Cb 0.18 -0.17 -0.02 0.00 0.37 0.00 0.00 40.66 41.02 3hjz h LEU 5 CO -0.18 0.51 -0.04 -0.08 -0.34 0.00 0.00 178.44 178.31 3hjz h GLU 6 N 0.85 0.92 -0.05 1.25 4.81 -1.73 0.33 114.58 120.96 3hjz h GLU 6 Ca 0.25 -0.32 0.02 0.00 -0.13 0.00 0.00 59.36 59.19 3hjz h GLU 6 Cb -0.05 -0.07 -0.02 0.00 0.63 0.00 0.00 28.75 29.23 3hjz h GLU 6 CO -0.07 0.97 -0.07 1.96 -0.73 0.00 0.00 179.01 181.06 3hjz h GLN 7 N 0.79 -0.10 -0.76 1.92 4.20 -1.03 -2.66 115.11 117.47 3hjz h GLN 7 Ca 0.14 0.01 0.08 0.00 0.06 0.00 0.00 58.65 58.94 3hjz h GLN 7 Cb 0.58 0.02 -0.07 0.00 0.30 0.00 0.00 27.48 28.31 3hjz h GLN 7 CO 0.03 -0.07 0.42 1.25 -0.67 0.00 0.00 178.83 179.80 3hjz h LEU 8 N -0.10 0.60 -1.68 1.46 5.85 -0.56 -1.86 115.31 119.02 3hjz h LEU 8 Ca 0.05 0.04 -0.00 0.00 0.84 0.00 0.00 57.88 58.81 3hjz h LEU 8 Cb 0.17 -0.07 -0.00 0.00 0.37 0.00 0.00 40.66 41.13 3hjz h LEU 8 CO -0.12 0.36 -0.00 0.28 -0.34 0.00 0.00 178.44 178.62 3hjz h SER 9 N 0.73 0.00 0.00 1.25 0.02 -0.74 -0.88 113.55 113.93 3hjz h SER 9 Ca 0.36 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.31 3hjz h SER 9 Cb 0.31 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.85 3hjz h SER 9 CO -0.23 0.00 0.00 -1.54 -1.14 0.00 0.00 176.83 173.92 3hjz n SER 10 N -3.09 1.98 0.00 3.07 3.41 -0.70 -4.67 113.62 113.62 3hjz n SER 10 Ca 0.00 -1.91 0.00 0.00 -0.26 0.00 0.00 58.87 56.70 3hjz n SER 10 Cb 0.27 -0.48 0.00 0.00 -0.26 0.00 0.00 64.21 63.75 3hjz n SER 10 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 175.04 175.29 3hjz n THR 12 N 0.29 0.00 -2.16 6.66 -1.04 -0.34 -5.11 114.28 112.59 3hjz n THR 12 Ca 0.00 0.00 -0.42 0.00 -2.04 0.00 0.00 64.05 61.59 3hjz n THR 12 Cb 0.37 0.00 -0.03 0.00 -1.82 0.00 0.00 70.33 68.85 3hjz n THR 12 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 3hjz s VAL 13 N 0.00 3.63 -0.08 12.58 1.01 -0.54 -4.95 120.40 132.05 3hjz s VAL 13 Ca 0.00 0.61 -0.18 0.00 0.00 0.00 0.00 61.98 62.41 3hjz s VAL 13 Cb 0.00 -3.94 -0.05 0.00 0.00 0.00 0.00 36.38 32.39 3hjz s VAL 13 CO 0.00 -0.66 0.48 -0.69 0.00 0.00 0.00 175.10 174.22 3hjz s VAL 14 N 6.60 5.13 -0.10 2.92 1.01 -1.26 -1.73 120.40 132.96 3hjz s VAL 14 Ca 0.69 0.96 0.00 0.00 0.00 0.00 0.00 61.98 63.64 3hjz s VAL 14 Cb -0.17 -3.81 0.02 0.00 0.00 0.00 0.00 36.38 32.42 3hjz s VAL 14 CO 0.31 0.38 -0.09 -0.69 0.00 0.00 0.00 175.10 175.01 3hjz s VAL 15 N 0.24 1.07 0.26 2.92 1.01 -0.63 -4.75 120.40 120.52 3hjz s VAL 15 Ca 0.26 -0.35 -0.30 0.00 0.00 0.00 0.00 61.98 61.58 3hjz s VAL 15 Cb -0.16 -1.04 -0.11 0.00 0.00 0.00 0.00 36.38 35.07 3hjz s VAL 15 CO 0.12 0.36 1.55 0.00 0.00 0.00 0.00 175.10 177.13 3hjz s ALA 16 N 1.35 3.72 -0.22 5.51 0.00 -1.26 -0.51 121.76 130.36 3hjz s ALA 16 Ca -0.02 1.48 -0.29 0.00 0.00 0.00 0.00 51.96 53.13 3hjz s ALA 16 Cb -0.14 -3.62 -0.00 0.00 0.00 0.00 0.00 23.12 19.36 3hjz s ALA 16 CO -0.04 -0.89 1.23 0.34 0.00 0.00 0.00 175.76 176.40 3hjz s ASP 17 N 0.54 6.90 0.04 0.00 -1.08 0.80 -4.71 116.67 119.16 3hjz s ASP 17 Ca 0.63 1.50 0.05 0.00 -0.52 0.00 0.00 52.55 54.21 3hjz s ASP 17 Cb -0.46 -2.54 -0.02 0.00 -1.46 0.00 0.00 42.92 38.44 3hjz s ASP 17 CO 0.44 -0.83 -0.15 0.42 0.52 0.00 0.00 175.17 175.57 3hjz s THR 18 N 3.67 1.22 0.00 1.71 -4.23 -1.26 -4.42 115.64 112.33 3hjz s THR 18 Ca 0.53 -1.01 0.00 0.00 -1.18 0.00 0.00 61.69 60.03 3hjz s THR 18 Cb -0.19 -1.09 0.00 0.00 1.34 0.00 0.00 72.50 72.56 3hjz s THR 18 CO 0.15 0.07 0.84 0.61 -0.54 0.00 0.00 174.62 175.75 3hjz n GLY 19 N 1.95 1.10 3.44 3.99 0.00 -1.26 -4.83 105.19 109.58 3hjz n GLY 19 Ca -0.18 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.74 3hjz n GLY 19 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 3hjz s ASP 20 N -0.68 -0.29 0.25 1.61 -4.77 -1.26 -3.94 116.67 107.58 3hjz s ASP 20 Ca 0.00 -0.37 -0.03 0.00 -3.30 0.00 0.00 52.55 48.85 3hjz s ASP 20 Cb 0.00 0.55 0.28 0.00 -1.09 0.00 0.00 42.92 42.66 3hjz s ASP 20 CO 0.00 -0.97 1.75 0.25 0.70 0.00 0.00 175.17 176.90 3hjz h LEU 21 N 2.23 0.84 -0.77 2.11 5.85 -1.98 -2.02 115.31 121.58 3hjz h LEU 21 Ca -0.31 -0.20 0.03 0.00 0.84 0.00 0.00 57.88 58.24 3hjz h LEU 21 Cb 1.27 -0.22 -0.05 0.00 0.37 0.00 0.00 40.66 42.03 3hjz h LEU 21 CO 0.41 0.88 0.49 0.44 -0.34 0.00 0.00 178.44 180.31 3hjz h ASP 22 N 0.83 0.81 -0.01 1.25 3.32 -1.99 -0.45 116.42 120.17 3hjz h ASP 22 Ca 0.16 -0.00 -0.10 0.00 0.02 0.00 0.00 57.03 57.11 3hjz h ASP 22 Cb 0.43 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 39.79 3hjz h ASP 22 CO 0.01 0.56 -0.30 0.28 -1.72 0.00 0.00 179.24 178.07 3hjz h SER 23 N 0.96 0.48 -0.31 6.45 0.02 -1.90 -0.44 113.55 118.81 3hjz h SER 23 Ca 0.31 -0.18 -0.03 0.00 -0.84 0.00 0.00 61.79 61.05 3hjz h SER 23 Cb 0.01 -0.13 -0.01 0.00 0.14 0.00 0.00 62.40 62.41 3hjz h SER 23 CO -0.11 0.76 0.09 0.40 -1.14 0.00 0.00 176.83 176.83 3hjz h ILE 24 N 0.40 1.21 -0.65 3.27 2.04 -0.82 -0.12 117.51 122.85 3hjz h ILE 24 Ca 0.05 -0.68 -0.00 0.00 1.00 0.00 0.00 64.86 65.23 3hjz h ILE 24 Cb 0.74 1.08 -0.03 0.00 -0.74 0.00 0.00 36.82 37.86 3hjz h ILE 24 CO 0.06 0.23 0.40 0.11 0.00 0.00 0.00 178.15 178.95 3hjz h LYS 25 N 0.34 0.87 -0.00 2.37 1.57 -0.90 -0.49 116.57 120.33 3hjz h LYS 25 Ca 0.10 -0.07 -0.00 0.00 -1.87 0.00 0.00 60.65 58.80 3hjz h LYS 25 Cb 0.26 -0.19 -0.00 0.00 0.08 0.00 0.00 32.23 32.39 3hjz h LYS 25 CO -0.00 0.61 -0.00 -0.22 -0.57 0.00 0.00 179.45 179.27 3hjz h LYS 26 N 0.88 0.01 0.00 3.15 3.64 -0.89 -3.33 116.57 120.03 3hjz h LYS 26 Ca 0.23 -0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.61 3hjz h LYS 26 Cb -0.05 -0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.77 3hjz h LYS 26 CO -0.05 0.44 -0.84 0.74 -2.27 0.00 0.00 179.45 177.47 3hjz h PHE 27 N -0.42 0.00 -6.38 1.91 0.04 -1.06 -3.49 116.94 107.53 3hjz h PHE 27 Ca 0.00 0.00 -0.47 0.00 2.80 0.00 0.00 57.97 60.30 3hjz h PHE 27 Cb 0.44 0.00 0.05 0.00 2.20 0.00 0.00 35.95 38.63 3hjz h PHE 27 CO 0.08 0.00 -0.94 1.04 -0.60 0.00 0.00 178.31 177.88 3hjz n GLN 28 N -2.68 -1.41 -1.87 1.51 6.02 -0.19 -4.93 117.38 113.84 3hjz n GLN 28 Ca 0.01 0.39 -0.35 0.00 -0.01 0.00 0.00 57.00 57.04 3hjz n GLN 28 Cb 0.54 -3.94 0.04 0.00 1.02 0.00 0.00 30.24 27.91 3hjz n GLN 28 CO 0.00 0.00 0.00 -1.25 -1.01 0.00 0.00 177.06 174.80 3hjz s PRO 29 N -6.31 2.81 0.14 -1.09 0.04 -1.26 -4.92 135.00 124.41 3hjz s PRO 29 Ca 0.40 1.68 -0.14 0.00 0.04 0.00 0.00 61.00 62.99 3hjz s PRO 29 Cb -0.16 -1.92 0.01 0.00 0.04 0.00 0.00 34.50 32.47 3hjz s PRO 29 CO 0.88 -1.30 1.64 -0.09 0.04 0.00 0.00 177.00 178.17 3hjz h ARG 30 N 0.49 0.77 -6.21 4.56 2.43 -1.92 -3.40 114.38 111.09 3hjz h ARG 30 Ca -0.49 -0.20 -0.58 0.00 -0.81 0.00 0.00 59.98 57.90 3hjz h ARG 30 Cb 1.28 -0.09 -0.18 0.00 -0.42 0.00 0.00 29.97 30.56 3hjz h ARG 30 CO 0.54 0.77 -0.79 -0.51 -1.51 0.00 0.00 179.97 178.46 3hjz s ASP 31 N -6.15 3.06 0.09 -3.80 1.01 -1.26 -0.78 116.67 108.85 3hjz s ASP 31 Ca -0.13 -0.89 -0.02 0.00 0.71 0.00 0.00 52.55 52.22 3hjz s ASP 31 Cb 0.11 -0.21 0.01 0.00 1.01 0.00 0.00 42.92 43.84 3hjz s ASP 31 CO 0.79 0.03 0.16 0.00 0.21 0.00 0.00 175.17 176.36 3hjz n ALA 32 N 0.17 -0.28 -3.40 5.23 0.00 -1.04 -4.87 120.51 116.33 3hjz n ALA 32 Ca -0.12 -0.34 -0.16 0.00 0.00 0.00 0.00 53.44 52.82 3hjz n ALA 32 Cb 0.57 0.27 -0.16 0.00 0.00 0.00 0.00 19.45 20.14 3hjz n ALA 32 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 3hjz s THR 33 N -2.68 0.23 -0.22 0.00 2.01 -1.26 -0.53 115.64 113.19 3hjz s THR 33 Ca 0.05 -0.01 -0.14 0.00 0.31 0.00 0.00 61.69 61.90 3hjz s THR 33 Cb -0.01 -0.28 -0.04 0.00 0.01 0.00 0.00 72.50 72.18 3hjz s THR 33 CO 0.04 0.13 0.32 0.28 -0.69 0.00 0.00 174.62 174.70 3hjz s THR 34 N 0.63 5.25 0.22 -0.82 -1.32 0.06 -4.92 115.64 114.73 3hjz s THR 34 Ca -0.06 0.54 -0.13 0.00 -1.21 0.00 0.00 61.69 60.82 3hjz s THR 34 Cb -0.10 -3.66 0.00 0.00 -1.51 0.00 0.00 72.50 67.24 3hjz s THR 34 CO -0.01 0.27 0.45 0.54 -2.21 0.00 0.00 174.62 173.66 3hjz s ASN 35 N 1.09 -0.10 0.30 8.08 2.20 -1.26 -2.09 114.94 123.16 3hjz s ASN 35 Ca 0.15 -0.82 0.06 0.00 -0.94 0.00 0.00 52.86 51.32 3hjz s ASN 35 Cb -0.14 0.55 0.81 0.00 -2.00 0.00 0.00 41.25 40.46 3hjz s ASN 35 CO 0.07 -1.07 1.69 -0.65 -2.94 0.00 0.00 177.10 174.21 3hjz h PRO 36 N 2.30 0.40 -0.71 3.55 0.11 -1.94 -2.72 132.00 133.00 3hjz h PRO 36 Ca -0.28 -0.02 -0.07 0.00 0.11 0.00 0.00 66.00 65.74 3hjz h PRO 36 Cb 1.25 -0.09 -0.03 0.00 0.11 0.00 0.00 31.00 32.24 3hjz h PRO 36 CO 0.38 0.26 0.18 0.77 -0.21 0.00 0.00 178.00 179.39 3hjz h SER 37 N 0.41 1.07 -0.72 -2.05 0.02 -1.94 -0.72 113.55 109.61 3hjz h SER 37 Ca 0.60 -0.23 -0.01 0.00 -0.84 0.00 0.00 61.79 61.31 3hjz h SER 37 Cb 1.18 -0.28 -0.03 0.00 0.14 0.00 0.00 62.40 63.40 3hjz h SER 37 CO -0.54 1.02 0.43 0.25 -1.14 0.00 0.00 176.83 176.85 3hjz h LEU 38 N 1.06 0.87 -0.43 5.07 6.46 -1.61 -1.61 115.31 125.12 3hjz h LEU 38 Ca 0.22 -0.07 -0.15 0.00 -0.12 0.00 0.00 57.88 57.76 3hjz h LEU 38 Cb 0.36 -0.22 -0.01 0.00 -0.73 0.00 0.00 40.66 40.07 3hjz h LEU 38 CO 0.00 0.68 -0.36 0.40 -0.62 0.00 0.00 178.44 178.55 3hjz h ILE 39 N 0.98 1.27 -0.56 4.05 2.04 -1.25 -0.98 117.51 123.06 3hjz h ILE 39 Ca 0.26 -1.53 0.03 0.00 1.00 0.00 0.00 64.86 64.62 3hjz h ILE 39 Cb -0.02 1.34 -0.04 0.00 -0.74 0.00 0.00 36.82 37.36 3hjz h ILE 39 CO -0.05 0.51 0.33 -0.07 0.00 0.00 0.00 178.15 178.88 3hjz h LEU 40 N 0.76 0.52 -0.55 1.44 3.38 -1.05 -1.40 115.31 118.41 3hjz h LEU 40 Ca 0.07 0.01 0.06 0.00 0.09 0.00 0.00 57.88 58.11 3hjz h LEU 40 Cb 0.94 -0.10 -0.05 0.00 0.09 0.00 0.00 40.66 41.55 3hjz h LEU 40 CO 0.09 0.36 0.26 0.00 0.09 0.00 0.00 178.44 179.24 3hjz h ALA 41 N 1.26 0.70 0.00 1.53 0.00 -1.14 -2.77 119.26 118.86 3hjz h ALA 41 Ca 0.23 0.04 -0.07 0.00 0.00 0.00 0.00 54.91 55.11 3hjz h ALA 41 Cb 0.06 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 3hjz h ALA 41 CO -0.12 -0.10 -0.31 0.00 0.00 0.00 0.00 179.25 178.72 3hjz h ALA 42 N 1.32 1.46 -0.02 0.00 0.00 -0.68 -2.67 119.26 118.66 3hjz h ALA 42 Ca 0.25 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.88 3hjz h ALA 42 Cb 0.20 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 17.94 3hjz h ALA 42 CO -0.19 0.39 0.05 0.00 0.00 0.00 0.00 179.25 179.50 3hjz h ALA 43 N 1.69 1.22 -0.00 0.00 0.00 -0.96 0.20 119.26 121.41 3hjz h ALA 43 Ca -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3hjz h ALA 43 Cb 0.56 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.35 3hjz h ALA 43 CO 0.04 -0.06 -0.13 1.63 0.00 0.00 0.00 179.25 180.73 3hjz n LYS 44 N -3.30 0.28 -3.88 0.00 4.76 -1.01 -4.71 118.16 110.30 3hjz n LYS 44 Ca -0.02 -0.07 -0.36 0.00 -2.87 0.00 0.00 58.31 54.98 3hjz n LYS 44 Cb 0.13 -1.50 -0.12 0.00 -1.84 0.00 0.00 35.03 31.70 3hjz n LYS 44 CO 0.00 0.00 0.00 1.21 -1.37 0.00 0.00 177.40 177.24 3hjz s ASN 45 N -2.77 5.13 0.62 4.39 3.84 0.06 -5.00 114.94 121.20 3hjz s ASN 45 Ca 0.20 -0.16 0.39 0.00 0.21 0.00 0.00 52.86 53.50 3hjz s ASN 45 Cb 0.19 -1.90 2.02 0.00 -0.55 0.00 0.00 41.25 41.01 3hjz s ASN 45 CO 0.53 0.02 2.24 1.55 -2.79 0.00 0.00 177.10 178.66 3hjz h PRO 46 N 7.80 0.00 0.11 0.43 0.13 -1.88 -0.47 132.00 138.13 3hjz