#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jg6 h ASN 2 N 0.00 0.37 -0.42 6.12 -1.24 -1.95 -1.88 115.58 116.59 2jg6 h ASN 2 Ca 0.00 0.01 0.03 0.00 0.71 0.00 0.00 56.30 57.05 2jg6 h ASN 2 Cb 0.00 -0.07 -0.03 0.00 0.73 0.00 0.00 38.32 38.94 2jg6 h ASN 2 CO 0.00 0.27 0.21 -0.08 -1.29 0.00 0.00 177.43 176.54 2jg6 h GLU 3 N 0.47 0.41 -0.87 6.67 4.81 -1.97 -0.94 114.58 123.17 2jg6 h GLU 3 Ca 0.16 -0.02 -0.03 0.00 -0.13 0.00 0.00 59.36 59.34 2jg6 h GLU 3 Cb 0.02 -0.09 -0.04 0.00 0.63 0.00 0.00 28.75 29.27 2jg6 h GLU 3 CO -0.08 0.27 0.43 0.00 -0.73 0.00 0.00 179.01 178.90 2jg6 n ALA 5 N -2.42 3.51 -1.97 0.00 0.00 -0.73 -4.83 120.51 114.07 2jg6 n ALA 5 Ca 0.09 -0.70 -0.21 0.00 0.00 0.00 0.00 53.44 52.62 2jg6 n ALA 5 Cb 0.13 -1.12 -0.05 0.00 0.00 0.00 0.00 19.45 18.41 2jg6 n ALA 5 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 2jg6 n PHE 6 N 0.30 -0.46 -1.27 0.00 3.72 -1.06 -1.79 117.46 116.90 2jg6 n PHE 6 Ca 0.14 0.00 -0.09 0.00 -0.05 0.00 0.00 57.45 57.45 2jg6 n PHE 6 Cb 0.72 -3.73 -0.04 0.00 -0.94 0.00 0.00 39.48 35.49 2jg6 n PHE 6 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2jg6 n GLY 7 N -0.68 1.04 3.72 1.37 0.00 -0.39 -4.98 105.19 105.26 2jg6 n GLY 7 Ca -0.23 -0.28 -0.41 0.00 0.00 0.00 0.00 46.02 45.10 2jg6 n GLY 7 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2jg6 s THR 8 N -2.15 4.77 -0.09 2.61 2.01 -0.74 -4.95 115.64 117.09 2jg6 s THR 8 Ca 0.00 1.99 0.21 0.00 0.31 0.00 0.00 61.69 64.19 2jg6 s THR 8 Cb 0.00 -4.29 -0.28 0.00 0.01 0.00 0.00 72.50 67.94 2jg6 s THR 8 CO 0.00 0.23 0.44 0.29 -0.69 0.00 0.00 174.62 174.88 2jg6 n LYS 9 N 3.50 0.66 -1.71 4.92 4.76 -1.26 -4.82 118.16 124.21 2jg6 n LYS 9 Ca 0.04 -0.10 -0.42 0.00 -2.87 0.00 0.00 58.31 54.96 2jg6 n LYS 9 Cb 0.50 -1.56 -0.03 0.00 -1.84 0.00 0.00 35.03 32.10 2jg6 n LYS 9 CO 0.00 0.00 0.00 0.34 -1.37 0.00 0.00 177.40 176.37 2jg6 s ASP 10 N -4.92 6.45 0.33 4.39 -1.08 -1.26 -4.86 116.67 115.74 2jg6 s ASP 10 Ca -0.08 2.68 0.26 0.00 -0.52 0.00 0.00 52.55 54.90 2jg6 s ASP 10 Cb 0.11 -2.55 1.00 0.00 -1.46 0.00 0.00 42.92 40.03 2jg6 s ASP 10 CO 0.87 -1.02 1.78 1.55 0.52 0.00 0.00 175.17 178.87 2jg6 h PRO 11 N 9.68 0.00 -0.51 4.34 0.13 -1.98 -1.34 132.00 142.32 2jg6 h PRO 11 Ca -0.47 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 64.62 2jg6 h PRO 11 Cb 1.23 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.33 2jg6 h PRO 11 CO 0.94 0.00 0.17 0.28 -0.23 0.00 0.00 178.00 179.17 2jg6 h VAL 12 N 0.00 1.23 -0.40 1.56 2.07 -2.00 0.16 116.25 118.87 2jg6 h VAL 12 Ca 0.00 -0.74 -0.06 0.00 0.82 0.00 0.00 66.70 66.72 2jg6 h VAL 12 Cb 0.51 0.75 -0.01 0.00 -1.52 0.00 0.00 31.29 31.02 2jg6 h VAL 12 CO 0.00 0.27 -0.00 0.22 0.02 0.00 0.00 177.57 178.08 2jg6 h TYR 13 N 0.69 0.77 -0.67 1.57 3.20 -1.74 -2.91 116.97 117.89 2jg6 h TYR 13 Ca 0.17 -0.13 -0.01 0.00 3.14 0.00 0.00 58.73 61.89 2jg6 h TYR 13 Cb 0.25 -0.20 -0.03 0.00 1.54 0.00 0.00 36.73 38.29 2jg6 h TYR 13 CO 0.01 0.79 0.39 -0.07 -1.64 0.00 0.00 178.16 177.64 2jg6 h LEU 14 N 0.54 0.80 -0.59 2.82 3.38 -1.11 -0.64 115.31 120.50 2jg6 h LEU 14 Ca 0.11 -0.05 0.08 0.00 0.09 0.00 0.00 57.88 58.11 2jg6 h LEU 14 Cb 0.48 -0.20 -0.06 0.00 0.09 0.00 0.00 40.66 40.96 2jg6 h LEU 14 CO 0.02 0.63 0.25 -1.13 0.09 0.00 0.00 178.44 178.31 2jg6 h ASN 15 N 0.92 0.31 -0.43 -0.43 -0.73 -0.56 0.32 115.58 114.97 2jg6 h ASN 15 Ca 0.24 0.06 -0.01 0.00 1.87 0.00 0.00 56.30 58.46 2jg6 h ASN 15 Cb -0.01 0.01 -0.02 0.00 0.27 0.00 0.00 38.32 38.57 2jg6 h ASN 15 CO -0.04 0.19 0.25 0.22 -0.37 0.00 0.00 177.43 177.68 2jg6 h TYR 16 N 0.47 0.58 -0.89 0.67 3.20 -1.07 -0.17 116.97 119.75 2jg6 h TYR 16 Ca 0.29 -0.01 -0.02 0.00 3.14 0.00 0.00 58.73 62.13 2jg6 h TYR 16 Cb 0.29 -0.19 -0.04 0.00 1.54 0.00 0.00 36.73 38.34 2jg6 h TYR 16 CO -0.14 0.42 0.49 1.25 -1.64 0.00 0.00 178.16 178.54 2jg6 h HIS 17 N 0.56 1.23 0.01 -3.82 2.76 -0.46 0.76 115.15 116.19 2jg6 h HIS 17 Ca 0.15 -0.03 -0.21 0.00 -2.20 0.00 0.00 60.37 58.08 2jg6 h HIS 17 Cb 0.02 -0.39 -0.03 0.00 1.55 0.00 0.00 27.41 28.57 2jg6 h HIS 17 CO -0.03 0.85 -0.99 -0.44 -1.30 0.00 0.00 177.93 176.02 2jg6 h ASP 18 N 1.25 0.04 0.00 3.26 3.32 -0.13 -3.37 116.42 120.79 2jg6 h ASP 18 Ca 0.31 -0.04 0.00 0.00 0.02 0.00 0.00 57.03 57.32 2jg6 h ASP 18 Cb 0.02 -0.01 0.00 0.00 0.22 0.00 0.00 39.33 39.56 2jg6 h ASP 18 CO -0.05 1.00 0.00 1.41 -1.72 0.00 0.00 179.24 179.88 2jg6 n HIS 19 N -3.41 0.00 0.11 4.55 8.25 -0.10 -4.91 115.22 119.71 2jg6 n HIS 19 Ca -0.01 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.45 2jg6 n HIS 19 Cb 0.92 0.00 0.00 0.00 1.12 0.00 0.00 29.99 32.03 2jg6 n HIS 19 CO 0.00 0.00 0.00 0.28 0.64 0.00 0.00 176.34 177.26 2jg6 n VAL 20 N -0.06 0.28 -1.68 1.59 0.31 -0.63 -4.97 118.33 113.16 2jg6 n VAL 20 Ca 0.00 0.09 -0.48 0.00 -0.01 0.00 0.00 64.34 63.94 2jg6 n VAL 20 Cb 0.08 -0.71 -0.05 0.00 -0.91 0.00 0.00 33.84 32.25 2jg6 n VAL 20 CO 0.00 0.00 0.00 1.87 -1.32 0.00 0.00 176.83 177.38 2jg6 n TRP 21 N -3.36 2.29 -0.51 3.52 -0.00 0.17 -1.53 117.44 118.01 2jg6 n TRP 21 Ca 0.00 0.11 0.00 0.00 -0.00 0.00 0.00 57.50 57.61 2jg6 n TRP 21 Cb 0.00 -2.61 0.00 0.00 -0.00 0.00 0.00 31.31 28.70 2jg6 n TRP 21 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 177.69 178.10 2jg6 n GLY 22 N 4.01 1.66 3.66 5.87 0.00 -0.41 -4.85 105.19 115.13 2jg6 n GLY 22 Ca 0.21 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.81 2jg6 n GLY 22 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2jg6 s GLN 23 N -0.11 4.24 -0.21 1.61 -1.52 -0.58 -4.30 119.66 118.78 2jg6 s GLN 23 Ca 0.00 0.99 -0.38 0.00 -1.95 0.00 0.00 55.36 54.02 2jg6 s GLN 23 Cb 0.00 -3.61 -0.15 0.00 -0.22 0.00 0.00 33.01 29.03 2jg6 s GLN 23 CO 0.00 -0.43 1.76 -2.30 -0.25 0.00 0.00 175.29 174.07 2jg6 n PRO 24 N 5.66 1.44 -3.92 2.91 -0.02 -1.26 -4.12 135.00 135.69 2jg6 n PRO 24 Ca 0.05 0.53 -0.35 0.00 -2.02 0.00 0.00 63.50 61.71 2jg6 n PRO 24 Cb 0.48 -2.25 -0.14 0.00 -0.02 0.00 