h PRO 46 Ca -0.37 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.75 3hjz h PRO 46 Cb 1.18 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.31 3hjz h PRO 46 CO 0.60 0.02 -0.05 0.22 -0.23 0.00 0.00 178.00 178.56 3hjz h ASP 47 N 0.00 -0.12 0.39 1.44 3.58 -1.94 -3.40 116.42 116.36 3hjz h ASP 47 Ca -0.00 0.00 -0.08 0.00 0.42 0.00 0.00 57.03 57.37 3hjz h ASP 47 Cb 0.15 0.03 -0.01 0.00 1.72 0.00 0.00 39.33 41.22 3hjz h ASP 47 CO 0.00 0.28 -0.40 1.88 -2.88 0.00 0.00 179.24 178.13 3hjz h TYR 48 N -0.89 0.02 -0.37 0.28 0.05 -1.70 -2.57 116.97 111.79 3hjz h TYR 48 Ca -0.02 -0.00 0.11 0.00 0.05 0.00 0.00 58.73 58.87 3hjz h TYR 48 Cb 0.11 -0.00 -0.01 0.00 1.01 0.00 0.00 36.73 37.83 3hjz h TYR 48 CO 0.00 0.41 0.28 -0.24 -1.05 0.00 0.00 178.16 177.56 3hjz h VAL 49 N 0.01 0.76 -0.10 -2.88 3.04 -1.09 0.06 116.25 116.05 3hjz h VAL 49 Ca -0.00 0.00 -0.02 0.00 -1.01 0.00 0.00 66.70 65.67 3hjz h VAL 49 Cb 0.71 0.80 -0.01 0.00 -2.01 0.00 0.00 31.29 30.79 3hjz h VAL 49 CO 0.05 0.00 -0.03 0.11 -1.01 0.00 0.00 177.57 176.69 3hjz h LYS 50 N 0.00 0.15 -0.06 4.17 1.57 -1.66 -0.96 116.57 119.78 3hjz h LYS 50 Ca 0.18 -0.02 -0.17 0.00 -1.87 0.00 0.00 60.65 58.77 3hjz h LYS 50 Cb 0.73 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 33.00 3hjz h LYS 50 CO -0.00 0.20 -0.71 1.25 -0.57 0.00 0.00 179.45 179.62 3hjz h LEU 51 N 0.15 0.36 0.29 2.94 5.85 -1.14 -0.55 115.31 123.20 3hjz h LEU 51 Ca 0.04 -0.24 -0.01 0.00 0.84 0.00 0.00 57.88 58.51 3hjz h LEU 51 Cb 0.16 -0.11 -0.00 0.00 0.37 0.00 0.00 40.66 41.09 3hjz h LEU 51 CO 0.01 0.95 -0.16 0.40 -0.34 0.00 0.00 178.44 179.30 3hjz h ILE 52 N 0.21 0.67 -0.71 4.05 2.04 -1.21 -2.02 117.51 120.54 3hjz h ILE 52 Ca -0.02 0.00 0.05 0.00 1.00 0.00 0.00 64.86 65.88 3hjz h ILE 52 Cb 1.27 0.67 -0.04 0.00 -0.74 0.00 0.00 36.82 37.97 3hjz h ILE 52 CO 0.11 0.00 0.47 0.44 0.00 0.00 0.00 178.15 179.17 3hjz h ASP 53 N -0.42 0.70 -0.92 1.72 3.32 -1.10 -1.82 116.42 117.90 3hjz h ASP 53 Ca -0.03 -0.00 0.01 0.00 0.02 0.00 0.00 57.03 57.02 3hjz h ASP 53 Cb 0.34 -0.16 -0.05 0.00 0.22 0.00 0.00 39.33 39.69 3hjz h ASP 53 CO 0.05 0.47 0.60 0.50 -1.72 0.00 0.00 179.24 179.14 3hjz h LYS 54 N 0.81 1.22 -0.59 3.56 1.63 -0.93 -0.85 116.57 121.43 3hjz h LYS 54 Ca 0.29 -0.08 -0.03 0.00 -0.85 0.00 0.00 60.65 59.97 3hjz h LYS 54 Cb 0.14 -0.27 -0.03 0.00 -0.60 0.00 0.00 32.23 31.47 3hjz h LYS 54 CO -0.09 0.82 0.22 0.00 -3.45 0.00 0.00 179.45 176.96 3hjz h ALA 55 N 1.33 1.29 0.25 5.00 0.00 -0.59 0.25 119.26 126.79 3hjz h ALA 55 Ca 0.34 -0.16 -0.01 0.00 0.00 0.00 0.00 54.91 55.07 3hjz h ALA 55 Cb -0.12 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 17.43 3hjz h ALA 55 CO -0.07 0.52 -0.12 0.82 0.00 0.00 0.00 179.25 180.40 3hjz h ILE 56 N 0.85 0.80 -0.54 0.00 2.04 -0.92 -0.83 117.51 118.91 3hjz h ILE 56 Ca 0.20 -0.33 0.10 0.00 1.00 0.00 0.00 64.86 65.82 3hjz h ILE 56 Cb 0.18 0.99 -0.08 0.00 -0.74 0.00 0.00 36.82 37.18 3hjz h ILE 56 CO -0.02 0.07 0.11 -0.33 0.00 0.00 0.00 178.15 177.99 3hjz h GLU 57 N -0.51 0.24 -0.78 2.37 5.08 -0.80 -0.26 114.58 119.93 3hjz h GLU 57 Ca -0.03 -0.01 -0.02 0.00 -1.00 0.00 0.00 59.36 58.29 3hjz h GLU 57 Cb 0.38 -0.05 -0.04 0.00 0.50 0.00 0.00 28.75 29.54 3hjz h GLU 57 CO 0.06 0.16 0.39 1.03 -1.00 0.00 0.00 179.01 179.65 3hjz h SER 58 N 0.25 0.99 -0.23 1.42 0.87 -0.41 -1.70 113.55 114.74 3hjz h SER 58 Ca 0.28 -0.10 -0.16 0.00 -1.23 0.00 0.00 61.79 60.58 3hjz h SER 58 Cb 0.39 -0.25 -0.01 0.00 -0.44 0.00 0.00 62.40 62.09 3hjz h SER 58 CO -0.36 0.82 -0.42 0.28 -0.53 0.00 0.00 176.83 176.62 3hjz h SER 59 N 1.10 0.84 -0.76 6.23 0.02 -0.63 -1.33 113.55 119.03 3hjz h SER 59 Ca 0.27 -0.40 0.05 0.00 -0.84 0.00 0.00 61.79 60.88 3hjz h SER 59 Cb 0.08 -0.24 -0.05 0.00 0.14 0.00 0.00 62.40 62.32 3hjz h SER 59 CO -0.04 1.15 0.46 -0.33 -1.14 0.00 0.00 176.83 176.93 3hjz h GLU 60 N 0.64 0.83 -0.04 3.45 5.08 -0.71 -2.06 114.58 121.76 3hjz h GLU 60 Ca 0.05 -0.05 -0.10 0.00 -1.00 0.00 0.00 59.36 58.26 3hjz h GLU 60 Cb 0.99 -0.19 -0.01 0.00 0.50 0.00 0.00 28.75 30.04 3hjz h GLU 60 CO 0.09 0.55 -0.42 -0.97 -1.00 0.00 0.00 179.01 177.27 3hjz h ASN 61 N 0.86 0.09 0.48 1.42 -1.24 -1.09 -3.32 115.58 112.77 3hjz h ASN 61 Ca 0.33 -0.04 -0.29 0.00 0.71 0.00 0.00 56.30 57.01 3hjz h ASN 61 Cb 0.13 -0.02 0.01 0.00 0.73 0.00 0.00 38.32 39.17 3hjz h ASN 61 CO -0.16 0.50 -1.26 0.74 -1.29 0.00 0.00 177.43 175.96 3hjz h THR 62 N 0.07 1.42 -4.13 -3.57 2.02 -0.56 -3.47 112.91 104.70 3hjz h THR 62 Ca 0.00 -2.87 -0.47 0.00 0.77 0.00 0.00 66.41 63.85 3hjz h THR 62 Cb 0.77 2.89 0.02 0.00 -1.74 0.00 0.00 68.15 70.09 3hjz h THR 62 CO 0.06 0.85 0.37 -0.76 0.37 0.00 0.00 175.52 176.40 3hjz s LEU 63 N -7.37 3.73 0.44 2.58 1.43 -0.94 -5.01 118.68 113.54 3hjz s LEU 63 Ca -0.06 1.77 -0.24 0.00 -1.03 0.00 0.00 54.13 54.57 3hjz s LEU 63 Cb 0.06 -4.54 -0.10 0.00 0.03 0.00 0.00 46.19 41.65 3hjz s LEU 63 CO 0.90 -0.73 1.00 -2.65 0.23 0.00 0.00 176.35 175.10 3hjz n PRO 64 N -1.28 1.31 -1.64 1.29 -0.02 -1.26 -4.92 135.00 128.48 3hjz n PRO 64 Ca 0.08 0.47 -0.42 0.00 -2.02 0.00 0.00 63.50 61.61 3hjz n PRO 64 Cb 0.53 -2.05 0.01 0.00 -0.02 0.00 0.00 33.50 31.97 3hjz n PRO 64 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 3hjz n ASN 65 N 0.41 1.73 0.00 2.55 3.02 -1.26 -2.23 115.26 119.47 3hjz n ASN 65 Ca 0.10 1.09 0.00 0.00 -0.03 0.00 0.00 54.58 55.74 3hjz n ASN 65 Cb 0.40 -1.39 0.00 0.00 -0.61 0.00 0.00 39.78 38.18 3hjz n ASN 65 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3hjz n GLY 66 N 1.06 0.66 3.70 7.41 0.00 -1.26 -5.05 105.19 111.72 3hjz n GLY 66 Ca 0.08 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.73 3hjz n GLY 66 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 3hjz n PHE 67 N -2.66 1.71 -2.44 1.61 -1.74 -0.95 -5.03 117.46 107.97 3hjz n PHE 67 Ca 0.00 0.42 -0.25 0.00 -0.56 0.00 0.00 57.45 57.06 3hjz n PHE 67 Cb 0.00 -2.25 0.04 0.00 1.52 0.00 0.00 39.48 38.79 3hjz n PHE 67 CO 0.00 0.00 0.00 -1.54 -0.56 0.00 0.00 176.76 174.66 3hjz s SER 68 N -1.33 5.40 0.25 5.98 1.04 -1.26 -4.96 113.70 118.82 3hjz s SER 68 Ca 0.81 0.53 -0.05 0.00 0.48 0.00 0.00 55.95 57.71 3hjz s SER 68 Cb -0.39 -1.46 0.27 0.00 0.10 0.00 0.00 66.02 64.55 3hjz s SER 68 CO 0.42 -1.16 1.89 -0.08 0.98 0.00 0.00 173.24 175.29 3hjz h GLU 69 N -0.19 1.22 -0.19 4.02 4.81 -1.99 -0.86 114.58 121.40 3hjz h GLU 69 Ca -0.45 -0.12 0.03 0.00 -0.13 0.00 0.00 59.36 58.69 3hjz h GLU 69 Cb 1.27 -0.25 -0.03 0.00 0.63 0.00 0.00 28.75 30.38 3hjz h GLU 69 CO 0.59 0.87 0.02 0.82 -0.73 0.00 0.00 179.01 180.58 3hjz h ILE 70 N 1.23 0.89 -0.99 2.32 1.08 -1.99 -0.44 117.51 119.61 3hjz h ILE 70 Ca 0.32 -0.03 0.01 0.00 -0.39 0.00 0.00 64.86 64.76 3hjz h ILE 70 Cb -0.02 0.80 -0.05 0.00 -3.07 0.00 0.00 36.82 34.48 3hjz h ILE 70 CO -0.06 0.02 0.64 -0.33 -0.69 0.00 0.00 178.15 177.73 3hjz h GLU 71 N 0.08 1.31 -0.07 2.37 5.08 -1.84 -1.31 114.58 120.21 3hjz h GLU 71 Ca 0.09 -0.09 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3hjz h GLU 71 Cb 0.09 -0.29 -0.01 0.00 0.50 0.00 0.00 28.75 29.05 3hjz h GLU 71 CO -0.13 0.88 0.03 1.25 -1.00 0.00 0.00 179.01 180.04 3hjz h LEU 72 N 1.34 0.05 -0.54 1.33 5.85 -0.75 -1.53 115.31 121.05 3hjz h LEU 72 Ca 0.36 0.00 -0.05 0.00 0.84 0.00 0.00 57.88 59.03 3hjz h LEU 72 Cb -0.13 -0.01 -0.02 0.00 0.37 0.00 0.00 40.66 40.87 3hjz h LEU 72 CO -0.08 0.04 0.14 0.40 -0.34 0.00 0.00 178.44 178.61 3hjz h ILE 73 N 0.07 1.24 -0.28 4.05 1.08 -0.72 0.53 117.51 123.48 3hjz h ILE 73 Ca 0.03 -0.85 0.03 0.00 -0.39 0.00 0.00 64.86 63.68 3hjz h ILE 73 Cb 0.00 0.76 -0.03 0.00 -3.07 0.00 0.00 36.82 34.48 3hjz h ILE 73 CO -0.02 0.31 0.11 0.11 -0.69 0.00 0.00 178.15 177.97 3hjz h LYS 74 N 0.76 0.23 -0.54 2.37 1.57 -1.19 -0.40 116.57 119.37 3hjz h LYS 74 Ca 0.17 -0.01 -0.08 0.00 -1.87 0.00 0.00 60.65 58.86 3hjz h LYS 74 Cb 0.32 -0.05 -0.02 0.00 0.08 0.00 0.00 32.23 32.56 3hjz h LYS 74 CO -0.00 0.15 0.02 1.49 -0.57 0.00 0.00 179.45 180.55 3hjz h GLU 75 N 0.24 0.90 -0.64 3.15 4.57 -0.99 -2.86 114.58 118.95 3hjz h GLU 75 Ca 0.12 -0.25 -0.08 0.00 -1.18 0.00 0.00 59.36 57.97 3hjz h GLU 75 Cb 0.08 -0.10 -0.03 0.00 -0.16 0.00 0.00 28.75 28.54 3hjz h GLU 75 CO -0.11 0.88 0.07 1.15 -1.18 0.00 0.00 179.01 179.82 3hjz h THR 76 N 0.84 1.26 -0.54 0.32 2.02 -0.45 -1.34 112.91 115.03 3hjz h THR 76 Ca 0.16 -1.06 0.08 0.00 0.77 0.00 0.00 66.41 66.36 3hjz h THR 76 Cb 0.47 0.69 -0.06 0.00 -1.74 0.00 0.00 68.15 67.51 3hjz h THR 76 CO 0.02 0.39 0.19 0.58 0.37 0.00 0.00 175.52 177.08 3hjz h VAL 77 N 0.99 0.81 0.49 3.16 2.07 -0.85 0.17 116.25 123.10 3hjz h VAL 77 Ca 0.19 -0.13 -0.02 0.00 0.82 0.00 0.00 66.70 67.56 3hjz h VAL 77 Cb 0.47 0.40 0.00 0.00 -1.52 0.00 0.00 31.29 30.64 3hjz h VAL 77 CO 0.02 0.07 -0.24 0.44 0.02 0.00 0.00 177.57 177.88 3hjz h ASP 78 N 0.37 -0.56 -0.61 0.57 3.32 -1.42 -2.88 116.42 115.22 3hjz h ASP 78 Ca 0.26 -0.01 -0.05 0.00 0.02 0.00 0.00 57.03 57.25 3hjz h ASP 78 Cb 0.29 0.14 -0.03 0.00 0.22 0.00 0.00 39.33 39.96 3hjz h ASP 78 CO -0.27 -0.36 0.18 1.56 -1.72 0.00 0.00 179.24 178.64 3hjz h GLN 79 N -0.72 0.96 -0.38 3.56 4.20 -0.81 -2.85 115.11 119.06 3hjz h GLN 79 Ca -0.07 -0.21 -0.10 0.00 0.06 0.00 0.00 58.65 58.33 3hjz h GLN 79 Cb 0.54 -0.13 -0.02 0.00 0.30 0.00 0.00 27.48 28.16 3hjz h GLN 79 CO 0.11 0.86 -0.16 -0.24 -0.67 0.00 0.00 178.83 178.73 3hjz h VAL 80 N 0.88 1.26 -0.16 -0.54 3.04 -0.74 0.86 116.25 120.84 3hjz h VAL 80 Ca 0.19 -1.21 0.04 0.00 -1.01 0.00 0.00 66.70 64.71 3hjz h VAL 80 Cb 0.31 1.14 -0.04 0.00 -2.01 0.00 0.00 31.29 30.69 3hjz h VAL 80 CO -0.00 0.41 -0.09 -1.28 -1.01 0.00 0.00 177.57 175.59 3hjz h SER 81 N 0.64 -0.30 -0.63 3.17 0.87 -1.36 -1.82 113.55 114.11 3hjz h SER 81 Ca 0.10 0.07 -0.08 0.00 -1.23 0.00 0.00 61.79 60.65 3hjz h SER 81 Cb 0.63 0.16 -0.02 0.00 -0.44 0.00 0.00 62.40 62.73 3hjz h SER 81 CO 0.04 -0.12 0.08 0.58 -0.53 0.00 0.00 176.83 176.88 3hjz h VAL 82 N -0.08 1.26 -0.42 2.23 2.07 -1.20 -1.35 116.25 118.76 3hjz h VAL 82 Ca 0.09 -1.06 0.05 0.00 0.82 0.00 0.00 66.70 66.61 3hjz h VAL 82 Cb 0.22 0.71 -0.05 0.00 -1.52 0.00 0.00 31.29 30.65 3hjz h VAL 82 CO -0.22 0.39 0.15 -0.26 0.02 0.00 0.00 177.57 177.65 3hjz h PHE 83 N 0.98 0.26 -0.16 1.57 -1.00 -0.70 0.29 116.94 118.19 3hjz h PHE 83 Ca 0.19 0.02 -0.13 0.00 2.81 0.00 0.00 57.97 60.86 3hjz h PHE 83 Cb 0.47 -0.06 -0.01 0.00 3.61 0.00 0.00 35.95 39.96 3hjz h PHE 83 CO 0.03 0.10 -0.45 0.74 -1.61 0.00 0.00 178.31 177.12 3hjz h PHE 84 N 0.31 0.46 -0.42 -0.55 0.04 -1.17 -1.43 116.94 114.18 3hjz h PHE 84 Ca 0.19 -0.14 -0.02 0.00 2.80 0.00 0.00 57.97 60.80 3hjz h PHE 84 Cb 0.18 -0.10 -0.02 0.00 2.20 0.00 0.00 35.95 38.21 3hjz h PHE 84 CO -0.15 0.77 0.18 0.78 -0.60 0.00 0.00 178.31 179.29 3hjz h GLY 85 N 1.19 0.67 1.02 -1.45 0.00 -0.84 -0.26 103.07 103.39 3hjz h GLY 85 Ca 0.02 -0.35 0.00 0.00 0.00 0.00 0.00 47.33 47.00 3hjz h GLY 85 CO 0.08 0.33 0.60 1.70 0.00 0.00 0.00 176.54 179.26 3hjz h LYS 86 N 0.54 1.30 -0.44 4.80 3.64 -0.74 -0.74 116.57 124.93 3hjz h LYS 86 Ca 0.14 -0.10 -0.00 0.00 -1.27 