0.00 33.50 31.57 2jg6 n PRO 24 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 2jg6 s LEU 25 N 3.50 3.33 0.00 2.45 2.96 -0.24 -4.98 118.68 125.69 2jg6 s LEU 25 Ca 0.96 -0.86 0.14 0.00 -0.22 0.00 0.00 54.13 54.15 2jg6 s LEU 25 Cb -0.96 -1.70 -0.11 0.00 0.50 0.00 0.00 46.19 43.91 2jg6 s LEU 25 CO 0.61 -0.14 0.64 -1.22 -1.32 0.00 0.00 176.35 174.91 2jg6 n TYR 26 N 4.70 0.00 -2.72 5.38 4.01 -1.26 -4.89 117.16 122.38 2jg6 n TYR 26 Ca -0.16 0.00 -0.42 0.00 -0.16 0.00 0.00 57.90 57.16 2jg6 n TYR 26 Cb 0.47 0.00 -0.03 0.00 -0.31 0.00 0.00 39.34 39.47 2jg6 n TYR 26 CO 0.00 0.00 0.00 0.34 -0.46 0.00 0.00 176.86 176.74 2jg6 s ASP 27 N -2.17 7.19 0.15 7.72 2.15 -1.26 -4.77 116.67 125.68 2jg6 s ASP 27 Ca 0.07 1.46 -0.19 0.00 0.43 0.00 0.00 52.55 54.32 2jg6 s ASP 27 Cb 0.11 -2.54 0.04 0.00 -0.30 0.00 0.00 42.92 40.23 2jg6 s ASP 27 CO 0.52 -0.45 1.68 0.28 -0.17 0.00 0.00 175.17 177.02 2jg6 h SER 28 N 7.15 -0.36 -0.33 -0.34 0.02 -1.95 -0.59 113.55 117.15 2jg6 h SER 28 Ca -0.30 0.10 -0.09 0.00 -0.84 0.00 0.00 61.79 60.66 2jg6 h SER 28 Cb 1.14 0.22 -0.02 0.00 0.14 0.00 0.00 62.40 63.88 2jg6 h SER 28 CO 0.86 -0.13 -0.10 0.11 -1.14 0.00 0.00 176.83 176.42 2jg6 h LYS 29 N -0.04 0.76 -0.44 3.45 1.57 -1.95 -1.55 116.57 118.37 2jg6 h LYS 29 Ca 0.15 -0.25 -0.13 0.00 -1.87 0.00 0.00 60.65 58.56 2jg6 h LYS 29 Cb 0.27 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.50 2jg6 h LYS 29 CO -0.33 0.84 -0.22 0.00 -0.57 0.00 0.00 179.45 179.17 2jg6 h ALA 30 N 1.19 0.77 -0.51 3.86 0.00 -1.87 -1.64 119.26 121.07 2jg6 h ALA 30 Ca 0.12 -0.39 0.01 0.00 0.00 0.00 0.00 54.91 54.65 2jg6 h ALA 30 Cb 0.57 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 18.18 2jg6 h ALA 30 CO 0.04 0.66 0.33 -0.07 0.00 0.00 0.00 179.25 180.21 2jg6 h LEU 31 N 0.78 0.57 -0.49 0.00 3.38 -0.82 -1.57 115.31 117.16 2jg6 h LEU 31 Ca 0.10 -0.01 0.02 0.00 0.09 0.00 0.00 57.88 58.08 2jg6 h LEU 31 Cb 0.77 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 41.35 2jg6 h LEU 31 CO 0.06 0.41 0.30 0.15 0.09 0.00 0.00 178.44 179.45 2jg6 h PHE 32 N 0.68 0.56 -0.32 1.13 3.57 -0.98 -0.65 116.94 120.94 2jg6 h PHE 32 Ca 0.19 0.02 -0.00 0.00 3.53 0.00 0.00 57.97 61.71 2jg6 h PHE 32 Cb -0.06 -0.18 -0.02 0.00 2.79 0.00 0.00 35.95 38.48 2jg6 h PHE 32 CO -0.04 0.33 0.19 -0.22 -2.23 0.00 0.00 178.31 176.34 2jg6 h LYS 33 N 0.60 0.43 -0.45 1.11 3.64 -1.12 0.13 116.57 120.91 2jg6 h LYS 33 Ca 0.19 -0.04 -0.02 0.00 -1.27 0.00 0.00 60.65 59.51 2jg6 h LYS 33 Cb -0.01 -0.09 -0.02 0.00 -0.41 0.00 0.00 32.23 31.70 2jg6 h LYS 33 CO -0.08 0.32 0.19 1.25 -2.27 0.00 0.00 179.45 178.87 2jg6 h LEU 34 N 0.41 0.60 -0.30 5.20 5.85 -1.03 -0.34 115.31 125.71 2jg6 h LEU 34 Ca 0.11 -0.15 0.01 0.00 0.84 0.00 0.00 57.88 58.69 2jg6 h LEU 34 Cb 0.00 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 40.86 2jg6 h LEU 34 CO -0.02 0.59 0.19 0.25 -0.34 0.00 0.00 178.44 179.10 2jg6 h LEU 35 N 0.58 0.32 -0.30 2.25 5.85 -0.89 0.22 115.31 123.34 2jg6 h LEU 35 Ca 0.15 -0.01 0.01 0.00 0.84 0.00 0.00 57.88 58.87 2jg6 h LEU 35 Cb 0.16 -0.08 -0.02 0.00 0.37 0.00 0.00 40.66 41.10 2jg6 h LEU 35 CO -0.02 0.23 0.19 0.00 -0.34 0.00 0.00 178.44 178.50 2jg6 h ALA 36 N 1.11 0.37 -0.53 1.25 0.00 -0.48 -1.49 119.26 119.50 2jg6 h ALA 36 Ca 0.11 -0.01 -0.09 0.00 0.00 0.00 0.00 54.91 54.92 2jg6 h ALA 36 Cb -0.03 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 2jg6 h ALA 36 CO -0.03 -0.18 -0.01 -0.07 0.00 0.00 0.00 179.25 178.96 2jg6 h LEU 37 N 0.38 0.88 -1.20 0.00 3.38 -0.94 -2.39 115.31 115.42 2jg6 h LEU 37 Ca 0.11 -0.23 0.08 0.00 0.09 0.00 0.00 57.88 57.93 2jg6 h LEU 37 Cb -0.02 -0.23 -0.06 0.00 0.09 0.00 0.00 40.66 40.43 2jg6 h LEU 37 CO -0.04 0.95 0.57 -0.08 0.09 0.00 0.00 178.44 179.93 2jg6 h GLU 38 N 0.83 0.90 0.00 1.13 4.57 -0.58 -0.83 114.58 120.60 2jg6 h GLU 38 Ca 0.15 -0.05 0.00 0.00 -1.18 0.00 0.00 59.36 58.28 2jg6 h GLU 38 Cb 0.52 -0.20 0.00 0.00 -0.16 0.00 0.00 28.75 28.90 2jg6 h GLU 38 CO 0.03 0.60 0.00 0.66 -1.18 0.00 0.00 179.01 179.11 2jg6 h SER 39 N 0.93 0.00 0.64 1.04 4.64 -0.74 -2.02 113.55 118.03 2jg6 h SER 39 Ca 0.39 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.71 2jg6 h SER 39 Cb 0.30 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.39 2jg6 h SER 39 CO -0.15 0.00 -0.38 0.00 -0.87 0.00 0.00 176.83 175.43 2jg6 n GLN 40 N -2.83 0.01 -0.34 4.77 1.13 -0.32 -4.29 117.38 115.50 2jg6 n GLN 40 Ca -0.01 0.00 -0.02 0.00 -1.94 0.00 0.00 57.00 55.03 2jg6 n GLN 40 Cb 0.17 -1.51 0.12 0.00 0.11 0.00 0.00 30.24 29.13 2jg6 n GLN 40 CO 0.00 0.00 0.00 1.25 -1.44 0.00 0.00 177.06 176.87 2jg6 h HIS 41 N 0.00 1.22 -1.08 1.08 2.76 -1.34 -3.46 115.15 114.32 2jg6 h HIS 41 Ca 0.00 0.01 -0.84 0.00 -2.20 0.00 0.00 60.37 57.33 2jg6 h HIS 41 Cb 0.51 -0.40 0.01 0.00 1.55 0.00 0.00 27.41 29.07 2jg6 h HIS 41 CO 0.00 0.80 0.77 0.00 -1.30 0.00 0.00 177.93 178.20 2jg6 n ALA 42 N -2.40 -1.01 -1.08 5.26 0.00 -1.26 -1.10 120.51 118.93 2jg6 n ALA 42 Ca 0.11 0.46 -0.03 0.00 0.00 0.00 0.00 53.44 53.98 2jg6 n ALA 42 Cb 0.05 -2.00 -0.01 0.00 0.00 0.00 0.00 19.45 17.48 2jg6 n ALA 42 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2jg6 n GLY 43 N 4.22 0.59 3.21 0.00 0.00 -1.26 -5.01 105.19 106.94 2jg6 n GLY 43 Ca 0.31 -0.48 -0.12 0.00 0.00 0.00 0.00 46.02 45.73 2jg6 n GLY 43 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2jg6 s LEU 44 N -0.61 2.09 0.39 0.99 1.43 -0.26 -5.15 118.68 117.55 2jg6 s LEU 44 Ca 0.00 -1.16 -0.24 0.00 -1.03 0.00 0.00 54.13 51.71 2jg6 s LEU 44 Cb 0.00 0.04 -0.10 0.00 0.03 0.00 0.00 46.19 46.16 2jg6 s LEU 44 CO 0.00 -0.60 0.97 -0.94 0.23 0.00 0.00 176.35 176.02 2jg6 s SER 45 N -3.12 7.02 0.33 2.29 1.04 -1.26 -4.96 113.70 115.03 2jg6 s SER 45 Ca 0.22 1.83 0.01 0.00 0.48 0.00 0.00 55.95 58.49 2jg6 s SER 45 Cb 0.06 -2.57 0.57 0.00 0.10 0.00 0.00 66.02 64.19 2jg6 s SER 45 CO 0.02 -0.30 1.98 -0.25 0.98 0.00 0.00 173.24 175.67 2jg6 h TRP 46 N 2.49 0.90 -0.99 