0.00 0.00 60.65 59.41 3hjz h LYS 86 Cb 0.17 -0.28 -0.02 0.00 -0.41 0.00 0.00 32.23 31.69 3hjz h LYS 86 CO -0.01 0.89 0.26 1.49 -2.27 0.00 0.00 179.45 179.81 3hjz h GLU 87 N 1.33 0.59 -0.41 1.90 4.57 -0.97 -2.51 114.58 119.09 3hjz h GLU 87 Ca 0.35 -0.06 0.07 0.00 -1.18 0.00 0.00 59.36 58.54 3hjz h GLU 87 Cb -0.09 -0.12 -0.06 0.00 -0.16 0.00 0.00 28.75 28.32 3hjz h GLU 87 CO -0.07 0.45 0.06 0.82 -1.18 0.00 0.00 179.01 179.08 3hjz h ILE 88 N 0.58 0.76 0.00 2.32 2.04 -0.75 -2.85 117.51 119.60 3hjz h ILE 88 Ca 0.16 -0.06 -0.00 0.00 1.00 0.00 0.00 64.86 65.95 3hjz h ILE 88 Cb 0.01 0.56 -0.00 0.00 -0.74 0.00 0.00 36.82 36.65 3hjz h ILE 88 CO -0.03 0.03 -0.01 -0.07 0.00 0.00 0.00 178.15 178.08 3hjz h LEU 89 N 0.18 0.00 -1.29 1.44 3.38 -0.77 0.17 115.31 118.41 3hjz h LEU 89 Ca 0.20 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.16 3hjz h LEU 89 Cb 0.26 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.01 3hjz h LEU 89 CO -0.28 0.01 -0.04 0.11 0.09 0.00 0.00 178.44 178.33 3hjz h LYS 90 N 0.00 0.00 0.00 1.13 1.57 -1.21 -3.36 116.57 114.70 3hjz h LYS 90 Ca -0.00 0.00 -0.40 0.00 -1.87 0.00 0.00 60.65 58.38 3hjz h LYS 90 Cb 0.07 0.00 -0.06 0.00 0.08 0.00 0.00 32.23 32.32 3hjz h LYS 90 CO 0.00 0.04 -2.33 -0.89 -0.57 0.00 0.00 179.45 175.70 3hjz n ILE 91 N -3.14 1.47 -2.65 1.86 5.41 0.47 -5.03 119.36 117.74 3hjz n ILE 91 Ca 0.01 -0.32 -0.27 0.00 1.00 0.00 0.00 62.75 63.17 3hjz n ILE 91 Cb 0.34 -1.91 0.00 0.00 -0.71 0.00 0.00 39.64 37.37 3hjz n ILE 91 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 176.55 176.82 3hjz s ILE 92 N -2.53 4.67 -0.47 1.39 -4.36 -0.37 -5.00 121.20 114.53 3hjz s ILE 92 Ca -0.36 0.10 0.22 0.00 -0.26 0.00 0.00 60.65 60.35 3hjz s ILE 92 Cb 0.13 -3.78 -0.23 0.00 1.25 0.00 0.00 42.46 39.83 3hjz s ILE 92 CO 0.46 -0.75 0.77 -1.54 0.24 0.00 0.00 174.94 174.13 3hjz n SER 93 N -2.28 0.49 0.00 4.36 3.41 -1.25 -4.78 113.62 113.56 3hjz n SER 93 Ca 0.01 -0.32 0.00 0.00 -0.26 0.00 0.00 58.87 58.30 3hjz n SER 93 Cb 0.56 1.32 0.00 0.00 -0.26 0.00 0.00 64.21 65.83 3hjz n SER 93 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3hjz n GLY 94 N 1.35 1.75 3.68 5.00 0.00 0.04 -5.07 105.19 111.95 3hjz n GLY 94 Ca 0.00 -0.57 -0.34 0.00 0.00 0.00 0.00 46.02 45.11 3hjz n GLY 94 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3hjz s ARG 95 N 4.33 2.91 -0.26 1.61 0.52 -1.24 -4.93 118.95 121.90 3hjz s ARG 95 Ca 0.00 -0.48 -0.09 0.00 -0.52 0.00 0.00 55.73 54.63 3hjz s ARG 95 Cb 0.00 -2.74 -0.04 0.00 0.52 0.00 0.00 34.95 32.69 3hjz s ARG 95 CO 0.00 0.67 0.13 0.54 0.02 0.00 0.00 175.30 176.67 3hjz s VAL 96 N -0.96 4.87 0.15 3.52 0.11 -0.43 -2.49 120.40 125.18 3hjz s VAL 96 Ca 0.16 0.02 -0.30 0.00 -2.93 0.00 0.00 61.98 58.92 3hjz s VAL 96 Cb -0.11 -3.30 -0.07 0.00 -1.53 0.00 0.00 36.38 31.37 3hjz s VAL 96 CO 0.05 0.30 0.98 -0.44 -3.33 0.00 0.00 175.10 172.67 3hjz s SER 97 N 1.57 7.48 -0.22 3.54 0.01 0.30 -1.26 113.70 125.12 3hjz s SER 97 Ca 0.07 1.88 0.01 0.00 1.31 0.00 0.00 55.95 59.22 3hjz s SER 97 Cb -0.15 -2.60 0.05 0.00 0.21 0.00 0.00 66.02 63.54 3hjz s SER 97 CO 0.07 -0.05 -0.07 -0.89 0.41 0.00 0.00 173.24 172.70 3hjz s THR 98 N -0.27 1.61 0.07 1.44 2.01 0.47 -0.76 115.64 120.20 3hjz s THR 98 Ca 0.46 -1.17 -0.31 0.00 0.31 0.00 0.00 61.69 60.98 3hjz s THR 98 Cb -0.25 -1.80 -0.07 0.00 0.01 0.00 0.00 72.50 70.39 3hjz s THR 98 CO 0.31 -0.00 1.44 -0.70 -0.69 0.00 0.00 174.62 174.98 3hjz s GLU 99 N 1.38 4.29 -0.02 4.92 2.12 -0.89 -1.19 118.70 129.30 3hjz s GLU 99 Ca -0.04 2.08 -0.24 0.00 0.36 0.00 0.00 54.97 57.12 3hjz s GLU 99 Cb -0.18 -3.42 -0.04 0.00 0.26 0.00 0.00 34.13 30.75 3hjz s GLU 99 CO -0.07 -0.54 0.74 0.08 -0.54 0.00 0.00 175.26 174.93 3hjz s VAL 100 N 1.81 4.92 -0.41 3.70 1.01 -0.42 -4.91 120.40 126.10 3hjz s VAL 100 Ca 0.66 1.54 -0.38 0.00 0.00 0.00 0.00 61.98 63.80 3hjz s VAL 100 Cb -0.35 -4.08 -0.16 0.00 0.00 0.00 0.00 36.38 31.79 3hjz s VAL 100 CO 0.29 0.29 1.52 -0.67 0.00 0.00 0.00 175.10 176.53 3hjz n ASP 101 N 3.41 0.83 0.17 3.32 -0.08 -1.26 -4.80 116.55 118.15 3hjz n ASP 101 Ca -0.01 0.80 0.14 0.00 -1.51 0.00 0.00 54.79 54.20 3hjz n ASP 101 Cb 0.51 -0.73 0.54 0.00 2.34 0.00 0.00 41.12 43.77 3hjz n ASP 101 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 3hjz h ALA 102 N 5.58 1.00 0.00 -1.67 0.00 -1.91 -1.88 119.26 120.38 3hjz h ALA 102 Ca -0.24 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.67 3hjz h ALA 102 Cb 1.15 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.94 3hjz h ALA 102 CO 0.85 0.00 0.00 0.00 0.00 0.00 0.00 179.25 180.10 3hjz h ARG 103 N 0.00 0.00 -0.62 0.00 3.08 -1.89 -2.10 114.38 112.85 3hjz h ARG 103 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 3hjz h ARG 103 Cb 0.44 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.49 3hjz h ARG 103 CO 0.00 0.00 0.00 1.28 -1.07 0.00 0.00 179.97 180.18 3hjz n LEU 104 N -2.38 3.49 0.33 3.04 4.77 -0.71 -4.64 117.00 120.90 3hjz n LEU 104 Ca 0.01 -1.75 0.21 0.00 -0.03 0.00 0.00 56.01 54.45 3hjz n LEU 104 Cb 0.19 -0.44 1.13 0.00 -2.33 0.00 0.00 43.42 41.97 3hjz n LEU 104 CO 0.19 0.77 1.16 0.28 -1.33 0.00 0.00 177.39 178.46 3hjz h SER 105 N 3.50 0.00 -0.30 -1.43 0.02 -1.54 -1.49 113.55 112.30 3hjz h SER 105 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 3hjz h SER 105 Cb 0.95 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.49 3hjz h SER 105 CO 0.06 0.00 0.00 0.49 -1.14 0.00 0.00 176.83 176.25 3hjz n PHE 106 N -3.26 0.85 -3.78 3.45 3.72 -1.26 -3.78 117.46 113.40 3hjz n PHE 106 Ca -0.03 -0.76 -0.30 0.00 -0.05 0.00 0.00 57.45 56.32 3hjz n PHE 106 Cb 0.08 -0.23 -0.15 0.00 -0.94 0.00 0.00 39.48 38.24 3hjz n PHE 106 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 176.76 177.05 3hjz s ASP 107 N -1.60 4.11 0.12 4.37 -1.08 -0.56 -4.91 116.67 117.11 3hjz s ASP 107 Ca 0.37 -1.83 -0.21 0.00 -0.52 0.00 0.00 52.55 50.36 3hjz s ASP 107 Cb 0.28 -1.01 -0.06 0.00 -1.46 0.00 0.00 42.92 40.67 3hjz s ASP 107 CO 0.11 -0.39 1.71 0.74 0.52 0.00 0.00 175.17 177.86 3hjz h THR 108 N 6.37 0.84 -0.57 1.71 2.02 -1.81 -1.40 112.91 120.06 3hjz h THR 108 Ca -0.11 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.07 3hjz h THR 108 Cb 1.01 0.84 -0.03 0.00 -1.74 0.00 0.00 68.15 68.23 3hjz h THR 108 CO 0.48 0.00 0.33 -0.08 0.37 0.00 0.00 175.52 176.62 3hjz h GLU 109 N -0.01 0.79 -0.42 6.66 4.81 -1.94 -0.75 114.58 123.72 3hjz h GLU 109 Ca 0.07 -0.08 -0.10 0.00 -0.13 0.00 0.00 59.36 59.12 3hjz h GLU 109 Cb 0.12 -0.16 -0.02 0.00 0.63 0.00 0.00 28.75 29.32 3hjz h GLU 109 CO -0.16 0.59 -0.14 0.00 -0.73 0.00 0.00 179.01 178.57 3hjz h ALA 110 N 1.15 0.96 -0.13 2.92 0.00 -1.88 -0.46 119.26 121.82 3hjz h ALA 110 Ca 0.20 -0.33 -0.01 0.00 0.00 0.00 0.00 54.91 54.77 3hjz h ALA 110 Cb 0.02 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 3hjz h ALA 110 CO -0.04 0.61 0.03 1.15 0.00 0.00 0.00 179.25 181.00 3hjz h THR 111 N 0.69 1.21 -0.32 0.00 2.02 -0.90 0.23 112.91 115.83 3hjz h THR 111 Ca 0.11 -0.65 0.02 0.00 0.77 0.00 0.00 66.41 66.65 3hjz h THR 111 Cb 0.63 1.39 -0.02 0.00 -1.74 0.00 0.00 68.15 68.41 3hjz h THR 111 CO 0.04 0.19 0.18 0.58 0.37 0.00 0.00 175.52 176.88 3hjz h VAL 112 N 0.01 1.01 -0.13 3.16 2.07 -1.06 -0.77 116.25 120.54 3hjz h VAL 112 Ca 0.04 -0.13 0.05 0.00 0.82 0.00 0.00 66.70 67.48 3hjz h VAL 112 Cb 0.27 0.62 -0.06 0.00 -1.52 0.00 0.00 31.29 30.60 3hjz h VAL 112 CO 0.00 0.07 -0.31 0.50 0.02 0.00 0.00 177.57 177.85 3hjz h LYS 113 N 0.37 -0.37 -0.41 1.57 3.64 -0.94 -0.76 116.57 119.66 3hjz h LYS 113 Ca 0.13 0.03 -0.01 0.00 -1.27 0.00 0.00 60.65 59.53 3hjz h LYS 113 Cb 0.02 0.08 -0.02 0.00 -0.41 0.00 0.00 32.23 31.91 3hjz h LYS 113 CO -0.07 -0.24 0.24 -0.22 -2.27 0.00 0.00 179.45 176.88 3hjz h LYS 114 N -0.38 0.57 -0.21 1.90 1.63 -0.71 -1.46 116.57 117.91 3hjz h LYS 114 Ca 0.10 -0.06 0.04 0.00 -0.85 0.00 0.00 60.65 59.87 3hjz h LYS 114 Cb 0.53 -0.11 -0.03 0.00 -0.60 0.00 0.00 32.23 32.01 3hjz h LYS 114 CO -0.35 0.44 -0.01 0.00 -3.45 0.00 0.00 179.45 176.09 3hjz h ALA 115 N 1.09 0.18 -0.63 5.00 0.00 -0.89 0.25 119.26 124.26 3hjz h ALA 115 Ca 0.15 0.06 0.07 0.00 0.00 0.00 0.00 54.91 55.19 3hjz h ALA 115 Cb 0.03 0.11 -0.06 0.00 0.00 0.00 0.00 17.79 17.87 3hjz h ALA 115 CO -0.03 -0.44 0.31 0.00 0.00 0.00 0.00 179.25 179.10 3hjz h ARG 116 N 0.06 0.54 -0.51 0.00 3.08 -0.92 0.35 114.38 116.97 3hjz h ARG 116 Ca 0.10 -0.03 -0.01 0.00 0.07 0.00 0.00 59.98 60.11 3hjz h ARG 116 Cb 0.13 -0.12 -0.02 0.00 0.08 0.00 0.00 29.97 30.03 3hjz h ARG 116 CO -0.18 0.36 0.29 -0.22 -1.07 0.00 0.00 179.97 179.15 3hjz h LYS 117 N 0.56 0.70 -0.37 0.04 3.64 -0.53 -0.08 116.57 120.53 3hjz h LYS 117 Ca 0.30 -0.08 -0.11 0.00 -1.27 0.00 0.00 60.65 59.49 3hjz h LYS 117 Cb 0.27 -0.14 -0.01 0.00 -0.41 0.00 0.00 32.23 31.94 3hjz h LYS 117 CO -0.23 0.54 -0.20 -0.07 -2.27 0.00 0.00 179.45 177.21 3hjz h LEU 118 N 0.68 0.82 -0.71 5.20 3.38 -0.57 -1.12 115.31 122.98 3hjz h LEU 118 Ca 0.18 -0.42 0.01 0.00 0.09 0.00 0.00 57.88 57.74 3hjz h LEU 118 Cb 0.03 -0.23 -0.04 0.00 0.09 0.00 0.00 40.66 40.52 3hjz h LEU 118 CO -0.03 1.05 0.47 0.40 0.09 0.00 0.00 178.44 180.43 3hjz h ILE 119 N 0.58 1.18 -0.13 1.22 1.08 -0.74 -1.10 117.51 119.60 3hjz h ILE 119 Ca 0.08 -0.33 -0.10 0.00 -0.39 0.00 0.00 64.86 64.12 3hjz h ILE 119 Cb 0.76 0.13 -0.01 0.00 -3.07 0.00 0.00 36.82 34.63 3hjz h ILE 119 CO 0.06 0.18 -0.37 0.78 -0.69 0.00 0.00 178.15 178.10 3hjz h ASN 120 N 0.96 0.28 -0.30 1.72 -0.26 -0.75 -1.35 115.58 115.88 3hjz h ASN 120 Ca 0.26 -0.11 -0.02 0.00 -0.56 0.00 0.00 56.30 55.88 3hjz h ASN 120 Cb -0.11 -0.08 -0.01 0.00 -1.06 0.00 0.00 38.32 37.06 3hjz h ASN 120 CO -0.06 0.63 0.13 -0.07 -1.06 0.00 0.00 177.43 177.00 3hjz h LEU 121 N 0.23 0.41 -0.52 1.61 3.38 -0.83 -0.47 115.31 119.12 3hjz h LEU 121 Ca 0.03 -0.15 0.06 0.00 0.09 0.00 0.00 57.88 57.91 3hjz h LEU 121 Cb 0.76 -0.11 -0.05 0.00 0.09 0.00 0.00 40.66 41.35 3hjz h LEU 121 CO 0.06 0.45 0.21 1.88 0.09 0.00 0.00 178.44 181.13 3hjz h TYR 122 N 0.34 0.38 -0.41 1.13 0.05 -0.91 -2.38 116.97 115.17 3hjz h TYR 122 Ca 0.10 0.02 0.04 0.00 0.05 0.00 0.00 58.73 58.95 3hjz h TYR 122 Cb 0.16 -0.09 -0.04 0.00 1.01 0.00 0.00 36.73 37.76 3hjz h TYR 122 CO -0.01 0.15 0.16 -0.22 -1.05 0.00 0.00 178.16 177.19 3hjz h LYS 123 N 0.41 0.33 -0.44 4.88 3.64 -0.99 0.13 116.57 124.53 3hjz h LYS 123 Ca 0.24 -0.02 0.13 0.00 -1.27 0.00 0.00 60.65 59.73 3hjz h LYS 123 Cb 0.23 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 31.96 3hjz h LYS 123 CO -0.22 0.22 0.40 -0.91 -2.27 0.00 0.00 179.45 176.66 3hjz h ASN 124 N 0.34 0.00 -0.52 4.20 2.35 -0.61 -0.91 115.58 120.43 3hjz h ASN 124 Ca 0.18 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.93 3hjz h ASN 124 Cb 0.15 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.52 3hjz h ASN 124 CO -0.17 0.00 0.00 0.49 -1.65 0.00 0.00 177.43 176.10 3hjz n PHE 125 N -3.99 1.21 -0.60 1.19 3.72 -0.63 -4.94 117.46 113.43 3hjz n PHE 125 Ca 0.08 -0.64 0.00 0.00 -0.05 0.00 0.00 57.45 56.84 3hjz n PHE 125 Cb 0.59 -0.22 