5.02 -0.00 -2.00 -1.63 115.95 119.74 2jg6 h TRP 46 Ca -0.48 0.02 0.18 0.00 -0.00 0.00 0.00 58.89 58.61 2jg6 h TRP 46 Cb 1.19 -0.30 -0.10 0.00 -0.00 0.00 0.00 29.16 29.95 2jg6 h TRP 46 CO 0.61 0.55 0.60 1.25 -0.00 0.00 0.00 178.44 181.44 2jg6 h LEU 47 N 0.95 0.77 -0.69 0.65 5.85 -1.99 -0.22 115.31 120.64 2jg6 h LEU 47 Ca 0.28 0.09 0.10 0.00 0.84 0.00 0.00 57.88 59.19 2jg6 h LEU 47 Cb -0.05 -0.04 -0.07 0.00 0.37 0.00 0.00 40.66 40.86 2jg6 h LEU 47 CO -0.07 0.28 0.31 0.74 -0.34 0.00 0.00 178.44 179.37 2jg6 h THR 48 N 0.76 0.81 -0.08 1.05 2.02 -1.68 -1.47 112.91 114.31 2jg6 h THR 48 Ca 0.56 -0.18 -0.24 0.00 0.77 0.00 0.00 66.41 67.32 2jg6 h THR 48 Cb 0.85 0.23 0.01 0.00 -1.74 0.00 0.00 68.15 67.51 2jg6 h THR 48 CO -0.38 0.10 -0.90 0.40 0.37 0.00 0.00 175.52 175.11 2jg6 h ILE 49 N 0.53 1.29 -0.92 3.11 1.08 -1.22 -3.16 117.51 118.22 2jg6 h ILE 49 Ca 0.34 -2.12 0.03 0.00 -0.39 0.00 0.00 64.86 62.73 2jg6 h ILE 49 Cb 0.40 2.17 -0.05 0.00 -3.07 0.00 0.00 36.82 36.27 2jg6 h ILE 49 CO -0.29 0.66 0.60 -0.07 -0.69 0.00 0.00 178.15 178.36 2jg6 h LEU 50 N 0.45 1.00 -0.88 1.44 3.38 -0.67 -0.63 115.31 119.40 2jg6 h LEU 50 Ca -0.09 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.87 2jg6 h LEU 50 Cb 1.53 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 42.05 2jg6 h LEU 50 CO 0.18 0.70 0.00 0.11 0.09 0.00 0.00 178.44 179.51 2jg6 h LYS 51 N 1.17 0.00 -0.03 1.13 1.57 -1.33 -2.88 116.57 116.19 2jg6 h LYS 51 Ca 0.36 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.14 2jg6 h LYS 51 Cb -0.03 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.28 2jg6 h LYS 51 CO -0.11 0.00 0.00 1.63 -0.57 0.00 0.00 179.45 180.40 2jg6 n LYS 52 N -2.90 2.06 -0.19 3.15 5.02 -0.52 -4.65 118.16 120.14 2jg6 n LYS 52 Ca 0.02 -1.82 -0.00 0.00 -2.02 0.00 0.00 58.31 54.49 2jg6 n LYS 52 Cb 0.36 -1.42 0.10 0.00 -0.02 0.00 0.00 35.03 34.04 2jg6 n LYS 52 CO 0.00 0.00 0.00 -0.22 -0.52 0.00 0.00 177.40 176.66 2jg6 h LYS 53 N 4.33 0.22 -0.30 1.97 3.64 -0.94 -0.22 116.57 125.27 2jg6 h LYS 53 Ca 0.00 -0.01 -0.07 0.00 -1.27 0.00 0.00 60.65 59.29 2jg6 h LYS 53 Cb 0.92 -0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 32.67 2jg6 h LYS 53 CO 0.00 0.15 -0.12 0.93 -2.27 0.00 0.00 179.45 178.14 2jg6 h GLU 54 N 0.23 0.51 -0.44 1.90 5.08 -1.83 -0.64 114.58 119.39 2jg6 h GLU 54 Ca 0.30 -0.15 -0.05 0.00 -1.00 0.00 0.00 59.36 58.46 2jg6 h GLU 54 Cb 0.44 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.62 2jg6 h GLU 54 CO -0.40 0.63 0.10 0.00 -1.00 0.00 0.00 179.01 178.33 2jg6 h ALA 55 N 1.40 0.58 -0.88 3.43 0.00 -1.53 -1.95 119.26 120.31 2jg6 h ALA 55 Ca 0.09 -0.21 0.03 0.00 0.00 0.00 0.00 54.91 54.82 2jg6 h ALA 55 Cb 0.49 -0.17 -0.05 0.00 0.00 0.00 0.00 17.79 18.07 2jg6 h ALA 55 CO 0.03 0.28 0.58 1.88 0.00 0.00 0.00 179.25 182.01 2jg6 h TYR 56 N 0.58 1.08 -0.64 0.00 0.05 -0.48 -0.35 116.97 117.22 2jg6 h TYR 56 Ca 0.14 0.03 0.02 0.00 0.05 0.00 0.00 58.73 58.97 2jg6 h TYR 56 Cb 0.34 -0.36 -0.04 0.00 1.01 0.00 0.00 36.73 37.68 2jg6 h TYR 56 CO 0.02 0.64 0.40 0.93 -1.05 0.00 0.00 178.16 179.10 2jg6 h GLU 57 N 1.14 0.77 -0.03 4.88 5.08 -0.93 -0.22 114.58 125.27 2jg6 h GLU 57 Ca 0.34 -0.05 -0.10 0.00 -1.00 0.00 0.00 59.36 58.56 2jg6 h GLU 57 Cb -0.04 -0.17 -0.01 0.00 0.50 0.00 0.00 28.75 29.02 2jg6 h GLU 57 CO -0.10 0.51 -0.46 0.93 -1.00 0.00 0.00 179.01 178.89 2jg6 h GLU 58 N 0.79 0.07 -0.00 2.33 5.08 -0.87 0.12 114.58 122.10 2jg6 h GLU 58 Ca 0.25 -0.03 -0.16 0.00 -1.00 0.00 0.00 59.36 58.41 2jg6 h GLU 58 Cb -0.01 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.22 2jg6 h GLU 58 CO -0.09 0.51 -0.78 0.00 -1.00 0.00 0.00 179.01 177.65 2jg6 h ALA 59 N 1.48 0.70 -0.54 3.43 0.00 -0.30 -3.38 119.26 120.66 2jg6 h ALA 59 Ca 0.00 -0.71 -0.39 0.00 0.00 0.00 0.00 54.91 53.81 2jg6 h ALA 59 Cb 0.83 -0.12 -0.36 0.00 0.00 0.00 0.00 17.79 18.14 2jg6 h ALA 59 CO 0.06 0.98 -0.84 1.19 0.00 0.00 0.00 179.25 180.64 2jg6 n PHE 60 N -3.61 1.92 -3.35 0.00 3.72 -0.17 -4.98 117.46 111.00 2jg6 n PHE 60 Ca -0.01 -2.02 -0.24 0.00 -0.05 0.00 0.00 57.45 55.13 2jg6 n PHE 60 Cb 0.76 -0.30 0.02 0.00 -0.94 0.00 0.00 39.48 39.02 2jg6 n PHE 60 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 2jg6 n TYR 61 N -0.69 -2.03 -2.21 1.38 4.01 -1.07 -0.39 117.16 116.16 2jg6 n TYR 61 Ca 0.31 0.61 -0.19 0.00 -0.16 0.00 0.00 57.90 58.47 2jg6 n TYR 61 Cb 0.90 -3.87 -0.02 0.00 -0.31 0.00 0.00 39.34 36.04 2jg6 n TYR 61 CO 0.00 0.00 0.00 -3.47 -0.46 0.00 0.00 176.86 172.93 2jg6 n ASP 62 N -2.53 -5.48 -2.48 7.72 -0.08 0.39 -1.89 116.55 112.20 2jg6 n ASP 62 Ca -0.04 0.07 -0.16 0.00 -1.51 0.00 0.00 54.79 53.15 2jg6 n ASP 62 Cb 0.57 -4.55 -0.01 0.00 2.34 0.00 0.00 41.12 39.47 2jg6 n ASP 62 CO 0.00 0.00 0.00 0.49 0.12 0.00 0.00 177.20 177.81 2jg6 n PHE 63 N -3.72 -1.29 -2.25 -0.67 3.72 0.48 -4.94 117.46 108.79 2jg6 n PHE 63 Ca -0.22 0.03 -0.43 0.00 -0.05 0.00 0.00 57.45 56.78 2jg6 n PHE 63 Cb 0.66 -3.28 -0.02 0.00 -0.94 0.00 0.00 39.48 35.90 2jg6 n PHE 63 CO 0.00 0.00 0.00 -2.00 -0.05 0.00 0.00 176.76 174.71 2jg6 s GLU 64 N -5.09 3.58 0.24 -1.08 2.56 -0.79 -4.70 118.70 113.41 2jg6 s GLU 64 Ca 0.02 1.17 -0.05 0.00 0.00 0.00 0.00 54.97 56.11 2jg6 s GLU 64 Cb -0.01 -4.05 0.35 0.00 2.00 0.00 0.00 34.13 32.42 2jg6 s GLU 64 CO 0.03 -1.56 1.82 -1.35 -0.56 0.00 0.00 175.26 173.64 2jg6 h PRO 65 N 11.08 0.79 -0.58 4.30 0.11 -1.92 -0.40 132.00 145.39 2jg6 h PRO 65 Ca -0.30 -0.05 0.04 0.00 0.11 0.00 0.00 66.00 65.80 2jg6 h PRO 65 Cb 1.12 -0.18 -0.03 0.00 0.11 0.00 0.00 31.00 32.02 2jg6 h PRO 65 CO 1.06 0.52 0.38 0.93 -0.21 0.00 0.00 178.00 180.68 2jg6 h GLU 66 N 0.82 0.63 0.14 1.05 4.39 -1.91 0.24 114.58 119.93 2jg6 h GLU 66 Ca 0.37 -0.04 -0.19 0.00 0.34 0.00 0.00 59.36 59.85 2jg6 h GLU 66 Cb 0.28 -0.14 0.02 0.00 -0.10 0.00 0.00 28.75 28.81 2jg6 h GLU 66 CO -0.22 0.42 -0.83 0.87 -1.16 0.00 0.00 179.01 178.09 2jg6 h LYS 67 N 0.65 0.30 -0.83 2.33 1.57 -1.70 -3.33 116.57 115.56 2jg6 h LYS 67 Ca 0.23 -0.52 -0.02 0.00 -1.87 0.00 0.00 60.65 58.47 2jg6 h LYS 67 Cb 0.12 0.19 -0.04 0.00 0.08 0.00 0.00 32.23 32.58 2jg6 h LYS 67 CO -0.06 1.25 0.43 0.28 -0.57 0.00 0.00 179.45 180.78 2jg6 h VAL 68 N -0.36 1.25 -0.06 0.50 2.07 -0.91 -2.91 116.25 115.83 2jg6 h VAL 68 Ca -0.15 -0.66 0.02 0.00 0.82 0.00 0.00 66.70 66.73 2jg6 h VAL 68 Cb 1.65 0.16 -0.00 0.00 -1.52 0.00 0.00 31.29 31.58 2jg6 h VAL 68 CO 0.15 0.29 0.06 0.00 0.02 0.00 0.00 177.57 178.10 2jg6 h ALA 69 N 1.23 1.73 -0.00 1.67 0.00 -1.08 -1.37 119.26 121.44 2jg6 h ALA 69 Ca 0.29 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.20 2jg6 h ALA 69 Cb 0.07 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.87 2jg6 h ALA 69 CO -0.04 -0.09 -0.20 1.04 0.00 0.00 0.00 179.25 179.95 2jg6 n GLN 70 N -4.01 0.46 -2.00 0.00 1.13 -1.10 -4.74 117.38 107.11 2jg6 n GLN 70 Ca -0.01 -0.19 -0.36 0.00 -1.94 0.00 0.00 57.00 54.49 2jg6 n GLN 70 Cb 0.16 -1.50 0.03 0.00 0.11 0.00 0.00 30.24 29.04 2jg6 n GLN 70 CO 0.00 0.00 0.00 -1.64 -1.44 0.00 0.00 177.06 173.98 2jg6 s MET 71 N -2.67 3.09 0.46 -1.09 -1.94 -0.52 -5.04 119.30 111.58 2jg6 s MET 71 Ca 0.22 1.89 0.03 0.00 -1.71 0.00 0.00 55.69 56.12 2jg6 s MET 71 Cb 0.19 -2.04 -0.01 0.00 2.01 0.00 0.00 34.83 34.98 2jg6 s MET 71 CO 0.54 -1.13 0.10 0.95 -0.01 0.00 0.00 175.02 175.47 2jg6 s THR 72 N -1.53 0.68 0.50 2.05 -4.23 -1.26 -4.99 115.64 106.86 2jg6 s THR 72 Ca 0.75 -2.00 0.24 0.00 -1.18 0.00 0.00 61.69 59.50 2jg6 s THR 72 Cb -0.32 -2.20 0.41 0.00 1.34 0.00 0.00 72.50 71.73 2jg6 s THR 72 CO 0.36 0.00 1.94 0.00 -0.54 0.00 0.00 174.62 176.38 2jg6 h ALA 73 N 1.58 2.47 -0.42 3.99 0.00 -1.99 -0.11 119.26 124.77 2jg6 h ALA 73 Ca -0.37 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.50 2jg6 h ALA 73 Cb 1.29 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 19.08 2jg6 h ALA 73 CO 0.60 -0.67 0.17 0.37 0.00 0.00 0.00 179.25 179.73 2jg6 h GLN 74 N 0.13 0.63 -0.36 0.00 4.15 -1.99 0.27 115.11 117.94 2jg6 h GLN 74 Ca 0.34 -0.11 -0.01 0.00 0.77 0.00 0.00 58.65 59.63 2jg6 h GLN 74 Cb 1.15 -0.10 -0.02 0.00 0.21 0.00 0.00 27.48 28.72 2jg6 h GLN 74 CO -0.04 0.59 0.19 -0.44 -1.93 0.00 0.00 178.83 177.19 2jg6 h ASP 75 N 0.54 0.47 -0.83 -0.69 3.32 -1.43 -2.63 116.42 115.17 2jg6 h ASP 75 Ca 0.14 -0.11 -0.03 0.00 0.02 0.00 0.00 57.03 57.05 2jg6 h ASP 75 Cb 0.19 -0.12 -0.04 0.00 0.22 0.00 0.00 39.33 39.58 2jg6 h ASP 75 CO -0.01 0.44 0.41 0.40 -1.72 0.00 0.00 179.24 178.76 2jg6 h ILE 76 N 0.46 1.25 -0.66 0.35 1.08 -0.90 -0.13 117.51 118.96 2jg6 h ILE 76 Ca 0.13 -0.70 0.11 0.00 -0.39 0.00 0.00 64.86 64.01 2jg6 h ILE 76 Cb 0.09 0.19 -0.08 0.00 -3.07 0.00 0.00 36.82 33.95 2jg6 h ILE 76 CO -0.02 0.30 0.24 0.44 -0.69 0.00 0.00 178.15 178.42 2jg6 h ASP 77 N 1.17 0.21 -0.39 1.72 3.32 -0.36 -0.92 116.42 121.17 2jg6 h ASP 77 Ca 0.29 0.09 -0.06 0.00 0.02 0.00 0.00 57.03 57.37 2jg6 h ASP 77 Cb 0.10 0.08 -0.01 0.00 0.22 0.00 0.00 39.33 39.72 2jg6 h ASP 77 CO -0.04 0.11 0.01 -0.09 -1.72 0.00 0.00 179.24 177.51 2jg6 h ARG 78 N 0.40 0.69 0.00 3.56 2.43 -0.98 -3.16 114.38 117.32 2jg6 h ARG 78 Ca 0.35 -0.22 -0.02 0.00 -0.81 0.00 0.00 59.98 59.28 2jg6 h ARG 78 Cb 0.48 -0.06 -0.00 0.00 -0.42 0.00 0.00 29.97 29.96 2jg6 h ARG 78 CO -0.36 0.78 -0.08 -0.07 -1.51 0.00 0.00 179.97 178.73 2jg6 h LEU 79 N 0.52 0.00 -0.20 3.80 3.38 -0.18 -2.56 115.31 120.07 2jg6 h LEU 79 Ca 0.11 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.08 2jg6 h LEU 79 Cb 0.46 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.21 2jg6 h LEU 79 CO 0.02 0.08 0.00 0.23 0.09 0.00 0.00 178.44 178.86 2jg6 n MET 80 N -3.26 0.03 -0.31 1.13 2.81 -0.43 -1.46 117.12 115.62 2jg6 n MET 80 Ca -0.00 0.42 0.06 0.00 -1.81 0.00 0.00 57.70 56.36 2jg6 n MET 80 Cb 0.31 -1.57 0.09 0.00 -0.71 0.00 0.00 33.22 31.33 2jg6 n MET 80 CO 0.00 0.00 0.00 0.25 1.51 0.00 0.00 175.97 177.73 2jg6 n THR 81 N -1.63 1.18 -2.60 2.03 -2.24 -0.97 -4.87 114.28 105.17 2jg6 n THR 81 Ca 0.01 -1.50 -0.42 0.00 -2.27 0.00 0.00 64.05 59.87 2jg6 n THR 81 Cb 0.08 0.07 -0.03 0.00 -2.10 0.00 0.00 70.33 68.35 2jg6 n THR 81 CO 0.00 0.00 0.00 0.12 -0.57 0.00 0.00 175.07 174.62 2jg6 s PHE 82 N -1.79 3.44 0.39 4.78 5.36 -0.54 -4.98 117.98 124.65 2jg6 s PHE 82 Ca 0.21 1.48 -0.27 0.00 -0.96 0.00 0.00 56.93 57.39 2jg6 s PHE 82 Cb 0.19 -3.27 -0.10 0.00 -0.34 0.00 0.00 43.02 39.51 2jg6 s PHE 82 CO 0.00 -0.60 1.44 -2.14 -1.46 0.00 0.00 175.22 172.46 2jg6 s PRO 83 N 1.75 4.05 -1.05 10.12 0.02 -1.26 -3.66 135.00 144.96 2jg6 s PRO 83 Ca 0.52 2.47 0.00 0.00 0.02 0.00 0.00 61.00 64.01 2jg6 s PRO 83 Cb -0.22 -2.91 0.00 0.00 0.02 0.00 0.00 34.50 31.40 2jg6 s PRO 83 CO 0.22 -0.54 0.00 -1.71 -0.33 0.00 0.00 177.00 174.64 2jg6 n ASN 84 N 0.35 -3.93 -4.47 2.53 5.15 -1.26 -4.94 115.26 108.69 2jg6 n ASN 84 Ca 0.02 0.11 -0.23 0.00 -0.60 0.00 0.00 54.58 53.87 2jg6 n ASN 84 Cb 0.40 -2.86 -0.10 0.00 -0.53 0.00 0.00 39.78 36.69 2jg6 n ASN 84 CO 0.00 0.00 0.00 0.27 1.40 0.00 0.00 177.26 178.93 2jg6 s ILE 85 N -2.50 2.18 -0.22 -1.44 -4.36 -1.24 -4.68 121.20 108.94 2jg6 s ILE 85 Ca 0.00 -2.27 -0.27 0.00 -0.26 0.00 0.00 60.65 57.85 2jg6 s ILE 85 Cb 0.00 -2.40 -0.00 0.00 1.25 0.00 0.00 42.46 41.31 2jg6 s ILE 85 CO 0.00 -0.35 0.93 -0.69 0.24 0.00 0.00 174.94 175.08 2jg6 s VAL 86 N -2.68 4.77 -1.35 8.37 1.01 -1.26 -4.93 120.40 124.33 2jg6 s VAL 86 Ca 0.30 1.81 -0.08 0.00 0.00 0.00 0.00 61.98 64.00 2jg6 s VAL 86 Cb -0.01 -4.22 0.11 0.00 0.00 0.00 0.00 36.38 32.27 2jg6 s VAL 86 CO 0.14 -0.10 2.22 1.41 0.00 0.00 0.00 175.10 178.77 2jg6 n HIS 87 N 5.95 2.80 -3.83 5.22 -0.00 -1.26 -4.83 115.22 119.26 2jg6 n HIS 87 Ca 0.08 -2.85 -0.36 0.00 -0.00 0.00 0.00 57.72 54.59 2jg6 n HIS 87 Cb 0.47 -2.02 -0.13 0.00 -0.00 0.00 0.00 29.99 28.32 2jg6 n HIS 87 CO 0.00 0.00 0.00 -1.58 -0.00 0.00 0.00 176.34 174.76 2jg6 s HIS 88 N 0.24 3.33 0.18 4.41 5.65 -1.26 -5.01 115.29 122.83 2jg6 s HIS 88 Ca 0.49 -1.84 -0.13 0.00 0.25 