0.00 0.00 -0.94 0.00 0.00 39.48 38.91 3hjz n PHE 125 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3hjz n GLY 126 N 0.72 0.66 3.30 1.37 0.00 -0.35 -5.05 105.19 105.84 3hjz n GLY 126 Ca 0.22 -0.40 -0.34 0.00 0.00 0.00 0.00 46.02 45.50 3hjz n GLY 126 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3hjz s ILE 127 N -2.00 3.17 0.53 -0.61 -1.09 0.34 -4.98 121.20 116.56 3hjz s ILE 127 Ca 0.00 -0.57 -0.16 0.00 -2.23 0.00 0.00 60.65 57.69 3hjz s ILE 127 Cb 0.00 -2.41 -0.07 0.00 -1.58 0.00 0.00 42.46 38.39 3hjz s ILE 127 CO 0.00 0.45 0.99 -1.61 -1.23 0.00 0.00 174.94 173.55 3hjz s GLU 128 N 1.26 3.89 0.60 2.79 0.41 -1.26 -2.68 118.70 123.71 3hjz s GLU 128 Ca 0.03 0.93 0.35 0.00 -0.41 0.00 0.00 54.97 55.86 3hjz s GLU 128 Cb -0.14 -2.13 1.91 0.00 -1.78 0.00 0.00 34.13 31.99 3hjz s GLU 128 CO -0.03 -0.32 2.23 1.57 -0.49 0.00 0.00 175.26 178.22 3hjz h LYS 129 N 0.73 0.00 -1.04 1.61 2.10 -1.94 -2.72 116.57 115.31 3hjz h LYS 129 Ca -0.46 0.00 0.28 0.00 -2.00 0.00 0.00 60.65 58.47 3hjz h LYS 129 Cb 1.19 0.00 -0.06 0.00 -0.90 0.00 0.00 32.23 32.45 3hjz h LYS 129 CO 0.61 0.03 0.72 0.93 -2.00 0.00 0.00 179.45 179.74 3hjz h GLU 130 N 0.00 0.17 -0.01 0.07 5.08 -1.93 -1.31 114.58 116.64 3hjz h GLU 130 Ca -0.00 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 3hjz h GLU 130 Cb 0.12 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.33 3hjz h GLU 130 CO 0.00 0.11 -0.03 0.54 -1.00 0.00 0.00 179.01 178.63 3hjz n ARG 131 N -4.39 1.60 -5.09 2.33 1.74 -1.03 -4.89 116.66 106.94 3hjz n ARG 131 Ca 0.23 -0.96 -0.32 0.00 -0.77 0.00 0.00 57.85 56.04 3hjz n ARG 131 Cb 1.00 -1.48 -0.15 0.00 -1.02 0.00 0.00 32.46 30.82 3hjz n ARG 131 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 3hjz s ILE 132 N -2.06 2.55 -0.19 0.55 -1.09 -0.50 -1.32 121.20 119.15 3hjz s ILE 132 Ca 0.36 -0.94 -0.02 0.00 -2.23 0.00 0.00 60.65 57.82 3hjz s ILE 132 Cb 0.21 -1.95 -0.01 0.00 -1.58 0.00 0.00 42.46 39.13 3hjz s ILE 132 CO 0.36 0.57 -0.08 -0.76 -1.23 0.00 0.00 174.94 173.80 3hjz s LEU 133 N -0.70 2.79 -0.22 2.97 1.43 -0.39 -4.47 118.68 120.09 3hjz s LEU 133 Ca 0.11 -0.38 -0.29 0.00 -1.03 0.00 0.00 54.13 52.54 3hjz s LEU 133 Cb -0.10 -1.68 0.01 0.00 0.03 0.00 0.00 46.19 44.44 3hjz s LEU 133 CO -0.00 0.05 1.02 -0.63 0.23 0.00 0.00 176.35 177.02 3hjz s ILE 134 N 1.07 4.70 -0.27 -0.59 -1.09 0.97 -0.40 121.20 125.59 3hjz s ILE 134 Ca 0.00 2.00 -0.09 0.00 -2.23 0.00 0.00 60.65 60.33 3hjz s ILE 134 Cb -0.15 -4.30 -0.03 0.00 -1.58 0.00 0.00 42.46 36.41 3hjz s ILE 134 CO -0.01 -0.15 0.13 -0.75 -1.23 0.00 0.00 174.94 172.93 3hjz s LYS 135 N 3.04 3.70 -0.02 2.79 2.20 -0.34 -0.28 119.74 130.84 3hjz s LYS 135 Ca 0.44 -0.47 0.02 0.00 -0.36 0.00 0.00 55.97 55.60 3hjz s LYS 135 Cb -0.15 -3.50 0.00 0.00 -1.51 0.00 0.00 37.83 32.67 3hjz s LYS 135 CO 0.07 -0.23 -0.07 0.42 -0.36 0.00 0.00 175.35 175.18 3hjz s ILE 136 N 1.67 0.63 0.32 5.43 1.01 -0.44 -1.30 121.20 128.53 3hjz s ILE 136 Ca 0.06 -0.30 -0.29 0.00 0.00 0.00 0.00 60.65 60.13 3hjz s ILE 136 Cb -0.16 -0.56 -0.10 0.00 0.01 0.00 0.00 42.46 41.65 3hjz s ILE 136 CO 0.07 0.20 1.35 0.00 0.00 0.00 0.00 174.94 176.55 3hjz s ALA 137 N 0.09 3.53 -0.28 9.38 0.00 -1.26 -0.79 121.76 132.42 3hjz s ALA 137 Ca -0.01 1.30 -0.06 0.00 0.00 0.00 0.00 51.96 53.19 3hjz s ALA 137 Cb -0.06 -3.51 -0.16 0.00 0.00 0.00 0.00 23.12 19.40 3hjz s ALA 137 CO -0.00 -0.70 3.32 0.00 0.00 0.00 0.00 175.76 178.38 3hjz n ALA 138 N 1.05 6.50 -1.32 0.00 0.00 0.20 -4.28 120.51 122.67 3hjz n ALA 138 Ca 0.01 -2.35 -0.30 0.00 0.00 0.00 0.00 53.44 50.81 3hjz n ALA 138 Cb 0.41 -2.37 0.13 0.00 0.00 0.00 0.00 19.45 17.63 3hjz n ALA 138 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 3hjz s THR 139 N 0.16 2.62 0.17 0.00 -4.23 -1.26 -4.87 115.64 108.23 3hjz s THR 139 Ca 0.65 0.20 -0.17 0.00 -1.18 0.00 0.00 61.69 61.19 3hjz s THR 139 Cb 0.32 -2.78 0.09 0.00 1.34 0.00 0.00 72.50 71.48 3hjz s THR 139 CO -0.07 -0.26 1.67 -0.25 -0.54 0.00 0.00 174.62 175.17 3hjz h TRP 140 N -1.48 -0.19 -0.48 3.99 2.91 -1.90 -1.57 115.95 117.24 3hjz h TRP 140 Ca -0.50 0.04 -0.07 0.00 1.13 0.00 0.00 58.89 59.49 3hjz h TRP 140 Cb 1.29 0.15 -0.02 0.00 -0.51 0.00 0.00 29.16 30.07 3hjz h TRP 140 CO 0.40 -0.16 0.01 0.93 -1.03 0.00 0.00 178.44 178.59 3hjz h GLU 141 N 0.01 0.79 -0.49 2.65 3.07 -1.91 -0.80 114.58 117.89 3hjz h GLU 141 Ca 0.19 -0.21 -0.10 0.00 -0.50 0.00 0.00 59.36 58.75 3hjz h GLU 141 Cb 0.29 -0.09 -0.02 0.00 -0.84 0.00 0.00 28.75 28.09 3hjz h GLU 141 CO -0.40 0.79 -0.09 0.78 -1.40 0.00 0.00 179.01 178.68 3hjz h GLY 142 N 0.97 0.96 0.79 -3.84 0.00 -1.55 -0.65 103.07 99.75 3hjz h GLY 142 Ca 0.15 -0.74 -0.06 0.00 0.00 0.00 0.00 47.33 46.68 3hjz h GLY 142 CO 0.02 0.68 -0.10 -2.22 0.00 0.00 0.00 176.54 174.91 3hjz h ILE 143 N 0.80 1.31 -0.89 2.60 2.04 -1.11 -0.59 117.51 121.68 3hjz h ILE 143 Ca 0.13 -1.17 0.13 0.00 1.00 0.00 0.00 64.86 64.95 3hjz h ILE 143 Cb 0.61 1.69 -0.09 0.00 -0.74 0.00 0.00 36.82 38.29 3hjz h ILE 143 CO 0.04 0.35 0.51 0.11 0.00 0.00 0.00 178.15 179.16 3hjz h LYS 144 N 0.08 0.76 -0.31 2.37 1.79 -1.03 0.15 116.57 120.38 3hjz h LYS 144 Ca 0.04 -0.05 -0.03 0.00 -2.18 0.00 0.00 60.65 58.43 3hjz h LYS 144 Cb 0.59 -0.17 -0.01 0.00 -1.58 0.00 0.00 32.23 31.06 3hjz h LYS 144 CO 0.03 0.50 0.06 0.00 -1.08 0.00 0.00 179.45 178.96 3hjz h ALA 145 N 1.52 0.41 -0.93 3.86 0.00 -0.95 -2.54 119.26 120.63 3hjz h ALA 145 Ca 0.46 -0.19 -0.01 0.00 0.00 0.00 0.00 54.91 55.17 3hjz h ALA 145 Cb 0.53 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 18.16 3hjz h ALA 145 CO -0.30 0.09 0.55 0.00 0.00 0.00 0.00 179.25 179.59 3hjz h ALA 146 N 0.90 1.19 -0.77 0.00 0.00 -0.61 -1.35 119.26 118.61 3hjz h ALA 146 Ca 0.10 -0.11 0.07 0.00 0.00 0.00 0.00 54.91 54.96 3hjz h ALA 146 Cb 0.32 -0.37 -0.06 0.00 0.00 0.00 0.00 17.79 17.67 3hjz h ALA 146 CO 0.00 0.66 0.45 1.49 0.00 0.00 0.00 179.25 181.85 3hjz h GLU 147 N 1.29 0.79 -0.05 0.00 4.81 -0.46 0.36 114.58 121.32 3hjz h GLU 147 Ca 0.33 -0.05 -0.01 0.00 -0.13 0.00 0.00 59.36 59.51 3hjz h GLU 147 Cb -0.03 -0.18 -0.00 0.00 0.63 0.00 0.00 28.75 29.17 3hjz h GLU 147 CO -0.06 0.52 0.01 0.82 -0.73 0.00 0.00 179.01 179.57 3hjz h ILE 148 N 0.81 1.21 -0.66 2.32 2.04 -1.00 -3.14 117.51 119.08 3hjz h ILE 148 Ca 0.35 -0.64 0.02 0.00 1.00 0.00 0.00 64.86 65.59 3hjz h ILE 148 Cb 0.22 1.55 -0.04 0.00 -0.74 0.00 0.00 36.82 37.81 3hjz h ILE 148 CO -0.19 0.17 0.43 -0.07 0.00 0.00 0.00 178.15 178.49 3hjz h LEU 149 N -0.16 0.72 -1.32 1.44 3.38 -0.87 -2.75 115.31 115.75 3hjz h LEU 149 Ca 0.02 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 3hjz h LEU 149 Cb 0.27 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 40.83 3hjz h LEU 149 CO 0.00 0.51 0.28 -0.33 0.09 0.00 0.00 178.44 178.99 3hjz h GLU 150 N 0.85 0.75 0.00 1.13 4.39 -0.76 -0.82 114.58 120.13 3hjz h GLU 150 Ca 0.26 -0.08 -0.02 0.00 0.34 0.00 0.00 59.36 59.86 3hjz h GLU 150 Cb -0.04 -0.15 -0.00 0.00 -0.10 0.00 0.00 28.75 28.46 3hjz h GLU 150 CO -0.08 0.57 -0.08 0.87 -1.16 0.00 0.00 179.01 179.12 3hjz h LYS 151 N 0.76 0.00 -0.56 2.33 1.57 -1.44 -0.83 116.57 118.39 3hjz h LYS 151 Ca 0.19 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.97 3hjz h LYS 151 Cb 0.04 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.35 3hjz h LYS 151 CO -0.03 0.08 0.00 -0.85 -0.57 0.00 0.00 179.45 178.08 3hjz n GLU 152 N -3.62 4.33 -0.98 3.15 0.28 -0.44 -4.94 120.64 118.43 3hjz n GLU 152 Ca -0.02 -3.04 0.00 0.00 -0.16 0.00 0.00 57.16 53.94 3hjz n GLU 152 Cb 0.20 -2.10 0.00 0.00 1.43 0.00 0.00 31.44 30.96 3hjz n GLU 152 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 3hjz n GLY 153 N 0.64 0.51 3.54 -1.84 0.00 -0.32 -5.00 105.19 102.71 3hjz n GLY 153 Ca 0.26 -0.04 -0.43 0.00 0.00 0.00 0.00 46.02 45.81 3hjz n GLY 153 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3hjz s ILE 154 N -2.00 4.66 0.08 -0.61 1.01 -0.44 -4.83 121.20 119.07 3hjz s ILE 154 Ca 0.00 0.36 -0.30 0.00 0.00 0.00 0.00 60.65 60.71 3hjz s ILE 154 Cb 0.00 -4.32 -0.05 0.00 0.01 0.00 0.00 42.46 38.10 3hjz s ILE 154 CO 0.00 -0.72 1.06 -0.54 0.00 0.00 0.00 174.94 174.73 3hjz s LYS 155 N 3.25 4.57 0.06 2.79 -0.14 -1.26 -2.79 119.74 126.22 3hjz s LYS 155 Ca 0.29 1.59 0.10 0.00 -1.36 0.00 0.00 55.97 56.58 3hjz s LYS 155 Cb -0.12 -3.37 -0.03 0.00 -1.68 0.00 0.00 37.83 32.63 3hjz s LYS 155 CO 0.22 -0.01 -0.26 0.00 -0.76 0.00 0.00 175.35 174.54 3hjz s ASN 157 N -1.39 5.27 -0.34 0.00 2.47 0.61 -2.12 114.94 119.45 3hjz s ASN 157 Ca 0.12 -1.11 -0.21 0.00 0.42 0.00 0.00 52.86 52.09 3hjz s ASN 157 Cb -0.10 -1.86 0.00 0.00 -1.45 0.00 0.00 41.25 37.84 3hjz s ASN 157 CO 0.03 -0.31 0.66 -0.76 -3.72 0.00 0.00 177.10 173.00 3hjz s LEU 158 N 1.40 4.20 0.00 3.21 2.01 0.09 -1.32 118.68 128.28 3hjz s LEU 158 Ca -0.01 0.27 0.00 0.00 0.01 0.00 0.00 54.13 54.40 3hjz s LEU 158 Cb -0.19 -2.83 0.00 0.00 0.01 0.00 0.00 46.19 43.18 3hjz s LEU 158 CO 0.03 -0.58 0.03 1.07 1.01 0.00 0.00 176.35 177.90 3hjz n THR 159 N 5.56 0.00 -4.02 5.49 5.66 0.03 -0.94 114.28 126.06 3hjz n THR 159 Ca -0.00 -1.32 -0.29 0.00 -3.05 0.00 0.00 64.05 59.39 3hjz n THR 159 Cb 0.49 0.20 -0.03 0.00 -1.55 0.00 0.00 70.33 69.44 3hjz n THR 159 CO 0.00 0.00 0.00 0.18 -3.05 0.00 0.00 175.07 172.20 3hjz n LEU 160 N 0.00 -1.87 -4.35 1.09 4.77 -1.26 -0.63 117.00 114.75 3hjz n LEU 160 Ca -0.10 -1.09 -0.35 0.00 -0.03 0.00 0.00 56.01 54.44 3hjz n LEU 160 Cb 0.36 -2.06 -0.14 0.00 -2.33 0.00 0.00 43.42 39.25 3hjz n LEU 160 CO 0.19 0.47 -0.38 -0.22 -1.33 0.00 0.00 177.39 176.13 3hjz s LEU 161 N -7.05 2.96 0.00 2.23 0.20 -1.26 -4.23 118.68 111.54 3hjz s LEU 161 Ca 0.08 -0.34 0.00 0.00 0.69 0.00 0.00 54.13 54.56 3hjz s LEU 161 Cb -0.03 -1.75 0.00 0.00 -0.43 0.00 0.00 46.19 43.98 3hjz s LEU 161 CO 0.92 0.01 0.00 0.49 -0.29 0.00 0.00 176.35 177.48 3hjz n PHE 162 N 4.58 0.00 -4.27 5.38 3.72 -1.26 -3.62 117.46 121.99 3hjz n PHE 162 Ca -0.18 0.00 -0.19 0.00 -0.05 0.00 0.00 57.45 57.03 3hjz n PHE 162 Cb 0.51 0.00 -0.08 0.00 -0.94 0.00 0.00 39.48 38.97 3hjz n PHE 162 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 176.76 177.25 3hjz s ASN 163 N -1.72 1.55 0.14 4.37 2.20 -1.26 -4.92 114.94 115.31 3hjz s ASN 163 Ca 0.00 -1.72 -0.13 0.00 -0.94 0.00 0.00 52.86 50.07 3hjz s ASN 163 Cb 0.00 0.55 0.01 0.00 -2.00 0.00 0.00 41.25 39.82 3hjz s ASN 163 CO 0.00 -1.07 1.60 0.15 -2.94 0.00 0.00 177.10 174.85 3hjz h PHE 164 N 2.16 0.89 -0.36 1.54 3.57 -1.99 -1.79 116.94 120.95 3hjz h PHE 164 Ca -0.26 -0.15 0.08 0.00 3.53 0.00 0.00 57.97 61.18 3hjz h PHE 164 Cb 1.23 -0.23 -0.08 0.00 2.79 0.00 0.00 35.95 39.65 3hjz h PHE 164 CO 1.63 0.84 -0.23 0.00 -2.23 0.00 0.00 178.31 178.32 3hjz h GLN 166 N -0.18 0.76 -0.08 0.00 4.20 -1.89 -1.59 115.11 116.33 3hjz h GLN 166 Ca 0.18 -0.13 0.01 0.00 0.06 0.00 0.00 58.65 58.77 3hjz h GLN 166 Cb 0.46 -0.13 -0.01 0.00 0.30 0.00 0.00 27.48 28.10 3hjz h GLN 166 CO -0.47 0.66 -0.01 0.00 -0.67 0.00 0.00 178.83 178.34 3hjz h ALA 167 N 1.06 0.06 -0.45 3.87 0.00 -0.71 -1.03 119.26 122.06 3hjz h ALA 167 