0.00 0.00 55.06 53.83 2jg6 s HIS 88 Cb 0.14 -2.39 0.14 0.00 -1.18 0.00 0.00 32.58 29.30 2jg6 s HIS 88 CO -0.05 -0.82 1.79 -0.09 -0.65 0.00 0.00 174.74 174.93 2jg6 h ARG 89 N 8.08 0.53 -0.37 2.88 2.43 -1.99 -1.75 114.38 124.18 2jg6 h ARG 89 Ca -0.20 -0.03 -0.05 0.00 -0.81 0.00 0.00 59.98 58.89 2jg6 h ARG 89 Cb 1.06 -0.12 -0.02 0.00 -0.42 0.00 0.00 29.97 30.48 2jg6 h ARG 89 CO 0.59 0.35 0.03 0.87 -1.51 0.00 0.00 179.97 180.30 2jg6 h LYS 90 N 0.55 0.56 -0.49 0.20 1.79 -1.99 -0.58 116.57 116.61 2jg6 h LYS 90 Ca 0.23 -0.11 -0.04 0.00 -2.18 0.00 0.00 60.65 58.55 2jg6 h LYS 90 Cb 0.11 -0.09 -0.02 0.00 -1.58 0.00 0.00 32.23 30.66 2jg6 h LYS 90 CO -0.15 0.56 0.16 0.87 -1.08 0.00 0.00 179.45 179.82 2jg6 h LYS 91 N 0.54 0.76 -0.16 3.15 1.57 -1.74 -1.32 116.57 119.37 2jg6 h LYS 91 Ca 0.12 -0.16 -0.03 0.00 -1.87 0.00 0.00 60.65 58.70 2jg6 h LYS 91 Cb 0.30 -0.11 -0.01 0.00 0.08 0.00 0.00 32.23 32.50 2jg6 h LYS 91 CO 0.01 0.71 -0.03 -0.07 -0.57 0.00 0.00 179.45 179.50 2jg6 h LEU 92 N 0.66 0.31 -1.13 2.94 3.38 -0.92 -2.75 115.31 117.80 2jg6 h LEU 92 Ca 0.16 -0.36 0.13 0.00 0.09 0.00 0.00 57.88 57.90 2jg6 h LEU 92 Cb 0.27 -0.08 -0.08 0.00 0.09 0.00 0.00 40.66 40.85 2jg6 h LEU 92 CO -0.01 0.60 0.60 -0.33 0.09 0.00 0.00 178.44 179.39 2jg6 h GLU 93 N 0.02 0.85 -0.88 1.13 5.08 -1.15 -2.40 114.58 117.22 2jg6 h GLU 93 Ca 0.04 -0.05 0.02 0.00 -1.00 0.00 0.00 59.36 58.38 2jg6 h GLU 93 Cb 0.46 -0.19 -0.05 0.00 0.50 0.00 0.00 28.75 29.47 2jg6 h GLU 93 CO 0.01 0.56 0.58 0.00 -1.00 0.00 0.00 179.01 179.17 2jg6 h ALA 94 N 1.57 1.42 -0.96 3.43 0.00 -0.94 -2.04 119.26 121.74 2jg6 h ALA 94 Ca 0.47 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.33 2jg6 h ALA 94 Cb 0.57 -0.33 -0.05 0.00 0.00 0.00 0.00 17.79 17.98 2jg6 h ALA 94 CO -0.24 0.51 0.61 0.82 0.00 0.00 0.00 179.25 180.96 2jg6 h ILE 95 N 1.14 1.25 -0.28 0.00 2.04 -1.29 0.10 117.51 120.48 2jg6 h ILE 95 Ca 0.34 -0.51 -0.02 0.00 1.00 0.00 0.00 64.86 65.67 2jg6 h ILE 95 Cb -0.04 -0.13 -0.01 0.00 -0.74 0.00 0.00 36.82 35.90 2jg6 h ILE 95 CO -0.09 0.26 0.09 0.58 0.00 0.00 0.00 178.15 178.99 2jg6 h VAL 96 N 1.31 1.19 -0.87 1.67 2.07 -1.42 -1.55 116.25 118.65 2jg6 h VAL 96 Ca 0.35 -0.60 -0.01 0.00 0.82 0.00 0.00 66.70 67.25 2jg6 h VAL 96 Cb -0.11 1.07 -0.04 0.00 -1.52 0.00 0.00 31.29 30.69 2jg6 h VAL 96 CO -0.07 0.20 0.49 0.78 0.02 0.00 0.00 177.57 178.99 2jg6 h ASN 97 N 0.29 1.08 -0.47 0.57 2.35 -0.85 -1.38 115.58 117.17 2jg6 h ASN 97 Ca 0.09 -0.09 0.02 0.00 -0.55 0.00 0.00 56.30 55.77 2jg6 h ASN 97 Cb 0.22 -0.27 -0.03 0.00 0.05 0.00 0.00 38.32 38.29 2jg6 h ASN 97 CO -0.00 0.86 0.29 1.56 -1.65 0.00 0.00 177.43 178.48 2jg6 h GLN 98 N 1.22 0.56 -0.85 0.81 4.20 -0.64 -0.43 115.11 119.96 2jg6 h GLN 98 Ca 0.31 -0.03 -0.01 0.00 0.06 0.00 0.00 58.65 58.97 2jg6 h GLN 98 Cb 0.01 -0.13 -0.04 0.00 0.30 0.00 0.00 27.48 27.62 2jg6 h GLN 98 CO -0.05 0.37 0.49 0.00 -0.67 0.00 0.00 178.83 178.97 2jg6 h ALA 99 N 1.20 1.09 -0.94 3.87 0.00 -0.69 0.89 119.26 124.68 2jg6 h ALA 99 Ca 0.18 -0.11 0.01 0.00 0.00 0.00 0.00 54.91 55.00 2jg6 h ALA 99 Cb -0.01 -0.34 -0.05 0.00 0.00 0.00 0.00 17.79 17.40 2jg6 h ALA 99 CO -0.07 0.58 0.62 1.96 0.00 0.00 0.00 179.25 182.33 2jg6 h GLN 100 N 1.18 1.22 -0.64 0.00 4.20 -1.00 -2.19 115.11 117.88 2jg6 h GLN 100 Ca 0.30 -0.07 -0.09 0.00 0.06 0.00 0.00 58.65 58.85 2jg6 h GLN 100 Cb -0.01 -0.28 -0.02 0.00 0.30 0.00 0.00 27.48 27.47 2jg6 h GLN 100 CO -0.05 0.81 0.05 0.78 -0.67 0.00 0.00 178.83 179.74 2jg6 h GLY 101 N 1.26 1.19 0.82 3.46 0.00 -0.02 -1.95 103.07 107.82 2jg6 h GLY 101 Ca 0.35 -0.84 0.03 0.00 0.00 0.00 0.00 47.33 46.87 2jg6 h GLY 101 CO -0.08 0.77 0.28 -1.82 0.00 0.00 0.00 176.54 175.70 2jg6 h TYR 102 N 1.01 0.53 -0.75 5.60 3.20 -0.61 -0.21 116.97 125.74 2jg6 h TYR 102 Ca 0.19 0.02 -0.03 0.00 3.14 0.00 0.00 58.73 62.04 2jg6 h TYR 102 Cb 0.51 -0.16 -0.03 0.00 1.54 0.00 0.00 36.73 38.58 2jg6 h TYR 102 CO 0.04 0.28 0.33 -0.07 -1.64 0.00 0.00 178.16 177.10 2jg6 h LEU 103 N 0.56 1.00 -0.57 2.82 3.38 -1.11 -0.45 115.31 120.93 2jg6 h LEU 103 Ca 0.21 -0.13 -0.09 0.00 0.09 0.00 0.00 57.88 57.96 2jg6 h LEU 103 Cb 0.07 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.54 2jg6 h LEU 103 CO -0.12 0.86 -0.01 0.11 0.09 0.00 0.00 178.44 179.37 2jg6 h LYS 104 N 1.07 1.02 -0.30 1.13 1.57 -0.83 -0.66 116.57 119.57 2jg6 h LYS 104 Ca 0.26 -0.33 -0.01 0.00 -1.87 0.00 0.00 60.65 58.70 2jg6 h LYS 104 Cb 0.16 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 32.36 2jg6 h LYS 104 CO -0.03 1.02 0.16 0.82 -0.57 0.00 0.00 179.45 180.84 2jg6 h ILE 105 N 0.91 1.14 -0.02 1.86 2.04 -0.70 -1.81 117.51 120.94 2jg6 h ILE 105 Ca 0.16 -0.39 -0.08 0.00 1.00 0.00 0.00 64.86 65.56 2jg6 h ILE 105 Cb 0.56 0.85 -0.01 0.00 -0.74 0.00 0.00 36.82 37.48 2jg6 h ILE 105 CO 0.03 0.14 -0.35 -0.33 0.00 0.00 0.00 178.15 177.64 2jg6 h GLU 106 N 0.36 0.03 -0.60 2.37 5.08 -0.84 0.36 114.58 121.34 2jg6 h GLU 106 Ca 0.10 -0.01 -0.05 0.00 -1.00 0.00 0.00 59.36 58.40 2jg6 h GLU 106 Cb 0.09 -0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.31 2jg6 h GLU 106 CO -0.02 0.38 0.17 1.96 -1.00 0.00 0.00 179.01 180.51 2jg6 h GLN 107 N 0.03 0.94 0.00 2.33 1.08 -0.94 0.68 115.11 119.24 2jg6 h GLN 107 Ca 0.00 -0.21 -0.24 0.00 -1.45 0.00 0.00 58.65 56.75 2jg6 h GLN 107 Cb 0.64 -0.13 -0.04 0.00 -0.05 0.00 0.00 27.48 27.90 2jg6 h GLN 107 CO 0.05 0.85 -1.25 0.00 -0.95 0.00 0.00 178.83 177.53 2jg6 h ALA 108 N 1.05 0.52 0.00 3.87 0.00 -0.58 -3.40 119.26 120.71 2jg6 h ALA 108 Ca 0.19 -1.10 0.00 0.00 0.00 0.00 0.00 54.91 54.01 2jg6 h ALA 108 Cb 0.31 0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.18 2jg6 h ALA 108 CO -0.00 1.35 0.00 0.98 0.00 0.00 0.00 179.25 181.57 2jg6 n TYR 109 N -3.23 0.00 0.00 0.00 9.36 0.12 -5.06 117.16 118.35 2jg6 n TYR 109 Ca -0.06 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.16 2jg6 n TYR 109 Cb 0.97 0.00 0.00 0.00 -0.63 0.00 0.00 39.34 39.68 