Ca 0.17 0.02 -0.06 0.00 0.00 0.00 0.00 54.91 55.05 3hjz h ALA 167 Cb 0.18 0.04 -0.02 0.00 0.00 0.00 0.00 17.79 17.99 3hjz h ALA 167 CO -0.02 -0.48 0.06 0.28 0.00 0.00 0.00 179.25 179.10 3hjz h VAL 168 N 0.02 1.25 -0.90 0.00 2.07 -0.70 -0.07 116.25 117.92 3hjz h VAL 168 Ca 0.04 -0.93 0.06 0.00 0.82 0.00 0.00 66.70 66.69 3hjz h VAL 168 Cb 0.05 0.97 -0.06 0.00 -1.52 0.00 0.00 31.29 30.72 3hjz h VAL 168 CO -0.07 0.32 0.57 0.74 0.02 0.00 0.00 177.57 179.15 3hjz h THR 169 N 0.62 1.06 -0.40 2.57 2.02 -1.15 -0.38 112.91 117.26 3hjz h THR 169 Ca 0.14 -0.36 -0.06 0.00 0.77 0.00 0.00 66.41 66.90 3hjz h THR 169 Cb 0.40 -0.07 -0.01 0.00 -1.74 0.00 0.00 68.15 66.73 3hjz h THR 169 CO 0.01 0.19 0.03 0.00 0.37 0.00 0.00 175.52 176.12 3hjz h ALA 171 N 0.90 0.47 0.00 0.00 0.00 -0.64 -1.97 119.26 118.02 3hjz h ALA 171 Ca 0.12 -0.10 -0.03 0.00 0.00 0.00 0.00 54.91 54.89 3hjz h ALA 171 Cb 0.43 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.07 3hjz h ALA 171 CO 0.01 0.03 -0.15 -0.91 0.00 0.00 0.00 179.25 178.24 3hjz h ASN 172 N 0.45 0.00 -0.26 0.00 -0.26 -1.09 -1.68 115.58 112.74 3hjz h ASN 172 Ca 0.12 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.86 3hjz h ASN 172 Cb 0.12 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.38 3hjz h ASN 172 CO -0.02 0.15 0.00 0.00 -1.06 0.00 0.00 177.43 176.50 3hjz n ALA 173 N -2.40 2.47 -3.86 -0.83 0.00 -0.79 -4.95 120.51 110.15 3hjz n ALA 173 Ca -0.02 -0.51 -0.29 0.00 0.00 0.00 0.00 53.44 52.62 3hjz n ALA 173 Cb 0.23 -1.01 0.04 0.00 0.00 0.00 0.00 19.45 18.71 3hjz n ALA 173 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 3hjz n ASN 174 N 0.32 -5.02 -4.76 0.00 3.02 -0.63 -4.58 115.26 103.61 3hjz n ASN 174 Ca 0.11 -0.74 -0.41 0.00 -0.03 0.00 0.00 54.58 53.51 3hjz n ASN 174 Cb 0.26 -4.09 -0.02 0.00 -0.61 0.00 0.00 39.78 35.31 3hjz n ASN 174 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 3hjz s ILE 175 N -3.31 2.73 0.18 2.41 1.09 -0.90 -4.95 121.20 118.44 3hjz s ILE 175 Ca 0.64 0.66 -0.13 0.00 -1.10 0.00 0.00 60.65 60.72 3hjz s ILE 175 Cb -0.31 -3.42 0.08 0.00 -1.06 0.00 0.00 42.46 37.74 3hjz s ILE 175 CO 0.81 0.13 1.81 0.74 -0.10 0.00 0.00 174.94 178.34 3hjz h THR 176 N 3.32 1.17 -2.49 2.92 2.02 -1.92 -3.37 112.91 114.57 3hjz h THR 176 Ca -0.47 -0.38 -0.09 0.00 0.77 0.00 0.00 66.41 66.23 3hjz h THR 176 Cb 1.22 0.38 -0.23 0.00 -1.74 0.00 0.00 68.15 67.79 3hjz h THR 176 CO 0.72 0.18 -0.10 -0.22 0.37 0.00 0.00 175.52 176.46 3hjz s LEU 177 N -10.05 0.03 0.06 2.58 0.20 -0.90 -0.40 118.68 110.20 3hjz s LEU 177 Ca -0.13 0.98 0.08 0.00 0.69 0.00 0.00 54.13 55.76 3hjz s LEU 177 Cb 0.13 1.79 -0.03 0.00 -0.43 0.00 0.00 46.19 47.64 3hjz s LEU 177 CO 0.76 -0.21 -0.21 0.27 -0.29 0.00 0.00 176.35 176.66 3hjz s ILE 178 N 0.13 2.55 -0.54 6.68 -4.36 -0.16 -0.73 121.20 124.77 3hjz s ILE 178 Ca -0.01 -1.35 0.06 0.00 -0.26 0.00 0.00 60.65 59.09 3hjz s ILE 178 Cb -0.04 -2.07 0.22 0.00 1.25 0.00 0.00 42.46 41.83 3hjz s ILE 178 CO 0.01 0.29 0.58 -1.54 0.24 0.00 0.00 174.94 174.52 3hjz n SER 179 N 1.45 1.93 -4.75 4.36 3.41 -0.12 -4.47 113.62 115.43 3hjz n SER 179 Ca -0.16 -3.02 -0.41 0.00 -0.26 0.00 0.00 58.87 55.01 3hjz n SER 179 Cb 0.52 -0.66 -0.02 0.00 -0.26 0.00 0.00 64.21 63.80 3hjz n SER 179 CO 0.00 0.00 0.00 -2.16 -0.16 0.00 0.00 175.04 172.72 3hjz s PRO 180 N -1.55 4.16 -0.88 4.33 0.04 -1.26 -4.35 135.00 135.49 3hjz s PRO 180 Ca 0.35 2.51 -0.16 0.00 0.04 0.00 0.00 61.00 63.73 3hjz s PRO 180 Cb 0.11 -3.04 0.18 0.00 0.04 0.00 0.00 34.50 31.78 3hjz s PRO 180 CO -0.10 -0.57 0.95 -0.06 0.04 0.00 0.00 177.00 177.26 3hjz s PHE 181 N -0.04 3.46 0.12 0.56 0.08 -1.24 -1.40 117.98 119.52 3hjz s PHE 181 Ca 0.62 -1.71 -0.22 0.00 0.12 0.00 0.00 56.93 55.74 3hjz s PHE 181 Cb -0.46 -4.05 -0.06 0.00 -0.57 0.00 0.00 43.02 37.88 3hjz s PHE 181 CO 0.47 -1.23 1.70 0.28 -0.10 0.00 0.00 175.22 176.34 3hjz h VAL 182 N 5.27 0.78 -0.13 -0.44 2.07 -1.45 -2.72 116.25 119.63 3hjz h VAL 182 Ca 0.13 0.00 -0.04 0.00 0.82 0.00 0.00 66.70 67.62 3hjz h VAL 182 Cb 1.03 0.78 -0.01 0.00 -1.52 0.00 0.00 31.29 31.57 3hjz h VAL 182 CO 0.93 0.00 -0.09 1.23 0.02 0.00 0.00 177.57 179.66 3hjz h GLY 183 N -0.07 0.21 1.58 2.17 0.00 -0.88 -1.97 103.07 104.11 3hjz h GLY 183 Ca 0.07 -0.12 -0.10 0.00 0.00 0.00 0.00 47.33 47.18 3hjz h GLY 183 CO -0.16 0.11 -0.27 3.21 0.00 0.00 0.00 176.54 179.43 3hjz h ARG 184 N 0.19 0.48 -0.22 4.80 3.08 -1.64 -0.36 114.38 120.70 3hjz h ARG 184 Ca 0.04 -0.19 -0.02 0.00 0.07 0.00 0.00 59.98 59.89 3hjz h ARG 184 Cb 0.29 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.30 3hjz h ARG 184 CO 0.02 0.71 0.07 0.82 -1.07 0.00 0.00 179.97 180.52 3hjz h ILE 185 N 0.42 1.19 -0.34 2.04 2.04 -1.27 -2.00 117.51 119.59 3hjz h ILE 185 Ca 0.06 -0.61 0.05 0.00 1.00 0.00 0.00 64.86 65.36 3hjz h ILE 185 Cb 0.70 1.18 -0.05 0.00 -0.74 0.00 0.00 36.82 37.91 3hjz h ILE 185 CO 0.05 0.20 0.06 0.25 0.00 0.00 0.00 178.15 178.71 3hjz h LEU 186 N 0.19 -0.01 -0.46 1.44 5.85 -1.21 -2.75 115.31 118.36 3hjz h LEU 186 Ca 0.07 0.06 0.06 0.00 0.84 0.00 0.00 57.88 58.91 3hjz h LEU 186 Cb 0.24 0.08 -0.05 0.00 0.37 0.00 0.00 40.66 41.30 3hjz h LEU 186 CO -0.00 0.03 0.18 0.44 -0.34 0.00 0.00 178.44 178.75 3hjz h ASP 187 N 0.18 0.21 -0.42 1.25 3.32 -0.91 -1.86 116.42 118.19 3hjz h ASP 187 Ca 0.16 0.05 0.05 0.00 0.02 0.00 0.00 57.03 57.31 3hjz h ASP 187 Cb 0.19 0.02 -0.04 0.00 0.22 0.00 0.00 39.33 39.71 3hjz h ASP 187 CO -0.22 0.15 0.16 -0.25 -1.72 0.00 0.00 179.24 177.36 3hjz h TRP 188 N 0.36 0.28 -0.57 4.55 7.01 -1.21 -0.45 115.95 125.92 3hjz h TRP 188 Ca 0.22 0.02 -0.09 0.00 2.11 0.00 0.00 58.89 61.15 3hjz h TRP 188 Cb 0.20 -0.06 -0.02 0.00 -2.10 0.00 0.00 29.16 27.17 3hjz h TRP 188 CO -0.14 0.11 0.02 0.45 -2.79 0.00 0.00 178.44 176.09 3hjz h HIS 189 N 0.33 1.08 -0.30 2.65 3.86 -1.12 0.12 115.15 121.77 3hjz h HIS 189 Ca 0.19 -0.18 0.01 0.00 -1.16 0.00 0.00 60.37 59.23 3hjz h HIS 189 Cb 0.17 -0.28 -0.02 0.00 1.06 0.00 0.00 27.41 28.33 3hjz h HIS 189 CO -0.14 0.96 0.18 0.87 0.86 0.00 0.00 177.93 180.66 3hjz h LYS 190 N 0.89 0.36 -0.63 2.45 1.57 -1.20 -2.37 116.57 117.64 3hjz h LYS 190 Ca 0.17 -0.02 -0.07 0.00 -1.87 0.00 0.00 60.65 58.86 3hjz h LYS 190 Cb 0.52 -0.08 -0.03 0.00 0.08 0.00 0.00 32.23 32.72 3hjz h LYS 190 CO 0.03 0.24 0.13 0.00 -0.57 0.00 0.00 179.45 179.27 3hjz h ALA 191 N 1.12 1.04 -0.30 3.86 0.00 -0.85 -0.29 119.26 123.85 3hjz h ALA 191 Ca 0.11 -0.24 -0.10 0.00 0.00 0.00 0.00 54.91 54.68 3hjz h ALA 191 Cb -0.02 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.51 3hjz h ALA 191 CO -0.04 0.62 -0.22 -0.22 0.00 0.00 0.00 179.25 179.39 3hjz h LYS 192 N 0.95 0.57 0.00 0.00 1.63 -0.90 -3.40 116.57 115.42 3hjz h LYS 192 Ca 0.20 -0.21 -0.03 0.00 -0.85 0.00 0.00 60.65 59.76 3hjz h LYS 192 Cb 0.37 -0.04 -0.00 0.00 -0.60 0.00 0.00 32.23 31.96 3hjz h LYS 192 CO 0.00 0.75 -1.26 0.25 -3.45 0.00 0.00 179.45 175.75 3hjz n THR 193 N -4.13 0.10 -0.96 1.00 -2.24 -0.90 -5.00 114.28 102.15 3hjz n THR 193 Ca -0.00 -0.14 0.00 0.00 -2.27 0.00 0.00 64.05 61.64 3hjz n THR 193 Cb 0.40 0.01 0.00 0.00 -2.10 0.00 0.00 70.33 68.64 3hjz n THR 193 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3hjz n GLY 194 N 2.36 0.41 3.72 3.38 0.00 -0.13 -5.01 105.19 109.91 3hjz n GLY 194 Ca -0.03 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.57 3hjz n GLY 194 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3hjz s LYS 195 N -0.60 4.20 0.23 1.61 2.20 -1.26 -4.90 119.74 121.21 3hjz s LYS 195 Ca 0.00 2.42 0.22 0.00 -0.36 0.00 0.00 55.97 58.24 3hjz s LYS 195 Cb 0.00 -3.13 0.04 0.00 -1.51 0.00 0.00 37.83 33.23 3hjz s LYS 195 CO 0.00 -0.63 1.12 1.79 -0.36 0.00 0.00 175.35 177.27 3hjz h THR 196 N 3.93 0.08 -2.74 3.43 1.35 -1.95 -3.41 112.91 113.60 3hjz h THR 196 Ca -0.43 -1.14 -0.05 0.00 -0.55 0.00 0.00 66.41 64.24 3hjz h THR 196 Cb 1.20 1.66 -0.15 0.00 -1.73 0.00 0.00 68.15 69.14 3hjz h THR 196 CO 0.91 0.05 0.11 -0.94 -0.25 0.00 0.00 175.52 175.40 3hjz s SER 197 N -5.57 -0.51 -0.32 5.36 1.04 -1.26 -5.08 113.70 107.36 3hjz s SER 197 Ca 0.01 0.19 -0.01 0.00 0.48 0.00 0.00 55.95 56.61 3hjz s SER 197 Cb 0.09 0.53 0.11 0.00 0.10 0.00 0.00 66.02 66.85 3hjz s SER 197 CO 0.77 -0.79 0.13 -0.36 0.98 0.00 0.00 173.24 173.98 3hjz s PHE 198 N -2.71 1.36 0.11 5.02 0.40 -1.26 -5.09 117.98 115.81 3hjz s PHE 198 Ca -0.04 -1.62 -0.24 0.00 -0.60 0.00 0.00 56.93 54.43 3hjz s PHE 198 Cb -0.00 -1.50 -0.07 0.00 0.51 0.00 0.00 43.02 41.96 3hjz s PHE 198 CO -0.04 -0.85 0.75 0.42 0.70 0.00 0.00 175.22 176.20 3hjz s ILE 199 N 1.54 4.56 0.00 0.64 1.01 -1.26 -3.35 121.20 124.33 3hjz s ILE 199 Ca 0.11 1.62 0.00 0.00 0.00 0.00 0.00 60.65 62.38 3hjz s ILE 199 Cb -0.18 -4.10 0.00 0.00 0.01 0.00 0.00 42.46 38.19 3hjz s ILE 199 CO -0.23 0.46 0.00 0.61 0.00 0.00 0.00 174.94 175.78 3hjz n GLY 200 N 1.94 3.73 0.17 6.18 0.00 -1.26 -1.51 105.19 114.43 3hjz n GLY 200 Ca -0.05 0.03 0.13 0.00 0.00 0.00 0.00 46.02 46.14 3hjz n GLY 200 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hjz h ALA 201 N -0.85 1.00 0.00 4.61 0.00 -1.93 -1.97 119.26 120.12 3hjz h ALA 201 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3hjz h ALA 201 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 3hjz h ALA 201 CO 0.00 0.00 -0.18 0.39 0.00 0.00 0.00 179.25 179.46 3hjz n GLU 202 N -2.40 0.15 -1.66 0.00 1.02 -0.57 -4.50 120.64 112.68 3hjz n GLU 202 Ca 0.00 0.10 -0.47 0.00 -0.02 0.00 0.00 57.16 56.77 3hjz n GLU 202 Cb 0.16 -1.65 -0.04 0.00 -0.02 0.00 0.00 31.44 29.88 3hjz n GLU 202 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 3hjz n ASP 203 N -1.91 3.48 0.02 1.62 -0.08 -0.74 -4.76 116.55 114.18 3hjz n ASP 203 Ca 0.06 0.87 0.06 0.00 -1.51 0.00 0.00 54.79 54.27 3hjz n ASP 203 Cb 0.39 -1.40 0.47 0.00 2.34 0.00 0.00 41.12 42.92 3hjz n ASP 203 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 3hjz h PRO 204 N 10.08 0.43 -0.47 -0.67 0.11 -1.88 -0.50 132.00 139.11 3hjz h PRO 204 Ca -0.47 -0.03 -0.03 0.00 0.11 0.00 0.00 66.00 65.59 3hjz h PRO 204 Cb 1.27 -0.10 -0.02 0.00 0.11 0.00 0.00 31.00 32.26 3hjz h PRO 204 CO 0.95 0.29 0.19 0.78 -0.21 0.00 0.00 178.00 180.00 3hjz h GLY 205 N 0.45 0.74 0.93 -0.55 0.00 -1.85 -1.56 103.07 101.22 3hjz h GLY 205 Ca 0.16 -0.40 -0.02 0.00 0.00 0.00 0.00 47.33 47.07 3hjz h GLY 205 CO -0.04 0.38 0.13 -2.08 0.00 0.00 0.00 176.54 174.93 3hjz h VAL 206 N 0.61 1.18 -0.18 4.60 2.07 -1.73 -1.04 116.25 121.76 3hjz h VAL 206 Ca 0.16 -0.56 0.05 0.00 0.82 0.00 0.00 66.70 67.17 3hjz h VAL 206 Cb 0.18 0.94 -0.06 0.00 -1.52 0.00 0.00 31.29 30.83 3hjz h VAL 206 CO -0.01 0.20 -0.20 0.40 0.02 0.00 0.00 177.57 177.98 3hjz h ILE 207 N 0.38 0.49 -0.37 4.57 2.04 -1.00 -0.17 117.51 123.45 3hjz h ILE 207 Ca 0.11 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.96 3hjz h ILE 207 Cb 0.18 0.49 -0.02 0.00 -0.74 0.00 0.00 36.82 36.73 3hjz h ILE 207 CO -0.01 0.00 0.21 0.28 0.00 0.00 0.00 178.15 178.63 3hjz h SER 208 N -0.22 0.46 0.12 1.72 0.02 -1.17 -2.14 113.55 112.34 3hjz h SER 208 Ca 0.12 -0.09 -0.16 