2jg6 n TYR 109 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 2jg6 n GLY 110 N 0.37 2.48 2.83 2.98 0.00 0.23 -4.91 105.19 109.17 2jg6 n GLY 110 Ca 0.00 -0.52 -0.20 0.00 0.00 0.00 0.00 46.02 45.29 2jg6 n GLY 110 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2jg6 s SER 111 N 0.00 1.02 0.21 1.61 0.15 -1.26 -4.73 113.70 110.70 2jg6 s SER 111 Ca 0.00 -0.08 -0.08 0.00 0.70 0.00 0.00 55.95 56.48 2jg6 s SER 111 Cb 0.00 -0.38 0.15 0.00 -1.71 0.00 0.00 66.02 64.08 2jg6 s SER 111 CO 0.00 -0.12 1.78 0.15 1.20 0.00 0.00 173.24 176.25 2jg6 h PHE 112 N 7.61 1.16 -0.16 3.44 3.57 -1.89 -1.12 116.94 129.55 2jg6 h PHE 112 Ca -0.32 -0.08 0.02 0.00 3.53 0.00 0.00 57.97 61.11 2jg6 h PHE 112 Cb 1.14 -0.35 -0.02 0.00 2.79 0.00 0.00 35.95 39.51 2jg6 h PHE 112 CO 0.49 0.87 0.05 1.03 -2.23 0.00 0.00 178.31 178.52 2jg6 h SER 113 N 1.11 0.05 -0.59 0.41 0.87 -1.86 -1.72 113.55 111.82 2jg6 h SER 113 Ca 0.26 0.02 -0.04 0.00 -1.23 0.00 0.00 61.79 60.80 2jg6 h SER 113 Cb 0.19 0.01 -0.03 0.00 -0.44 0.00 0.00 62.40 62.14 2jg6 h SER 113 CO -0.02 0.05 0.24 0.11 -0.53 0.00 0.00 176.83 176.68 2jg6 h LYS 114 N 0.12 0.92 0.14 2.24 1.57 -1.84 0.16 116.57 119.88 2jg6 h LYS 114 Ca 0.07 -0.15 0.01 0.00 -1.87 0.00 0.00 60.65 58.71 2jg6 h LYS 114 Cb 0.04 -0.16 -0.02 0.00 0.08 0.00 0.00 32.23 32.17 2jg6 h LYS 114 CO -0.07 0.76 -0.21 0.35 -0.57 0.00 0.00 179.45 179.71 2jg6 h PHE 115 N 0.90 -0.56 -0.13 -1.35 3.57 -0.96 -1.81 116.94 116.61 2jg6 h PHE 115 Ca 0.21 0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.70 2jg6 h PHE 115 Cb 0.20 0.23 -0.00 0.00 2.79 0.00 0.00 35.95 39.16 2jg6 h PHE 115 CO 0.01 -0.31 0.00 -0.07 -2.23 0.00 0.00 178.31 175.72 2jg6 h LEU 116 N -0.41 0.23 -2.24 0.59 3.38 -0.91 -3.04 115.31 112.90 2jg6 h LEU 116 Ca 0.02 -0.30 -0.01 0.00 0.09 0.00 0.00 57.88 57.68 2jg6 h LEU 116 Cb 0.42 -0.06 -0.00 0.00 0.09 0.00 0.00 40.66 41.11 2jg6 h LEU 116 CO -0.10 0.47 -0.05 -0.50 0.09 0.00 0.00 178.44 178.35 2jg6 h TRP 117 N -0.03 0.00 -0.06 1.13 4.06 -0.96 -1.39 115.95 118.70 2jg6 h TRP 117 Ca 0.04 0.00 0.02 0.00 2.06 0.00 0.00 58.89 61.00 2jg6 h TRP 117 Cb 0.36 0.00 -0.00 0.00 -1.00 0.00 0.00 29.16 28.51 2jg6 h TRP 117 CO 0.03 0.05 0.05 0.66 -3.56 0.00 0.00 178.44 175.68 2jg6 h SER 118 N 0.00 0.00 1.00 -3.49 4.64 -1.20 -0.29 113.55 114.22 2jg6 h SER 118 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2jg6 h SER 118 Cb 0.21 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.30 2jg6 h SER 118 CO 0.01 0.00 0.00 1.88 -0.87 0.00 0.00 176.83 177.85 2jg6 h TYR 119 N 0.00 0.00 -0.01 4.77 -1.99 -1.39 -2.24 116.97 116.11 2jg6 h TYR 119 Ca 0.03 0.00 -0.00 0.00 2.00 0.00 0.00 58.73 60.76 2jg6 h TYR 119 Cb 0.13 0.00 -0.00 0.00 2.00 0.00 0.00 36.73 38.86 2jg6 h TYR 119 CO 0.00 0.00 -0.14 1.33 -0.00 0.00 0.00 178.16 179.35 2jg6 n VAL 120 N -2.74 1.99 -2.95 -2.88 0.24 -0.69 -4.99 118.33 106.31 2jg6 n VAL 120 Ca 0.02 -2.54 -0.22 0.00 -2.04 0.00 0.00 64.34 59.56 2jg6 n VAL 120 Cb 0.30 -0.24 0.02 0.00 -1.47 0.00 0.00 33.84 32.45 2jg6 n VAL 120 CO 0.00 0.00 0.00 0.59 -2.14 0.00 0.00 176.83 175.28 2jg6 n ASN 121 N -1.33 -5.62 0.00 -1.34 3.02 -0.84 -2.92 115.26 106.23 2jg6 n ASN 121 Ca 0.17 -0.24 0.00 0.00 -0.03 0.00 0.00 54.58 54.48 2jg6 n ASN 121 Cb 0.66 -4.58 0.00 0.00 -0.61 0.00 0.00 39.78 35.25 2jg6 n ASN 121 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2jg6 n GLY 122 N -1.36 0.88 3.09 7.41 0.00 -0.20 -4.99 105.19 110.01 2jg6 n GLY 122 Ca -0.12 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.79 2jg6 n GLY 122 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2jg6 s LYS 123 N -0.12 0.46 0.33 1.61 -2.85 -1.15 -5.06 119.74 112.96 2jg6 s LYS 123 Ca 0.00 -0.45 -0.28 0.00 -1.00 0.00 0.00 55.97 54.24 2jg6 s LYS 123 Cb 0.00 0.19 -0.13 0.00 -2.06 0.00 0.00 37.83 35.83 2jg6 s LYS 123 CO 0.00 -0.11 1.26 -2.30 0.10 0.00 0.00 175.35 174.30 2jg6 n PRO 124 N 1.45 2.02 -2.96 1.78 -0.02 -1.26 -4.79 135.00 131.22 2jg6 n PRO 124 Ca -0.23 0.71 -0.43 0.00 -2.02 0.00 0.00 63.50 61.53 2jg6 n PRO 124 Cb 0.55 -2.26 -0.05 0.00 -0.02 0.00 0.00 33.50 31.72 2jg6 n PRO 124 CO 0.00 0.00 0.00 0.21 1.98 0.00 0.00 175.50 177.69 2jg6 s LYS 125 N -1.79 3.31 -0.41 -0.52 2.20 0.07 -4.94 119.74 117.66 2jg6 s LYS 125 Ca 0.56 -0.34 -0.29 0.00 -0.36 0.00 0.00 55.97 55.55 2jg6 s LYS 125 Cb -0.59 -4.02 0.02 0.00 -1.51 0.00 0.00 37.83 31.73 2jg6 s LYS 125 CO 0.62 -1.28 1.20 0.34 -0.36 0.00 0.00 175.35 175.86 2jg6 s ASP 126 N 2.53 6.64 0.00 1.43 -1.08 -1.26 -0.86 116.67 124.07 2jg6 s ASP 126 Ca 0.27 0.74 0.22 0.00 -0.52 0.00 0.00 52.55 53.26 2jg6 s ASP 126 Cb -0.14 -2.55 1.01 0.00 -1.46 0.00 0.00 42.92 39.79 2jg6 s ASP 126 CO 0.19 -1.19 1.72 0.18 0.52 0.00 0.00 175.17 176.59 2jg6 n LEU 127 N 7.80 0.00 -3.36 -1.34 4.77 -0.66 -4.91 117.00 119.31 2jg6 n LEU 127 Ca 0.13 0.42 -0.24 0.00 -0.03 0.00 0.00 56.01 56.29 2jg6 n LEU 127 Cb 0.48 -0.42 0.02 0.00 -2.33 0.00 0.00 43.42 41.17 2jg6 n LEU 127 CO 0.68 -0.10 0.03 0.00 -1.33 0.00 0.00 177.39 176.66 2jg6 n GLN 128 N -1.42 -4.72 -2.23 3.23 6.02 -1.26 -4.94 117.38 112.05 2jg6 n GLN 128 Ca 0.07 0.69 -0.37 0.00 -0.01 0.00 0.00 57.00 57.39 2jg6 n GLN 128 Cb 0.23 -5.52 -0.00 0.00 1.02 0.00 0.00 30.24 25.97 2jg6 n GLN 128 CO 0.00 0.00 0.00 0.71 -1.01 0.00 0.00 177.06 176.76 2jg6 s TYR 129 N -3.12 2.79 -0.03 1.08 2.02 -1.26 -4.89 117.35 113.94 2jg6 s TYR 129 Ca 0.43 1.53 0.02 0.00 -0.37 0.00 0.00 57.07 58.69 2jg6 s TYR 129 Cb -0.21 -3.37 -0.03 0.00 -0.40 0.00 0.00 41.96 37.94 2jg6 s TYR 129 CO 0.53 -1.59 0.01 0.39 -1.57 0.00 0.00 175.55 173.32 2jg6 n GLU 130 N -0.75 3.36 -4.68 -0.62 1.02 -1.26 -0.84 120.64 116.87 2jg6 n GLU 130 Ca 0.09 -0.00 -0.27 0.00 -0.02 0.00 0.00 57.16 56.96 2jg6 n GLU 130 Cb 0.49 -1.07 -0.14 0.00 -0.02 0.00 0.00 31.44 30.69 2jg6 n GLU 130 CO 0.00 0.00 0.00 -1.01 1.18 0.00 0.00 177.13 177.30 2jg6 s HIS 131 N -2.07 2.01 0.52 -0.32 3.76 -1.26 -4.61 115.29 113.32 2jg6 s HIS 131 Ca -0.02 -0.39 0.16 0.00 -0.15 0.00 0.00 55.06 54.67 2jg6 s HIS 131 Cb 0.01 -1.18 1.27 0.00 1.11 0.00 0.00 32.58 33.79 2jg6 s HIS 131 CO 0.11 0.13 2.14 0.00 -0.85 0.00 0.00 174.74 176.27 2jg6 h ALA 132 N 4.71 2.03 0.00 -1.40 0.00 -1.97 -0.56 119.26 122.07 2jg6 h ALA 132 Ca -0.45 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.46 2jg6 h ALA 132 Cb 1.16 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.95 2jg6 h ALA 132 CO 0.43 -0.04 0.00 -1.13 0.00 0.00 0.00 179.25 178.51 2jg6 n SER 133 N -4.53 0.24 0.27 0.00 3.41 -1.26 -2.31 113.62 109.44 2jg6 n SER 133 Ca -0.02 0.55 0.16 0.00 -0.26 0.00 0.00 58.87 59.30 2jg6 n SER 133 Cb 0.12 -0.60 0.71 0.00 -0.26 0.00 0.00 64.21 64.17 2jg6 n SER 133 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 2jg6 h ASP 134 N 0.00 0.00 -3.36 4.04 3.32 -1.51 -3.46 116.42 115.45 2jg6 h ASP 134 Ca 0.00 0.00 -0.52 0.00 0.02 0.00 0.00 57.03 56.53 2jg6 h ASP 134 Cb 0.34 0.00 0.02 0.00 0.22 0.00 0.00 39.33 39.92 2jg6 h ASP 134 CO 0.00 0.06 0.60 -0.13 -1.72 0.00 0.00 179.24 178.06 2jg6 s ARG 135 N -3.79 4.43 0.47 3.56 0.52 -0.98 -5.04 118.95 118.13 2jg6 s ARG 135 Ca -0.00 1.94 0.04 0.00 -0.52 0.00 0.00 55.73 57.19 2jg6 s ARG 135 Cb 0.10 -3.24 0.02 0.00 0.52 0.00 0.00 34.95 32.35 2jg6 s ARG 135 CO 0.55 -0.20 0.65 0.96 0.02 0.00 0.00 175.30 177.28 2jg6 s ILE 136 N 0.28 3.08 -0.32 1.52 -4.36 -1.26 -5.04 121.20 115.09 2jg6 s ILE 136 Ca 0.56 -0.82 0.04 0.00 -0.26 0.00 0.00 60.65 60.18 2jg6 s ILE 136 Cb -0.34 -3.09 -0.02 0.00 1.25 0.00 0.00 42.46 40.26 2jg6 s ILE 136 CO 0.35 -0.05 0.33 0.35 0.24 0.00 0.00 174.94 176.17 2jg6 n THR 137 N -2.05 0.00 -3.50 8.37 -2.24 -1.26 -5.05 114.28 108.55 2jg6 n THR 137 Ca 0.06 -0.43 -0.13 0.00 -2.27 0.00 0.00 64.05 61.28 2jg6 n THR 137 Cb 0.59 1.03 -0.04 0.00 -2.10 0.00 0.00 70.33 69.81 2jg6 n THR 137 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 2jg6 s VAL 138 N -1.06 0.02 0.30 2.28 0.11 -1.26 -4.59 120.40 116.19 2jg6 s VAL 138 Ca 0.03 -0.13 -0.04 0.00 -2.93 0.00 0.00 61.98 58.91 2jg6 s VAL 138 Cb 0.03 -1.01 0.02 0.00 -1.53 0.00 0.00 36.38 33.89 2jg6 s VAL 138 CO 0.13 -0.07 0.46 -0.90 -3.33 0.00 0.00 175.10 171.40 2jg6 n ASP 139 N 0.09 -1.31 -0.13 3.54 5.75 -1.26 -5.06 116.55 118.18 2jg6 n ASP 139 Ca -0.18 -2.50 -0.11 0.00 -0.01 0.00 0.00 54.79 51.99 2jg6 n ASP 139 Cb 0.62 2.35 -0.02 0.00 -1.03 0.00 0.00 41.12 43.04 2jg6 n ASP 139 CO 0.00 0.00 0.00 -0.78 -0.11 0.00 0.00 177.20 176.31 2jg6 h ASP 140 N 1.63 0.67 -0.32 -1.12 3.58 -2.01 -2.34 116.42 116.52 2jg6 h ASP 140 Ca -0.24 -0.34 -0.01 0.00 0.42 0.00 0.00 57.03 56.87 2jg6 h ASP 140 Cb 0.99 -0.18 -0.01 0.00 1.72 0.00 0.00 39.33 41.84 2jg6 h ASP 140 CO 0.31 0.85 0.16 0.74 -2.88 0.00 0.00 179.24 178.42 2jg6 h THR 141 N 0.48 1.15 -0.58 2.25 2.02 -1.98 -0.53 112.91 115.72 2jg6 h THR 141 Ca 0.10 -0.42 -0.03 0.00 0.77 0.00 0.00 66.41 66.83 2jg6 h THR 141 Cb 0.53 0.85 -0.03 0.00 -1.74 0.00 0.00 68.15 67.76 2jg6 h THR 141 CO 0.03 0.16 0.24 0.00 0.37 0.00 0.00 175.52 176.31 2jg6 h ALA 142 N 1.02 1.33 -0.26 6.16 0.00 -1.89 0.37 119.26 125.98 2jg6 h ALA 142 Ca 0.11 -0.15 -0.02 0.00 0.00 0.00 0.00 54.91 54.85 2jg6 h ALA 142 Cb 0.10 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 2jg6 h ALA 142 CO -0.01 0.50 0.07 1.15 0.00 0.00 0.00 179.25 180.96 2jg6 h THR 143 N 0.83 1.20 -0.58 0.00 2.02 -1.02 0.47 112.91 115.83 2jg6 h THR 143 Ca 0.20 -0.66 -0.06 0.00 0.77 0.00 0.00 66.41 66.66 2jg6 h THR 143 Cb 0.15 1.15 -0.02 0.00 -1.74 0.00 0.00 68.15 67.68 2jg6 h THR 143 CO -0.02 0.21 0.14 -0.61 0.37 0.00 0.00 175.52 175.62 2jg6 h GLN 144 N 0.25 0.92 -0.61 6.66 5.75 -0.62 -1.64 115.11 125.83 2jg6 h GLN 144 Ca 0.08 -0.22 -0.02 0.00 -0.15 0.00 0.00 58.65 58.35 2jg6 h GLN 144 Cb 0.26 -0.12 -0.03 0.00 1.07 0.00 0.00 27.48 28.66 2jg6 h GLN 144 CO -0.00 0.85 0.32 1.25 -2.65 0.00 0.00 178.83 178.60 2jg6 h LEU 145 N 0.83 0.77 -0.21 -2.39 5.85 -0.78 0.17 115.31 119.55 2jg6 h LEU 145 Ca 0.18 -0.11 0.05 0.00 0.84 0.00 0.00 57.88 58.84 2jg6 h LEU 145 Cb 0.34 -0.20 -0.05 0.00 0.37 0.00 0.00 40.66 41.12 2jg6 h LEU 145 CO 0.00 0.66 -0.12 -1.28 -0.34 0.00 0.00 178.44 177.36 2jg6 h SER 146 N 0.82 -0.40 -0.58 1.25 0.87 -0.61 0.17 113.55 115.08 2jg6 h SER 146 Ca 0.21 0.09 0.02 0.00 -1.23 0.00 0.00 61.79 60.88 2jg6 h SER 146 Cb 0.07 0.21 -0.03 0.00 -0.44 0.00 0.00 62.40 62.21 2jg6 h SER 146 CO -0.03 -0.16 0.36 0.11 -0.53 0.00 0.00 176.83 176.58 2jg6 h LYS 147 N -0.11 0.70 -0.62 2.24 1.57 -0.95 -1.14 116.57 118.26 2jg6 h LYS 147 Ca 0.12 -0.04 -0.09 0.00 -1.87 0.00 0.00 60.65 58.77 2jg6 h LYS 147 Cb 0.28 -0.16 -0.02 0.00 0.08 0.00 0.00 32.23 32.41 2jg6 h LYS 147 CO -0.28 0.47 0.05 -0.44 -0.57 0.00 0.00 179.45 178.68 2jg6 h ASP 148 N 0.72 1.03 -0.45 0.86 3.32 -0.16 -2.45 116.42 119.30 2jg6 h ASP 148 Ca 0.23 -0.29 -0.08 0.00 0.02 0.00 0.00 57.03 56.91 2jg6 h ASP 148 Cb -0.02 -0.28 -0.02 0.00 0.22 0.00 0.00 39.33 39.24 2jg6 h ASP 148 CO -0.08 1.06 0.00 -0.07 -1.72 0.00 0.00 179.24 178.44 2jg6 h LEU 149 N 0.97 0.82 -1.49 1.55 3.38 -0.50 -2.76 115.31 117.29 2jg6 h LEU 149 Ca 0.18 -0.20 0.09 0.00 0.09 0.00 0.00 57.88 58.03 2jg6 h LEU 149 Cb 0.50 -0.22 -0.04 0.00 0.09 0.00 0.00 40.66 40.99 2jg6 h LEU 149 CO 0.02 0.88 0.45 0.50 0.09 0.00 0.00 178.44 180.39 2jg6 h LYS 150 N 0.79 0.58 0.00 1.13 3.64 -0.74 -0.91 116.57 121.06 2jg6 h LYS 150 Ca 0.15 -0.03 -0.01 0.00 -1.27 0.00 0.00 60.65 59.49 2jg6 h LYS 150 Cb 0.47 -0.13 -0.00 0.00 -0.41 0.00 0.00 32.23 32.16 2jg6 h LYS 150 CO 0.02 0.38 -0.03 1.96 -2.27 0.00 0.00 179.45 179.52 2jg6 h GLN 151 N 0.59 0.00 -0.18 1.90 1.08 -1.21 -0.86 115.11 116.43 2jg6 h GLN 151 Ca 0.31 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.51 2jg6 h GLN 151 Cb 0.42 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.85 2jg6 h GLN 151 CO -0.10 0.03 0.00 0.66 -0.95 0.00 0.00 178.83 178.47 2jg6 n TYR 152 N -3.19 0.21 0.00 2.96 4.01 -0.37 -4.96 117.16 115.82 