0.00 -0.84 0.00 0.00 61.79 60.82 3hjz h SER 208 Cb 0.40 -0.12 -0.01 0.00 0.14 0.00 0.00 62.40 62.81 3hjz h SER 208 CO -0.31 0.42 -0.57 0.58 -1.14 0.00 0.00 176.83 175.81 3hjz h VAL 209 N 0.47 1.34 -0.34 2.27 2.07 -1.05 -1.97 116.25 119.04 3hjz h VAL 209 Ca 0.13 -1.84 0.07 0.00 0.82 0.00 0.00 66.70 65.88 3hjz h VAL 209 Cb 0.05 1.84 -0.06 0.00 -1.52 0.00 0.00 31.29 31.60 3hjz h VAL 209 CO -0.02 0.56 -0.09 0.74 0.02 0.00 0.00 177.57 178.78 3hjz h THR 210 N 0.35 0.65 -0.19 2.57 2.02 -0.96 -0.08 112.91 117.28 3hjz h THR 210 Ca 0.00 0.00 -0.00 0.00 0.77 0.00 0.00 66.41 67.18 3hjz h THR 210 Cb 1.10 0.65 -0.01 0.00 -1.74 0.00 0.00 68.15 68.15 3hjz h THR 210 CO 0.10 0.00 0.10 -0.61 0.37 0.00 0.00 175.52 175.48 3hjz h GLN 211 N -0.01 0.26 -0.02 6.66 4.15 -1.22 -1.43 115.11 123.51 3hjz h GLN 211 Ca 0.16 -0.03 0.01 0.00 0.77 0.00 0.00 58.65 59.57 3hjz h GLN 211 Cb 0.25 -0.05 -0.02 0.00 0.21 0.00 0.00 27.48 27.88 3hjz h GLN 211 CO -0.35 0.25 -0.06 0.82 -1.93 0.00 0.00 178.83 177.56 3hjz h ILE 212 N 0.20 0.84 -0.12 2.39 2.04 -1.20 -0.79 117.51 120.87 3hjz h ILE 212 Ca 0.07 0.00 0.03 0.00 1.00 0.00 0.00 64.86 65.96 3hjz h ILE 212 Cb 0.07 0.84 -0.03 0.00 -0.74 0.00 0.00 36.82 36.96 3hjz h ILE 212 CO -0.01 0.00 -0.07 0.22 0.00 0.00 0.00 178.15 178.29 3hjz h TYR 213 N -0.10 -0.17 -0.56 1.37 3.20 -0.94 -0.39 116.97 119.38 3hjz h TYR 213 Ca 0.03 0.01 0.06 0.00 3.14 0.00 0.00 58.73 61.97 3hjz h TYR 213 Cb 0.14 0.09 -0.05 0.00 1.54 0.00 0.00 36.73 38.45 3hjz h TYR 213 CO -0.14 -0.11 0.28 -0.22 -1.64 0.00 0.00 178.16 176.33 3hjz h LYS 214 N -0.07 0.52 -0.17 1.82 3.64 -1.13 -1.81 116.57 119.37 3hjz h LYS 214 Ca 0.07 -0.03 -0.02 0.00 -1.27 0.00 0.00 60.65 59.40 3hjz h LYS 214 Cb 0.18 -0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 31.87 3hjz h LYS 214 CO -0.16 0.34 0.03 -0.92 -2.27 0.00 0.00 179.45 176.47 3hjz h TYR 215 N 0.53 0.29 -0.26 1.91 5.03 -0.88 -1.68 116.97 121.92 3hjz h TYR 215 Ca 0.26 -0.04 0.02 0.00 2.58 0.00 0.00 58.73 61.55 3hjz h TYR 215 Cb 0.19 -0.08 -0.02 0.00 1.55 0.00 0.00 36.73 38.36 3hjz h TYR 215 CO -0.11 0.43 0.12 0.74 -1.32 0.00 0.00 178.16 178.02 3hjz h PHE 216 N 0.07 0.21 -0.17 -3.82 -1.00 -0.82 -1.28 116.94 110.12 3hjz h PHE 216 Ca 0.05 0.01 -0.06 0.00 2.81 0.00 0.00 57.97 60.78 3hjz h PHE 216 Cb 0.29 -0.06 -0.00 0.00 3.61 0.00 0.00 35.95 39.79 3hjz h PHE 216 CO 0.02 0.11 -0.13 0.87 -1.61 0.00 0.00 178.31 177.57 3hjz h LYS 217 N 0.25 0.39 -1.01 1.51 1.79 -1.32 -0.79 116.57 117.40 3hjz h LYS 217 Ca 0.11 -0.19 0.05 0.00 -2.18 0.00 0.00 60.65 58.43 3hjz h LYS 217 Cb 0.05 -0.00 -0.06 0.00 -1.58 0.00 0.00 32.23 30.63 3hjz h LYS 217 CO -0.09 0.74 0.66 0.93 -1.08 0.00 0.00 179.45 180.61 3hjz h GLU 218 N 0.06 1.21 0.00 3.15 5.08 -1.27 -2.18 114.58 120.63 3hjz h GLU 218 Ca 0.03 -0.07 0.00 0.00 -1.00 0.00 0.00 59.36 58.32 3hjz h GLU 218 Cb 0.64 -0.27 0.00 0.00 0.50 0.00 0.00 28.75 29.62 3hjz h GLU 218 CO 0.03 0.80 0.00 1.63 -1.00 0.00 0.00 179.01 180.47 3hjz n LYS 219 N -4.46 0.08 -0.99 2.33 4.76 -0.49 -0.44 118.16 118.96 3hjz n LYS 219 Ca 0.14 0.07 0.00 0.00 -2.87 0.00 0.00 58.31 55.65 3hjz n LYS 219 Cb 0.12 -1.59 0.00 0.00 -1.84 0.00 0.00 35.03 31.72 3hjz n LYS 219 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3hjz n GLY 220 N 1.44 0.42 3.76 0.72 0.00 -0.75 -4.97 105.19 105.82 3hjz n GLY 220 Ca 0.07 -0.76 -0.39 0.00 0.00 0.00 0.00 46.02 44.93 3hjz n GLY 220 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3hjz s PHE 221 N -2.00 2.60 -0.43 1.61 0.40 -0.38 -4.94 117.98 114.84 3hjz s PHE 221 Ca 0.00 1.39 0.23 0.00 -0.60 0.00 0.00 56.93 57.95 3hjz s PHE 221 Cb 0.00 -3.71 0.24 0.00 0.51 0.00 0.00 43.02 40.05 3hjz s PHE 221 CO 0.00 -2.41 1.31 1.57 0.70 0.00 0.00 175.22 176.39 3hjz h LYS 222 N 2.16 0.00 -6.48 0.44 2.10 -1.92 -3.43 116.57 109.43 3hjz h LYS 222 Ca -0.50 0.00 -0.58 0.00 -2.00 0.00 0.00 60.65 57.57 3hjz h LYS 222 Cb 1.27 0.00 0.05 0.00 -0.90 0.00 0.00 32.23 32.65 3hjz h LYS 222 CO 0.60 0.00 0.86 2.41 -2.00 0.00 0.00 179.45 181.32 3hjz n THR 223 N -2.59 0.09 -2.86 0.07 -1.04 -1.26 -4.93 114.28 101.75 3hjz n THR 223 Ca 0.02 -0.02 -0.37 0.00 -2.04 0.00 0.00 64.05 61.65 3hjz n THR 223 Cb 0.51 -1.62 -0.06 0.00 -1.82 0.00 0.00 70.33 67.33 3hjz n THR 223 CO 0.00 0.00 0.00 -1.61 -0.64 0.00 0.00 175.07 172.82 3hjz s GLU 224 N 1.40 4.49 0.57 -2.82 2.02 0.47 -4.92 118.70 119.91 3hjz s GLU 224 Ca 0.80 1.21 0.06 0.00 0.02 0.00 0.00 54.97 57.07 3hjz s GLU 224 Cb -0.66 -2.80 0.06 0.00 0.10 0.00 0.00 34.13 30.83 3hjz s GLU 224 CO 0.39 0.30 0.53 0.08 0.02 0.00 0.00 175.26 176.58 3hjz s VAL 225 N -1.61 1.64 -0.19 2.63 1.01 -1.26 -0.99 120.40 121.63 3hjz s VAL 225 Ca 0.49 -1.37 -0.14 0.00 0.00 0.00 0.00 61.98 60.97 3hjz s VAL 225 Cb -0.18 -2.01 0.06 0.00 0.00 0.00 0.00 36.38 34.25 3hjz s VAL 225 CO 0.23 0.00 0.48 -0.83 0.00 0.00 0.00 175.10 174.97 3hjz s GLY 227 N -4.42 -0.38 0.19 4.51 0.00 -0.82 -1.76 107.32 104.64 3hjz s GLY 227 Ca 0.40 1.56 -0.05 0.00 0.00 0.00 0.00 44.72 46.62 3hjz s GLY 227 CO 0.25 1.53 0.23 0.00 0.00 0.00 0.00 173.10 175.11 3hjz s ALA 228 N 0.89 0.53 -0.74 3.20 0.00 -0.49 -0.70 121.76 124.45 3hjz s ALA 228 Ca -0.05 -1.29 -0.04 0.00 0.00 0.00 0.00 51.96 50.58 3hjz s ALA 228 Cb -0.06 1.10 -0.04 0.00 0.00 0.00 0.00 23.12 24.12 3hjz s ALA 228 CO -0.07 -0.64 0.64 0.45 0.00 0.00 0.00 175.76 176.14 3hjz n SER 229 N -0.25 -5.00 -4.83 0.00 2.88 -1.26 -1.62 113.62 103.55 3hjz n SER 229 Ca -0.02 -0.49 -0.37 0.00 -1.33 0.00 0.00 58.87 56.65 3hjz n SER 229 Cb 0.64 -3.77 -0.06 0.00 -0.75 0.00 0.00 64.21 60.27 3hjz n SER 229 CO 0.00 0.00 0.00 -0.36 -1.23 0.00 0.00 175.04 173.45 3hjz s PHE 230 N -3.27 3.72 -0.10 0.66 0.08 -1.26 -0.38 117.98 117.43 3hjz s PHE 230 Ca 0.30 1.07 0.16 0.00 0.12 0.00 0.00 56.93 58.58 3hjz s PHE 230 Cb -0.04 -2.35 -0.15 0.00 -0.57 0.00 0.00 43.02 39.90 3hjz s PHE 230 CO 0.51 0.59 0.81 0.00 -0.10 0.00 0.00 175.22 177.02 3hjz h ARG 231 N 4.39 0.00 -3.52 0.44 2.47 -1.93 -3.47 114.38 112.77 3hjz h ARG 231 Ca -0.50 0.00 -0.04 0.00 -1.26 0.00 0.00 59.98 58.18 3hjz h ARG 231 Cb 1.21 0.00 -0.09 0.00 -1.65 0.00 0.00 29.97 29.44 3hjz h ARG 231 CO 0.63 0.35 -0.06 0.54 0.56 0.00 0.00 179.97 181.99 3hjz s ASN 232 N -5.88 -0.13 0.29 7.04 4.22 -1.26 -5.05 114.94 114.16 3hjz s ASN 232 Ca -0.03 -0.80 0.14 0.00 -2.14 0.00 0.00 52.86 50.03 3hjz s ASN 232 Cb 0.08 0.59 0.30 0.00 1.28 0.00 0.00 41.25 43.51 3hjz s ASN 232 CO 0.81 -1.14 1.56 0.25 -2.04 0.00 0.00 177.10 176.54 3hjz h LEU 233 N 2.23 0.00 -0.91 3.54 5.85 -2.01 -3.15 115.31 120.86 3hjz h LEU 233 Ca -0.26 0.00 -0.04 0.00 0.84 0.00 0.00 57.88 58.42 3hjz h LEU 233 Cb 1.25 0.00 -0.03 0.00 0.37 0.00 0.00 40.66 42.25 3hjz h LEU 233 CO 0.35 0.57 0.33 0.44 -0.34 0.00 0.00 178.44 179.78 3hjz h ASP 234 N 0.00 1.02 -0.55 1.25 3.45 -1.99 -1.88 116.42 117.72 3hjz h ASP 234 Ca -0.01 -0.14 0.08 0.00 0.43 0.00 0.00 57.03 57.39 3hjz h ASP 234 Cb 1.22 -0.26 -0.06 0.00 -0.56 0.00 0.00 39.33 39.66 3hjz h ASP 234 CO 0.07 0.89 0.20 -0.33 -1.57 0.00 0.00 179.24 178.50 3hjz h GLU 235 N 1.10 0.37 -0.36 3.56 5.08 -1.88 -0.05 114.58 122.41 3hjz h GLU 235 Ca 0.26 -0.02 -0.02 0.00 -1.00 0.00 0.00 59.36 58.58 3hjz h GLU 235 Cb 0.17 -0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.32 3hjz h GLU 235 CO -0.03 0.25 0.16 0.82 -1.00 0.00 0.00 179.01 179.21 3hjz h ILE 236 N 0.38 1.18 -0.66 3.13 2.04 -1.54 -3.00 117.51 119.03 3hjz h ILE 236 Ca 0.27 -0.52 -0.02 0.00 1.00 0.00 0.00 64.86 65.59 3hjz h ILE 236 Cb 0.30 0.86 -0.03 0.00 -0.74 0.00 0.00 36.82 37.21 3hjz h ILE 236 CO -0.27 0.19 0.34 0.11 0.00 0.00 0.00 178.15 178.52 3hjz h LYS 237 N 0.43 0.93 -0.34 2.37 1.57 -0.93 -2.17 116.57 118.44 3hjz h LYS 237 Ca 0.12 -0.12 0.10 0.00 -1.87 0.00 0.00 60.65 58.88 3hjz h LYS 237 Cb 0.15 -0.18 -0.01 0.00 0.08 0.00 0.00 32.23 32.27 3hjz h LYS 237 CO -0.01 0.72 0.25 0.93 -0.57 0.00 0.00 179.45 180.77 3hjz h GLU 238 N 0.91 0.00 -0.65 3.15 4.39 -0.94 -2.54 114.58 118.90 3hjz h GLU 238 Ca 0.23 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.93 3hjz h GLU 238 Cb 0.08 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.73 3hjz h GLU 238 CO -0.03 0.00 0.00 1.28 -1.16 0.00 0.00 179.01 179.10 3hjz n LEU 239 N -4.37 4.21 -4.65 1.33 4.77 -0.85 -4.64 117.00 112.81 3hjz n LEU 239 Ca 0.05 -2.21 -0.49 0.00 -0.03 0.00 0.00 56.01 53.33 3hjz n LEU 239 Cb 0.42 -0.51 -0.05 0.00 -2.33 0.00 0.00 43.42 40.96 3hjz n LEU 239 CO 0.35 0.89 1.12 0.00 -1.33 0.00 0.00 177.39 178.42 3hjz n ALA 240 N 1.27 0.50 0.00 -1.18 0.00 -0.96 -1.40 120.51 118.74 3hjz n ALA 240 Ca 0.24 0.46 0.00 0.00 0.00 0.00 0.00 53.44 54.13 3hjz n ALA 240 Cb 0.73 -2.27 0.00 0.00 0.00 0.00 0.00 19.45 17.91 3hjz n ALA 240 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3hjz n GLY 241 N 3.22 0.75 3.64 0.00 0.00 -1.26 -1.65 105.19 109.88 3hjz n GLY 241 Ca 0.18 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.85 3hjz n GLY 241 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hjz h ASP 243 N -0.40 -0.55 -4.90 0.00 3.32 -1.88 -3.38 116.42 108.62 3hjz h ASP 243 Ca -0.47 0.10 -0.20 0.00 0.02 0.00 0.00 57.03 56.48 3hjz h ASP 243 Cb 1.32 0.26 -0.18 0.00 0.22 0.00 0.00 39.33 40.95 3hjz h ASP 243 CO 0.47 -0.23 -0.70 -0.76 -1.72 0.00 0.00 179.24 176.30 3hjz s LEU 244 N -10.43 2.37 -0.04 1.55 1.02 -0.72 -1.47 118.68 110.96 3hjz s LEU 244 Ca -0.15 -0.75 -0.00 0.00 0.02 0.00 0.00 54.13 53.25 3hjz s LEU 244 Cb 0.11 0.02 0.03 0.00 0.02 0.00 0.00 46.19 46.36 3hjz s LEU 244 CO 0.68 -0.39 0.02 -0.76 0.02 0.00 0.00 176.35 175.92 3hjz s LEU 245 N -2.21 0.84 -0.26 1.79 1.43 -0.71 -1.94 118.68 117.63 3hjz s LEU 245 Ca -0.02 -0.01 -0.16 0.00 -1.03 0.00 0.00 54.13 52.91 3hjz s LEU 245 Cb -0.02 -0.22 -0.04 0.00 0.03 0.00 0.00 46.19 45.94 3hjz s LEU 245 CO -0.04 -0.15 0.40 -0.89 0.23 0.00 0.00 176.35 175.90 3hjz s THR 246 N 1.43 5.16 -0.05 5.49 2.01 0.12 -1.61 115.64 128.20 3hjz s THR 246 Ca -0.04 0.65 0.02 0.00 0.31 0.00 0.00 61.69 62.62 3hjz s THR 246 Cb -0.13 -3.73 0.02 0.00 0.01 0.00 0.00 72.50 68.67 3hjz s THR 246 CO -0.03 0.16 -0.07 -0.63 -0.69 0.00 0.00 174.62 173.36 3hjz s ILE 247 N 1.97 0.74 0.24 1.82 1.01 0.34 -4.30 121.20 123.02 3hjz s ILE 247 Ca 0.17 -0.26 -0.30 0.00 0.00 0.00 0.00 60.65 60.26 3hjz s ILE 247 Cb -0.16 -0.72 -0.14 0.00 0.01 0.00 0.00 42.46 41.45 3hjz s ILE 247 CO 0.09 0.26 1.17 0.00 0.00 0.00 0.00 174.94 176.46 3hjz n ALA 248 N 3.87 -0.05 -0.34 9.38 0.00 -1.26 -0.14 120.51 131.97 3hjz n ALA 248 Ca -0.24 0.42 0.20 0.00 0.00 0.00 0.00 53.44 53.82 3hjz n ALA 248 Cb 0.51 -2.09 0.43 0.00 0.00 0.00 0.00 19.45 18.30 3hjz n ALA 248 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 3hjz h PRO 249 N 3.00 0.49 -0.15 0.00 0.11 -1.95 0.25 132.00 133.75 3hjz h PRO 249 Ca -0.42 -0.03 -0.07 0.00 0.11 0.00 0.00 66.00 65.59 3hjz h PRO 249 Cb 1.32 -0.11 -0.01 0.00 0.11 0.00 0.00 31.00 32.31 3hjz h PRO 249 CO 0.67 0.33 -0.21 1.57 -0.21 0.00 0.00 178.00 180.15 3hjz h LYS 250 N 0.51 0.25 -0.16 1.05 2.10 -1.97 -1.24 116.57 117.10 3hjz h LYS 250 Ca 0.64 -0.08 -0.20 0.00 -2.00 0.00 0.00 60.65 59.02 3hjz h LYS 250 Cb 1.36 -0.03 0.00 0.00 -0.90 0.00 0.00 32.23 32.66 3hjz h LYS 250 CO -0.44 0.46 -0.70 0.74 -2.00 0.00 0.00 179.45 177.52 3hjz h PHE 251 N 0.23 0.88 -0.25 0.07 0.04 -1.34 -1.34 116.94 115.23 3hjz h PHE 251 Ca 0.04 -0.37 0.06 0.00 2.80 0.00 0.00 57.97 60.50 3hjz h PHE 251 Cb 0.52 -0.14 -0.06 0.00 2.20 0.00 0.00 35.95 38.46 3hjz h PHE 251 CO 0.01 1.17 -0.13 -0.07 -0.60 0.00 0.00 178.31 178.68 3hjz h LEU 252 N 0.47 -0.43 -0.68 1.54 4.07 -0.78 0.19 115.31 119.69 3hjz h LEU 252 Ca -0.03 0.10 0.02 0.00 0.08 0.00 0.00 57.88 58.05 3hjz h LEU 252 Cb 1.30 0.24 -0.04 0.00 1.08 0.00 0.00 40.66 43.24 3hjz h LEU 252 CO 0.14 -0.17 0.43 -0.33 -1.08 0.00 0.00 178.44 177.43 3hjz h GLU 253 N -0.10 0.83 -0.49 1.13 5.08 -1.07 -2.09 114.58 117.86 3hjz h GLU 253 Ca 0.13 -0.05 -0.06 0.00 -1.00 0.00 0.00 59.36 58.38 3hjz h GLU 253 Cb 0.30 -0.19 -0.02 0.00 0.50 0.00 0.00 28.75 29.35 3hjz h GLU 253 CO -0.31 0.55 0.06 1.49 -1.00 0.00 0.00 179.01 179.80 3hjz h GLU 254 N 0.86 0.83 -0.94 2.33 4.57 -0.87 -1.75 114.58 119.61 3hjz h GLU 254 Ca 0.26 -0.23 0.02 0.00 -1.18 0.00 0.00 59.36 58.22 3hjz h GLU 254 Cb -0.03 -0.09 -0.05 0.00 -0.16 0.00 0.00 28.75 28.42 3hjz h GLU 254 CO -0.09 0.84 0.62 -0.07 -1.18 0.00 0.00 179.01 179.14 3hjz h LEU 255 N 0.70 1.07 -0.93 1.64 3.38 -0.86 -1.57 115.31 118.74 3hjz h LEU 255 Ca 0.15 -0.02 -0.09 0.00 0.09 0.00 0.00 57.88 58.01 3hjz h LEU 255 Cb 0.43 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.90 3hjz h LEU 255 CO 0.01 0.76 -0.15 0.50 0.09 0.00 0.00 178.44 179.66 3hjz h LYS 256 N 1.26 0.61 -0.14 1.13 3.64 -1.14 -1.77 116.57 120.15 3hjz h LYS 256 Ca 0.35 -0.20 -0.09 0.00 -1.27 0.00 0.00 60.65 59.44 3hjz h LYS 256 Cb -0.11 -0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 31.65 3hjz h LYS 256 CO -0.09 0.74 -0.32 -0.09 -2.27 0.00 0.00 179.45 177.43 3hjz h ARG 257 N 0.56 0.27 -6.97 1.90 2.43 -0.83 -3.44 114.38 108.30 3hjz h ARG 257 Ca 0.09 -0.11 -0.47 0.00 -0.81 0.00 0.00 59.98 58.69 3hjz h ARG 257 Cb 0.58 -0.01 -0.00 0.00 -0.42 0.00 0.00 29.97 30.11 3hjz h ARG 257 CO 0.04 0.57 0.37 -1.21 -1.51 0.00 0.00 179.97 178.22 3hjz s GLU 258 N -4.34 4.31 0.43 0.20 2.02 -0.63 -5.00 118.70 115.69 3hjz s GLU 258 Ca -0.05 1.34 0.06 0.00 0.02 0.00 0.00 54.97 56.34 3hjz s GLU 258 Cb 0.14 -2.52 -0.06 0.00 0.10 0.00 0.00 34.13 31.79 3hjz s GLU 258 CO 0.76 0.02 0.06 -1.59 0.02 0.00 0.00 175.26 174.53 3hjz s LYS 259 N -2.55 2.07 0.00 1.61 -2.85 -1.26 -2.11 119.74 114.64 3hjz s LYS 259 Ca 0.57 -2.10 0.00 0.00 -1.00 0.00 0.00 55.97 53.43 3hjz s LYS 259 Cb -0.17 -1.71 0.00 0.00 -2.06 0.00 0.00 37.83 33.89 3hjz s LYS 259 CO 0.22 -0.14 0.00 0.41 0.10 0.00 0.00 175.35 175.94 3hjz n GLY 260 N -1.10 0.51 3.19 0.59 0.00 -1.26 -4.87 105.19 102.24 3hjz n GLY 260 Ca -0.07 -1.99 -0.33 0.00 0.00 0.00 0.00 46.02 43.64 3hjz n GLY 260 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3hjz s VAL 261 N -1.23 2.18 -0.24 1.61 1.01 -1.26 -4.79 120.40 117.68 3hjz s VAL 261 Ca 0.00 -0.94 -0.07 0.00 0.00 0.00 0.00 61.98 60.97 3hjz s VAL 261 Cb 0.00 -1.88 -0.03 0.00 0.00 0.00 0.00 36.38 34.47 3hjz s VAL 261 CO 0.00 0.54 0.07 -0.22 0.00 0.00 0.00 175.10 175.49 3hjz s LEU 262 N 0.78 3.47 -0.02 3.92 2.96 -1.26 -5.09 118.68 123.44 3hjz s LEU 262 Ca -0.08 -0.18 -0.27 0.00 -0.22 0.00 0.00 54.13 53.39 3hjz s LEU 262 Cb -0.16 -1.93 -0.04 0.00 0.50 0.00 0.00 46.19 44.57 3hjz s LEU 262 CO -0.01 -0.01 0.83 -0.63 -1.32 0.00 0.00 176.35 175.21 3hjz s ILE 263 N 1.50 4.91 -0.87 6.68 -1.09 -1.26 -4.98 121.20 126.08 3hjz s ILE 263 Ca 0.06 1.75 -0.25 0.00 -2.23 0.00 0.00 60.65 59.98 3hjz s ILE 263 Cb -0.15 -4.18 -0.03 0.00 -1.58 0.00 0.00 42.46 36.52 3hjz s ILE 263 CO 0.04 0.23 1.87 -0.60 -1.23 0.00 0.00 174.94 175.25 3hjz s ARG 264 N 0.72 2.68 0.09 2.79 3.52 -1.26 -4.68 118.95 122.81 3hjz s ARG 264 Ca 0.44 -0.26 -0.08 0.00 -0.13 0.00 0.00 55.73 55.70 3hjz s ARG 264 Cb -0.20 -4.99 -0.22 0.00 -1.56 0.00 0.00 34.95 27.98 3hjz s ARG 264 CO 0.23 -3.15 1.18 0.87 -0.81 0.00 0.00 175.30 173.63 3hjz h LYS 265 N 11.59 0.44 -5.31 5.12 1.57 -1.71 -3.39 116.57 124.89 3hjz h LYS 265 Ca 0.05 -0.59 -0.67 0.00 -1.87 0.00 0.00 60.65 57.58 3hjz h LYS 265 Cb 1.03 0.19 -0.16 0.00 0.08 0.00 0.00 32.23 33.38 3hjz h LYS 265 CO 1.24 1.24 1.04 -0.51 -0.57 0.00 0.00 179.45 181.88 3hjz s LEU 266 N -7.59 4.64 -0.03 2.94 1.02 -0.66 -4.75 118.68 114.25 3hjz s LEU 266 Ca -0.06 -1.92 0.05 0.00 0.02 0.00 0.00 54.13 52.21 3hjz s LEU 266 Cb 0.07 -2.45 0.07 0.00 0.02 0.00 0.00 46.19 43.91 3hjz s LEU 266 CO 0.90 -1.17 0.95 -0.90 0.02 0.00 0.00 176.35 176.15 3hjz n ASP 267 N 7.15 0.73 -4.78 2.29 5.75 -1.26 -4.35 116.55 122.08 3hjz n ASP 267 Ca 0.27 -2.10 -0.34 0.00 -0.01 0.00 0.00 54.79 52.62 3hjz n ASP 267 Cb 0.49 -0.21 0.01 0.00 -1.03 0.00 0.00 41.12 40.39 3hjz n ASP 267 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3hjz s ALA 268 N -0.78 2.67 0.29 2.12 0.00 -1.26 -5.07 121.76 119.73 3hjz s ALA 268 Ca 0.08 0.59 0.03 0.00 0.00 0.00 0.00 51.96 52.65 3hjz s ALA 268 Cb 0.07 -3.29 -0.04 0.00 0.00 0.00 0.00 23.12 19.85 3hjz s ALA 268 CO 0.01 -0.85 0.15 -1.54 0.00 0.00 0.00 175.76 173.52 3hjz s SER 269 N -2.33 1.40 0.31 0.00 1.04 -1.26 -4.80 113.70 108.07 3hjz s SER 269 Ca 0.68 -1.52 -0.29 0.00 0.48 0.00 0.00 55.95 55.30 3hjz s SER 269 Cb -0.19 0.35 -0.13 0.00 0.10 0.00 0.00 66.02 66.15 3hjz s SER 269 CO 0.33 -0.86 1.28 0.41 0.98 0.00 0.00 173.24 175.38 3hjz n THR 270 N -0.55 1.75 -4.62 2.02 -1.04 -1.07 -3.63 114.28 107.13 3hjz n THR 270 Ca 0.01 -0.44 -0.25 0.00 -2.04 0.00 0.00 64.05 61.34 3hjz n THR 270 Cb 0.65 -1.47 -0.14 0.00 -1.82 0.00 0.00 70.33 67.55 3hjz n THR 270 CO 0.00 0.00 0.00 -0.54 -0.64 0.00 0.00 175.07 173.89 3hjz s LYS 271 N -1.48 1.34 -0.26 -2.82 1.02 0.42 -4.93 119.74 113.03 3hjz s LYS 271 Ca 0.59 -0.90 -0.01 0.00 0.02 0.00 0.00 55.97 55.68 3hjz s LYS 271 Cb -0.61 -1.43 0.04 0.00 -0.52 0.00 0.00 37.83 35.31 3hjz s LYS 271 CO 0.59 0.37 -0.06 0.42 -0.92 0.00 0.00 175.35 175.74 3hjz s ILE 272 N -0.78 2.70 0.24 2.17 1.01 -1.26 -4.71 121.20 120.57 3hjz s ILE 272 Ca 0.07 -1.25 -0.11 0.00 0.00 0.00 0.00 60.65 59.36 3hjz s ILE 272 Cb -0.09 -2.45 0.04 0.00 0.01 0.00 0.00 42.46 39.97 3hjz s ILE 272 CO 0.02 0.09 0.58 -0.46 0.00 0.00 0.00 174.94 175.17 3hjz n ASN 273 N 4.60 -1.51 -1.21 3.58 0.23 -1.26 -5.07 115.26 114.62 3hjz n ASN 273 Ca -0.15 -2.00 0.07 0.00 -0.53 0.00 0.00 54.58 51.97 3hjz n ASN 273 Cb 0.45 2.51 0.26 0.00 -2.08 0.00 0.00 39.78 40.92 3hjz n ASN 273 CO 0.00 0.00 0.00 -0.46 -0.93 0.00 0.00 177.26 175.87 3hjz n ASN 274 N -1.31 3.53 -4.73 0.53 6.94 -1.26 -4.96 115.26 113.99 3hjz n ASN 274 Ca -0.05 -2.29 -0.35 0.00 -0.02 0.00 0.00 54.58 51.87 3hjz n ASN 274 Cb 0.41 -0.48 0.07 0.00 -2.36 0.00 0.00 39.78 37.43 3hjz n ASN 274 CO 0.00 0.00 0.00 -0.94 -1.03 0.00 0.00 177.26 175.29 3hjz s SER 275 N -0.81 4.54 0.36 0.53 1.04 -1.26 -4.93 113.70 113.18 3hjz s SER 275 Ca 0.37 2.36 -0.28 0.00 0.48 0.00 0.00 55.95 58.88 3hjz s SER 275 Cb 0.23 -2.59 -0.10 0.00 0.10 0.00 0.00 66.02 63.67 3hjz s SER 275 CO 0.19 -2.03 1.31 -0.63 0.98 0.00 0.00 173.24 173.06 3hjz s ILE 276 N -1.87 2.64 -0.51 -1.02 -1.09 -1.26 -4.99 121.20 113.10 3hjz s ILE 276 Ca 0.75 0.62 -0.20 0.00 -2.23 0.00 0.00 60.65 59.59 3hjz s ILE 276 Cb -0.29 -3.38 0.05 0.00 -1.58 0.00 0.00 42.46 37.26 3hjz s ILE 276 CO 0.42 0.12 0.69 -1.81 -1.23 0.00 0.00 174.94 173.13 3hjz s ASP 277 N -0.57 6.25 0.31 3.58 1.01 -1.26 -5.06 116.67 120.92 3hjz s ASP 277 Ca 0.52 -0.77 -0.29 0.00 0.71 0.00 0.00 52.55 52.73 3hjz s ASP 277 Cb -0.39 -2.32 -0.10 0.00 1.01 0.00 0.00 42.92 41.12 3hjz s ASP 277 CO 0.52 -0.96 1.17 -0.31 0.21 0.00 0.00 175.17 175.80 3hjz s TYR 278 N 2.91 3.37 0.02 4.23 2.02 -1.26 -5.04 117.35 123.59 3hjz s TYR 278 Ca 0.19 1.60 0.04 0.00 -0.37 0.00 0.00 57.07 58.53 3hjz s TYR 278 Cb -0.18 -3.41 -0.02 0.00 -0.40 0.00 0.00 41.96 37.96 3hjz s TYR 278 CO 0.14 -1.00 -0.12 0.15 -1.57 0.00 0.00 175.55 173.15 3hjz s LYS 279 N -1.65 0.86 -0.34 -0.62 -0.14 -1.26 -4.97 119.74 111.62 3hjz s LYS 279 Ca 0.47 -0.59 0.01 0.00 -1.36 0.00 0.00 55.97 54.50 3hjz s LYS 279 Cb -0.34 -0.83 0.10 0.00 -1.68 0.00 0.00 37.83 35.09 3hjz s LYS 279 CO 0.44 0.21 0.10 -0.06 -0.76 0.00 0.00 175.35 175.29 3hjz s PHE 280 N -0.63 2.33 0.93 3.18 0.40 -1.26 -5.00 117.98 117.94 3hjz s PHE 280 Ca 0.02 -2.20 -0.15 0.00 -0.60 0.00 0.00 56.93 54.00 3hjz s PHE 280 Cb -0.06 -2.09 0.18 0.00 0.51 0.00 0.00 43.02 41.56 3hjz s PHE 280 CO 0.00 -0.88 1.29 -1.21 0.70 0.00 0.00 175.22 175.12 3hjz s GLU 281 N 1.23 0.88 0.19 0.44 0.41 -1.26 -4.59 118.70 116.00 3hjz s GLU 281 Ca 0.11 -0.34 -0.16 0.00 -0.41 0.00 0.00 54.97 54.17 3hjz s GLU 281 Cb -0.19 -1.87 0.17 0.00 -1.78 0.00 0.00 34.13 30.46 3hjz s GLU 281 CO -0.17 -2.26 1.62 1.49 -0.49 0.00 0.00 175.26 175.45 3hjz h GLU 282 N -1.52 -0.06 -0.32 1.61 4.81 -1.99 -0.41 114.58 116.70 3hjz h GLU 282 Ca -0.45 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.79 3hjz h GLU 282 Cb 1.25 0.01 -0.02 0.00 0.63 0.00 0.00 28.75 30.63 3hjz h GLU 282 CO 0.43 -0.04 0.20 -0.22 -0.73 0.00 0.00 179.01 178.65 3hjz h LYS 283 N -0.06 0.42 -0.86 1.92 3.64 -1.99 -0.78 116.57 118.86 3hjz h LYS 283 Ca 0.26 -0.03 -0.03 0.00 -1.27 0.00 0.00 60.65 59.57 3hjz h LYS 283 Cb 0.46 -0.09 -0.04 0.00 -0.41 0.00 0.00 32.23 32.15 3hjz h LYS 283 CO -0.59 0.30 0.42 -0.44 -2.27 0.00 0.00 179.45 176.88 3hjz h ASP 284 N 0.42 1.12 0.12 4.20 3.32 -1.70 -1.44 116.42 122.46 3hjz h ASP 284 Ca 0.11 -0.13 0.00 0.00 0.02 0.00 0.00 57.03 57.04 3hjz h ASP 284 Cb -0.02 -0.29 -0.01 0.00 0.22 0.00 0.00 39.33 39.24 3hjz h ASP 284 CO -0.02 0.93 -0.10 0.15 -1.72 0.00 0.00 179.24 178.48 3hjz h PHE 285 N 1.22 -0.25 -0.33 4.55 3.57 -0.84 0.03 116.94 124.90 3hjz h PHE 285 Ca 0.30 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.80 3hjz h PHE 285 Cb 0.10 0.10 -0.02 0.00 2.79 0.00 0.00 35.95 38.92 3hjz h PHE 285 CO 0.01 -0.15 0.21 0.00 -2.23 0.00 0.00 178.31 176.15 3hjz h ARG 286 N -0.23 0.44 -0.35 1.11 3.08 -0.95 -2.95 114.38 114.53 3hjz h ARG 286 Ca -0.00 -0.03 -0.00 0.00 0.07 0.00 0.00 59.98 60.01 3hjz h ARG 286 Cb 0.21 -0.10 -0.02 0.00 0.08 0.00 0.00 29.97 30.15 3hjz h ARG 286 CO -0.01 0.31 0.20 -0.07 -1.07 0.00 0.00 179.97 179.33 3hjz h LEU 287 N 0.43 0.43 -1.60 3.04 3.38 -1.22 -0.31 115.31 119.46 3hjz h LEU 287 Ca 0.12 -0.07 0.00 0.00 0.09 0.00 0.00 57.88 58.02 3hjz h LEU 287 Cb -0.03 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 40.62 3hjz h LEU 287 CO -0.02 0.37 0.00 -1.20 0.09 0.00 0.00 178.44 177.67 3hjz n SER 288 N -4.79 0.23 0.00 -0.43 7.64 -0.01 -1.83 113.62 114.43 3hjz n SER 288 Ca -0.01 -0.21 0.00 0.00 1.01 0.00 0.00 58.87 59.67 3hjz n SER 288 Cb 0.06 -0.05 0.00 0.00 -1.01 0.00 0.00 64.21 63.21 3hjz n SER 288 CO 0.00 0.00 0.00 -0.11 -3.01 0.00 0.00 175.04 171.92 3hjz n LEU 290 N 0.75 0.00 0.24 -3.43 7.94 -0.13 -2.22 117.00 120.15 3hjz n LEU 290 Ca 0.00 0.00 0.14 0.00 -1.11 0.00 0.00 56.01 55.04 3hjz n LEU 290 Cb 0.04 0.00 0.36 0.00 0.53 0.00 0.00 43.42 44.35 3hjz n LEU 290 CO 0.00 0.00 0.86 -0.33 -1.11 0.00 0.00 177.39 176.81 3hjz h GLU 291 N 0.00 0.00 -3.83 1.96 4.39 -1.63 -3.39 114.58 112.08 3hjz h GLU 291 Ca 0.00 0.00 -0.79 0.00 0.34 0.00 0.00 59.36 58.91 3hjz h GLU 291 Cb 0.00 0.00 -0.26 0.00 -0.10 0.00 0.00 28.75 28.39 3hjz h GLU 291 CO 0.00 0.02 0.08 0.34 -1.16 0.00 0.00 179.01 178.29 3hjz s ASP 292 N -6.03 6.71 0.00 1.42 -1.08 -0.94 -5.07 116.67 111.67 3hjz s ASP 292 Ca 0.05 -2.68 0.00 0.00 -0.52 0.00 0.00 52.55 49.40 3hjz s ASP 292 Cb 0.07 -2.20 0.00 0.00 -1.46 0.00 0.00 42.92 39.33 3hjz s ASP 292 CO 0.63 -0.57 0.06 1.67 0.52 0.00 0.00 175.17 177.47 3hjz n GLN 293 N 3.99 0.07 0.00 4.34 7.27 -1.26 -1.26 117.38 130.52 3hjz n GLN 293 Ca 0.13 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.20 3hjz n GLN 293 Cb 0.47 -1.40 0.00 0.00 2.41 0.00 0.00 30.24 31.71 3hjz n GLN 293 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 3hjz n ALA 295 N 0.89 0.00 0.18 1.69 0.00 -1.26 -1.37 120.51 120.65 3hjz n ALA 295 Ca 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 53.44 53.30 3hjz n ALA 295 Cb 0.03 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.41 3hjz n ALA 295 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 3hjz h SER 296 N 0.00 -0.73 -0.43 0.00 0.02 -1.58 -0.25 113.55 110.57 3hjz h SER 296 Ca 0.00 0.07 -0.03 0.00 -0.84 0.00 0.00 61.79 60.99 3hjz h SER 296 Cb 0.00 0.25 -0.02 0.00 0.14 0.00 0.00 62.40 62.77 3hjz h SER 296 CO 0.00 -0.40 0.17 -0.33 -1.14 0.00 0.00 176.83 175.13 3hjz h GLU 297 N -0.58 0.65 -0.23 3.45 5.08 -1.46 0.08 114.58 121.57 3hjz h GLU 297 Ca -0.01 -0.12 -0.12 0.00 -1.00 0.00 0.00 59.36 58.11 3hjz h GLU 297 Cb 0.53 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.67 3hjz h GLU 297 CO -0.06 0.61 -0.36 0.87 -1.00 0.00 0.00 179.01 179.07 3hjz h LYS 298 N 0.56 0.51 -0.14 2.33 1.79 -1.77 0.11 116.57 119.96 3hjz h LYS 298 Ca 0.14 -0.24 -0.00 0.00 -2.18 0.00 0.00 60.65 58.38 3hjz h LYS 298 Cb 0.21 -0.01 -0.01 0.00 -1.58 0.00 0.00 32.23 30.84 3hjz h LYS 298 CO -0.01 0.80 0.08 1.25 -1.08 0.00 0.00 179.45 180.49 3hjz h LEU 299 N 0.43 0.17 -0.16 2.94 5.85 -0.85 -0.72 115.31 122.97 3hjz h LEU 299 Ca 0.05 -0.06 -0.05 0.00 0.84 0.00 0.00 57.88 58.66 3hjz h LEU 299 Cb 0.83 -0.04 -0.00 0.00 0.37 0.00 0.00 40.66 41.81 3hjz h LEU 299 CO 0.07 0.18 -0.08 0.77 -0.34 0.00 0.00 178.44 179.04 3hjz h SER 300 N 0.15 0.34 -0.53 1.25 4.64 -0.71 -1.49 113.55 117.20 3hjz h SER 300 Ca 0.05 -0.41 0.10 0.00 -0.47 0.00 0.00 61.79 61.06 3hjz h SER 300 Cb 0.04 -0.09 -0.08 0.00 -0.31 0.00 0.00 62.40 61.96 3hjz h SER 300 CO -0.01 0.68 0.08 -0.08 -0.87 0.00 0.00 176.83 176.63 3hjz h GLU 301 N 0.01 0.21 -0.48 4.77 4.81 -0.85 -1.24 114.58 121.81 3hjz h GLU 301 Ca 0.04 -0.01 -0.02 0.00 -0.13 0.00 0.00 59.36 59.23 3hjz h GLU 301 Cb 0.55 -0.05 -0.02 0.00 0.63 0.00 0.00 28.75 29.86 3hjz h GLU 301 CO 0.02 0.14 0.21 0.78 -0.73 0.00 0.00 179.01 179.43 3hjz h GLY 302 N 0.21 0.76 1.00 1.92 0.00 -0.94 -0.37 103.07 105.65 3hjz h GLY 302 Ca 0.27 -0.40 0.00 0.00 0.00 0.00 0.00 47.33 47.21 3hjz h GLY 302 CO -0.38 0.38 0.25 -2.22 0.00 0.00 0.00 176.54 174.57 3hjz h ILE 303 N 0.63 1.10 -0.57 2.60 2.04 -1.10 -0.02 117.51 122.20 3hjz h ILE 303 Ca 0.16 -0.20 0.04 0.00 1.00 0.00 0.00 64.86 65.86 3hjz h ILE 303 Cb 0.16 0.56 -0.04 0.00 -0.74 0.00 0.00 36.82 36.76 3hjz h ILE 303 CO -0.02 0.10 0.32 0.74 0.00 0.00 0.00 178.15 179.30 3hjz h THR 304 N 0.51 1.02 -0.62 -0.27 2.02 -0.92 0.85 112.91 115.51 3hjz h THR 304 Ca 0.14 -0.22 -0.01 0.00 0.77 0.00 0.00 66.41 67.09 3hjz h THR 304 Cb -0.05 0.33 -0.03 0.00 -1.74 0.00 0.00 68.15 66.67 3hjz h THR 304 CO -0.03 0.12 0.35 1.23 0.37 0.00 0.00 175.52 177.55 3hjz h GLY 305 N 0.63 0.91 1.04 2.16 0.00 -0.74 0.30 103.07 107.36 3hjz h GLY 305 Ca 0.24 -0.41 -0.06 0.00 0.00 0.00 0.00 47.33 47.11 3hjz h GLY 305 CO -0.13 0.39 0.19 0.74 0.00 0.00 0.00 176.54 177.73 3hjz h PHE 306 N 0.84 1.09 -0.49 5.60 -1.00 -0.58 -2.30 116.94 120.09 3hjz h PHE 306 Ca 0.22 -0.12 -0.09 0.00 2.81 0.00 0.00 57.97 60.79 3hjz h PHE 306 Cb 0.03 -0.31 -0.02 0.00 3.61 0.00 0.00 35.95 39.26 3hjz h PHE 306 CO -0.01 0.89 -0.05 0.77 -1.61 0.00 0.00 178.31 178.29 3hjz h SER 307 N 0.97 0.90 -0.48 2.17 0.02 -0.35 -1.65 113.55 115.14 3hjz h SER 307 Ca 0.21 -0.33 0.04 0.00 -0.84 0.00 0.00 61.79 60.87 3hjz h SER 307 Cb 0.33 -0.24 -0.04 0.00 0.14 0.00 0.00 62.40 62.58 3hjz h SER 307 CO -0.00 1.02 0.24 0.50 -1.14 0.00 0.00 176.83 177.44 3hjz h LYS 308 N 0.76 0.46 -0.46 3.45 3.64 -0.27 -1.20 116.57 122.95 3hjz h LYS 308 Ca 0.13 -0.03 -0.09 0.00 -1.27 0.00 0.00 60.65 59.39 3hjz h LYS 308 Cb 0.59 -0.10 -0.02 0.00 -0.41 0.00 0.00 32.23 32.29 3hjz h LYS 308 CO 0.04 0.30 -0.09 0.00 -2.27 0.00 0.00 179.45 177.43 3hjz h ALA 309 N 1.26 0.99 -0.14 5.00 0.00 -1.12 0.03 119.26 125.28 3hjz h ALA 309 Ca 0.21 -0.31 -0.12 0.00 0.00 0.00 0.00 54.91 54.69 3hjz h ALA 309 Cb 0.12 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 3hjz h ALA 309 CO -0.15 0.60 -0.43 0.97 0.00 0.00 0.00 179.25 180.25 3hjz h ILE 310 N 0.74 1.31 -0.74 0.00 2.10 -1.08 -1.06 117.51 118.78 3hjz h ILE 310 Ca 0.13 -1.58 -0.06 0.00 1.08 0.00 0.00 64.86 64.43 3hjz h ILE 310 Cb 0.57 1.68 -0.03 0.00 -1.09 0.00 0.00 36.82 37.95 3hjz h ILE 310 CO 0.03 0.48 0.25 -0.33 -1.08 0.00 0.00 178.15 177.50 3hjz h GLU 311 N 0.28 1.14 -0.47 2.19 5.08 -0.72 -1.37 114.58 120.71 3hjz h GLU 311 Ca 0.02 -0.24 -0.07 0.00 -1.00 0.00 0.00 59.36 58.08 3hjz h GLU 311 Cb 0.87 -0.17 -0.02 0.00 0.50 0.00 0.00 28.75 29.93 3hjz h GLU 311 CO 0.07 0.97 0.02 0.93 -1.00 0.00 0.00 179.01 180.00 3hjz h GLU 312 N 1.09 0.76 -0.32 2.33 5.08 -0.72 -1.87 114.58 120.94 3hjz h GLU 312 Ca 0.24 -0.19 0.02 0.00 -1.00 0.00 0.00 59.36 58.44 3hjz h GLU 312 Cb 0.29 -0.10 -0.03 0.00 0.50 0.00 0.00 28.75 29.41 3hjz h GLU 312 CO -0.01 0.75 0.15 1.25 -1.00 0.00 0.00 179.01 180.15 3hjz h LEU 313 N 0.72 0.22 -0.77 1.33 5.85 -0.79 -1.61 115.31 120.26 3hjz h LEU 313 Ca 0.15 0.02 0.06 0.00 0.84 0.00 0.00 57.88 58.94 3hjz h LEU 313 Cb 0.40 -0.02 -0.06 0.00 0.37 0.00 0.00 40.66 41.35 3hjz h LEU 313 CO 0.01 0.16 0.46 -0.33 -0.34 0.00 0.00 178.44 178.41 3hjz h GLU 314 N 0.32 0.82 -0.84 1.25 5.08 -0.88 -0.35 114.58 119.98 3hjz h GLU 314 Ca 0.13 -0.05 -0.03 0.00 -1.00 0.00 0.00 59.36 58.41 3hjz h GLU 314 Cb 0.06 -0.19 -0.04 0.00 0.50 0.00 0.00 28.75 29.08 3hjz h GLU 314 CO -0.10 0.54 0.39 0.93 -1.00 0.00 0.00 179.01 179.77 3hjz h GLU 315 N 0.85 1.22 -0.47 2.33 4.39 -1.05 -1.66 114.58 120.18 3hjz h GLU 315 Ca 0.34 -0.19 -0.04 0.00 0.34 0.00 0.00 59.36 59.81 3hjz h GLU 315 Cb 0.16 -0.21 -0.02 0.00 -0.10 0.00 0.00 28.75 28.58 3hjz h GLU 315 CO -0.17 0.94 0.14 1.25 -1.16 0.00 0.00 179.01 180.01 3hjz h LEU 316 N 1.20 0.69 -0.89 1.33 5.85 -0.49 -1.70 115.31 121.30 3hjz h LEU 316 Ca 0.29 -0.21 -0.02 0.00 0.84 0.00 0.00 57.88 58.78 3hjz h LEU 316 Cb 0.14 -0.18 -0.04 0.00 0.37 0.00 0.00 40.66 40.95 3hjz h LEU 316 CO -0.03 0.72 0.49 -0.07 -0.34 0.00 0.00 178.44 179.21 3hjz h LEU 317 N 0.63 1.11 -0.55 2.25 3.38 -0.87 0.10 115.31 121.35 3hjz h LEU 317 Ca 0.15 -0.10 0.04 0.00 0.09 0.00 0.00 57.88 58.06 3hjz h LEU 317 Cb 0.29 -0.28 -0.04 0.00 0.09 0.00 0.00 40.66 40.71 3hjz h LEU 317 CO -0.00 0.88 0.31 0.40 0.09 0.00 0.00 178.44 180.12 3hjz h ILE 318 N 1.24 0.99 -0.56 1.22 2.04 -1.12 -1.18 117.51 120.14 3hjz h ILE 318 Ca 0.31 -0.20 -0.07 0.00 1.00 0.00 0.00 64.86 65.90 3hjz h ILE 318 Cb 0.02 0.35 -0.02 0.00 -0.74 0.00 0.00 36.82 36.43 3hjz h ILE 318 CO -0.05 0.11 0.05 -0.33 0.00 0.00 0.00 178.15 177.93 3hjz h GLU 319 N 0.59 0.91 -0.55 2.37 5.08 -0.39 -2.22 114.58 120.38 3hjz h GLU 319 Ca 0.24 -0.24 -0.10 0.00 -1.00 0.00 0.00 59.36 58.26 3hjz h GLU 319 Cb 0.11 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.23 3hjz h GLU 319 CO -0.14 0.87 -0.05 0.00 -1.00 0.00 0.00 179.01 178.69 3hjz h ARG 320 N 0.86 1.01 -0.15 2.33 2.47 -0.64 -2.24 114.38 118.01 3hjz h ARG 320 Ca 0.17 -0.35 0.02 0.00 -1.26 0.00 0.00 59.98 58.56 3hjz h ARG 320 Cb 0.43 -0.08 -0.02 0.00 -1.65 0.00 0.00 29.97 28.66 3hjz h ARG 320 CO 0.01 1.03 0.04 1.25 0.56 0.00 0.00 179.97 182.87 3hjz h LEU 321 N 0.88 0.04 -0.11 3.04 5.85 -1.02 -2.77 115.31 121.22 3hjz h LEU 321 Ca 0.15 0.02 0.02 0.00 0.84 0.00 0.00 57.88 58.91 3hjz h LEU 321 Cb 0.61 0.02 -0.02 0.00 0.37 0.00 0.00 40.66 41.63 3hjz h LEU 321 CO 0.04 0.05 -0.04 -1.28 -0.34 0.00 0.00 178.44 176.87 3hjz h SER 322 N 0.11 -0.13 0.00 1.25 0.87 -1.40 -0.45 113.55 113.80 3hjz h SER 322 Ca 0.06 0.04 0.00 0.00 -1.23 0.00 0.00 61.79 60.66 3hjz h SER 322 Cb 0.05 0.08 0.00 0.00 -0.44 0.00 0.00 62.40 62.08 3hjz h SER 322 CO -0.07 -0.05 0.00 -0.62 -0.53 0.00 0.00 176.83 175.56 3hjz n GLU 323 N -5.16 0.00 0.00 2.24 -0.58 -0.84 -1.14 120.64 115.15 3hjz n GLU 323 Ca -0.04 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.70 3hjz n GLU 323 Cb 0.09 -1.14 0.00 0.00 -0.57 0.00 0.00 31.44 29.82 3hjz n GLU 323 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 3hjz n LYS 325 N 0.66 0.00 -0.06 3.49 5.02 -0.18 -0.84 118.16 126.25 3hjz n LYS 325 Ca 0.00 0.00 -0.07 0.00 -2.02 0.00 0.00 58.31 56.22 3hjz n LYS 325 Cb 0.00 0.00 -0.01 0.00 -0.02 0.00 0.00 35.03 35.00 3hjz n LYS 325 CO 0.00 0.00 0.00 -0.97 -0.52 0.00 0.00 177.40 175.91 3hjz h ASN 326 N 0.00 -0.13 -0.62 4.39 -0.73 -1.39 -1.95 115.58 115.15 3hjz h ASN 326 Ca 0.00 0.06 0.11 0.00 1.87 0.00 0.00 56.30 58.34 3hjz h ASN 326 Cb 0.00 0.11 -0.08 0.00 0.27 0.00 0.00 38.32 38.62 3hjz h ASN 326 CO 0.00 -0.03 0.17 -0.74 -0.37 0.00 0.00 177.43 176.46 3hjz h HIS 327 N 0.06 0.28 -0.57 0.67 2.76 -1.25 -1.97 115.15 115.14 3hjz h HIS 327 Ca 0.12 0.03 0.02 0.00 -2.20 0.00 0.00 60.37 58.34 3hjz h HIS 327 Cb 0.17 -0.03 -0.03 0.00 1.55 0.00 0.00 27.41 29.06 3hjz h HIS 327 CO -0.21 0.01 0.36 0.87 -1.30 0.00 0.00 177.93 177.66 3hjz h LYS 328 N 0.31 0.71 0.00 5.26 1.57 -1.72 -2.45 116.57 120.25 3hjz h LYS 328 Ca 0.32 -0.04 -0.06 0.00 -1.87 0.00 0.00 60.65 59.00 3hjz h LYS 328 Cb 0.46 -0.16 -0.01 0.00 0.08 0.00 0.00 32.23 32.60 3hjz h LYS 328 CO -0.38 0.47 -0.29 -0.07 -0.57 0.00 0.00 179.45 178.61 3hjz h LEU 329 N 0.73 0.00 -2.05 2.94 3.38 -0.78 -3.12 115.31 116.42 3hjz h LEU 329 Ca 0.22 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.19 3hjz h LEU 329 Cb -0.04 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.71 3hjz h LEU 329 CO -0.07 0.29 0.00 2.30 0.09 0.00 0.00 178.44 181.05 3hjz n ILE 330 N -3.88 0.30 -4.31 1.22 -5.35 -0.80 -4.97 119.36 101.57 3hjz n ILE 330 Ca -0.02 -0.65 -0.33 0.00 -0.27 0.00 0.00 62.75 61.49 3hjz n ILE 330 Cb 0.37 1.12 -0.09 0.00 -1.74 0.00 0.00 39.64 39.30 3hjz n ILE 330 CO 0.00 0.00 0.00 -0.44 -1.76 0.00 0.00 176.55 174.35 3hjz s SER 331 N -1.38 5.06 0.00 7.28 0.01 -0.93 -5.08 113.70 118.66 3hjz s SER 331 Ca 0.27 -0.02 0.00 0.00 1.31 0.00 0.00 55.95 57.51 3hjz s SER 331 Cb 0.17 -1.31 0.00 0.00 0.21 0.00 0.00 66.02 65.09 3hjz s SER 331 CO 0.24 0.28 0.40 0.00 0.41 0.00 0.00 173.24 174.57