2jg6 n TYR 152 Ca -0.01 -0.11 0.00 0.00 -0.16 0.00 0.00 57.90 57.62 2jg6 n TYR 152 Cb 0.22 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.25 2jg6 n TYR 152 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2jg6 n GLY 153 N 1.35 0.79 3.76 2.72 0.00 -0.33 -3.93 105.19 109.55 2jg6 n GLY 153 Ca 0.17 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.80 2jg6 n GLY 153 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2jg6 s PHE 154 N -2.00 2.57 0.14 1.61 0.08 -1.08 -4.41 117.98 114.88 2jg6 s PHE 154 Ca 0.00 1.36 0.05 0.00 0.12 0.00 0.00 56.93 58.46 2jg6 s PHE 154 Cb 0.00 -3.76 -0.04 0.00 -0.57 0.00 0.00 43.02 38.65 2jg6 s PHE 154 CO 0.00 -2.53 -0.11 0.15 -0.10 0.00 0.00 175.22 172.63 2jg6 s LYS 155 N -2.52 1.04 -1.60 0.44 1.02 -1.26 -4.45 119.74 112.41 2jg6 s LYS 155 Ca 0.62 -1.38 0.00 0.00 0.02 0.00 0.00 55.97 55.24 2jg6 s LYS 155 Cb -0.40 -0.68 0.00 0.00 -0.52 0.00 0.00 37.83 36.23 2jg6 s LYS 155 CO 0.50 0.10 0.00 1.19 -0.92 0.00 0.00 175.35 176.22 2jg6 n PHE 156 N 0.03 -0.87 -3.33 3.18 3.01 -1.26 -4.88 117.46 113.33 2jg6 n PHE 156 Ca -0.12 0.00 -0.26 0.00 1.01 0.00 0.00 57.45 58.09 2jg6 n PHE 156 Cb 0.60 -3.64 -0.08 0.00 -0.01 0.00 0.00 39.48 36.34 2jg6 n PHE 156 CO 0.00 0.00 0.00 1.28 1.01 0.00 0.00 176.76 179.05 2jg6 n LEU 157 N -2.66 1.35 -4.75 4.37 4.77 -1.26 -4.65 117.00 114.18 2jg6 n LEU 157 Ca -0.22 -4.91 -0.30 0.00 -0.03 0.00 0.00 56.01 50.55 2jg6 n LEU 157 Cb 0.67 0.14 0.19 0.00 -2.33 0.00 0.00 43.42 42.09 2jg6 n LEU 157 CO 0.26 2.02 0.72 -0.83 -1.33 0.00 0.00 177.39 178.23 2jg6 s GLY 158 N -1.43 1.63 0.18 -0.72 0.00 -1.26 -4.66 107.32 101.06 2jg6 s GLY 158 Ca 0.36 -0.86 -0.15 0.00 0.00 0.00 0.00 44.72 44.06 2jg6 s GLY 158 CO -0.10 -0.12 1.68 -2.55 0.00 0.00 0.00 173.10 172.01 2jg6 h PRO 159 N -1.98 0.08 -0.67 2.90 0.11 -1.88 0.34 132.00 130.90 2jg6 h PRO 159 Ca -0.47 -0.00 -0.05 0.00 0.11 0.00 0.00 66.00 65.58 2jg6 h PRO 159 Cb 1.29 -0.02 -0.03 0.00 0.11 0.00 0.00 31.00 32.35 2jg6 h PRO 159 CO 0.45 0.05 0.22 0.28 -0.21 0.00 0.00 178.00 178.79 2jg6 h VAL 160 N 0.08 1.25 -0.42 3.15 2.07 -1.92 0.88 116.25 121.35 2jg6 h VAL 160 Ca 0.23 -0.85 -0.04 0.00 0.82 0.00 0.00 66.70 66.85 2jg6 h VAL 160 Cb 0.34 0.53 -0.02 0.00 -1.52 0.00 0.00 31.29 30.63 2jg6 h VAL 160 CO -0.40 0.33 0.09 0.74 0.02 0.00 0.00 177.57 178.34 2jg6 h THR 161 N 0.98 1.24 -0.80 2.57 2.02 -1.77 -1.13 112.91 116.01 2jg6 h THR 161 Ca 0.22 -0.83 -0.04 0.00 0.77 0.00 0.00 66.41 66.53 2jg6 h THR 161 Cb 0.29 0.98 -0.04 0.00 -1.74 0.00 0.00 68.15 67.64 2jg6 h THR 161 CO -0.01 0.29 0.35 0.58 0.37 0.00 0.00 175.52 177.10 2jg6 h VAL 162 N 0.54 1.26 -0.57 3.16 2.07 -0.62 -0.62 116.25 121.47 2jg6 h VAL 162 Ca 0.13 -0.77 0.04 0.00 0.82 0.00 0.00 66.70 66.92 2jg6 h VAL 162 Cb 0.34 0.27 -0.04 0.00 -1.52 0.00 0.00 31.29 30.34 2jg6 h VAL 162 CO 0.00 0.32 0.31 0.15 0.02 0.00 0.00 177.57 178.38 2jg6 h PHE 163 N 1.15 0.58 -0.64 1.57 3.57 -0.50 0.66 116.94 123.33 2jg6 h PHE 163 Ca 0.27 0.02 0.03 0.00 3.53 0.00 0.00 57.97 61.82 2jg6 h PHE 163 Cb 0.17 -0.18 -0.04 0.00 2.79 0.00 0.00 35.95 38.69 2jg6 h PHE 163 CO 0.02 0.30 0.40 1.03 -2.23 0.00 0.00 178.31 177.83 2jg6 h SER 164 N 0.61 0.66 -0.43 0.41 0.87 -0.64 -2.32 113.55 112.71 2jg6 h SER 164 Ca 0.24 -0.00 -0.01 0.00 -1.23 0.00 0.00 61.79 60.79 2jg6 h SER 164 Cb 0.10 -0.14 -0.02 0.00 -0.44 0.00 0.00 62.40 61.90 2jg6 h SER 164 CO -0.14 0.46 0.23 0.15 -0.53 0.00 0.00 176.83 177.00 2jg6 h PHE 165 N 0.79 0.59 -0.79 2.24 3.57 -0.41 -0.67 116.94 122.26 2jg6 h PHE 165 Ca 0.26 -0.02 0.09 0.00 3.53 0.00 0.00 57.97 61.83 2jg6 h PHE 165 Cb 0.01 -0.19 -0.07 0.00 2.79 0.00 0.00 35.95 38.49 2jg6 h PHE 165 CO -0.05 0.46 0.44 -0.07 -2.23 0.00 0.00 178.31 176.85 2jg6 h LEU 166 N 0.56 0.61 -0.42 0.59 3.38 -0.48 0.67 115.31 120.22 2jg6 h LEU 166 Ca 0.15 0.05 -0.07 0.00 0.09 0.00 0.00 57.88 58.11 2jg6 h LEU 166 Cb 0.06 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 40.73 2jg6 h LEU 166 CO -0.02 0.35 0.01 -0.33 0.09 0.00 0.00 178.44 178.53 2jg6 h GLU 167 N 0.74 0.74 -0.62 1.13 5.08 -1.20 -1.01 114.58 119.43 2jg6 h GLU 167 Ca 0.38 -0.23 -0.04 0.00 -1.00 0.00 0.00 59.36 58.46 2jg6 h GLU 167 Cb 0.36 -0.07 -0.03 0.00 0.50 0.00 0.00 28.75 29.51 2jg6 h GLU 167 CO -0.25 0.81 0.22 0.00 -1.00 0.00 0.00 179.01 178.79 2jg6 h ALA 168 N 0.90 0.82 -0.00 3.43 0.00 -0.20 -2.20 119.26 122.01 2jg6 h ALA 168 Ca 0.12 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.84 2jg6 h ALA 168 Cb 0.47 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.02 2jg6 h ALA 168 CO 0.02 0.47 -0.06 0.00 0.00 0.00 0.00 179.25 179.68 2jg6 n ALA 169 N -2.39 2.69 -1.00 0.00 0.00 0.14 -1.29 120.51 118.66 2jg6 n ALA 169 Ca 0.04 -0.25 0.00 0.00 0.00 0.00 0.00 53.44 53.23 2jg6 n ALA 169 Cb 0.20 -1.38 0.00 0.00 0.00 0.00 0.00 19.45 18.26 2jg6 n ALA 169 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2jg6 n GLY 170 N 1.22 0.48 0.25 0.00 0.00 -0.96 -1.08 105.19 105.09 2jg6 n GLY 170 Ca 0.17 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.16 2jg6 n GLY 170 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2jg6 h LEU 171 N 0.00 0.52 -8.99 0.99 4.07 -1.59 -3.39 115.31 106.92 2jg6 h LEU 171 Ca 0.00 -0.15 -0.66 0.00 0.08 0.00 0.00 57.88 57.15 2jg6 h LEU 171 Cb 0.08 -0.14 -0.20 0.00 1.08 0.00 0.00 40.66 41.48 2jg6 h LEU 171 CO 0.00 0.70 -0.68 -0.31 -1.08 0.00 0.00 178.44 177.07 2jg6 s TYR 172 N -4.66 2.99 -0.45 1.13 1.51 -0.47 -0.75 117.35 116.64 2jg6 s TYR 172 Ca -0.07 -0.13 -0.13 0.00 -1.01 0.00 0.00 57.07 55.72 2jg6 s TYR 172 Cb 0.14 -1.83 0.07 0.00 -0.11 0.00 0.00 41.96 40.23 2jg6 s TYR 172 CO 0.79 0.16 0.34 0.34 -1.11 0.00 0.00 175.55 176.07 2jg6 s ASP 173 N -0.27 5.98 -0.04 2.29 2.15 -0.04 -4.17 116.67 122.57 2jg6 s ASP 173 Ca 0.04 -1.34 0.18 0.00 0.43 0.00 0.00 52.55 51.86 2jg6 s ASP 173 Cb -0.13 -2.12 0.59 0.00 -0.30 0.00 0.00 42.92 40.96 2jg6 s ASP 173 CO 0.02 -0.59 1.50 0.00 -0.17 0.00 0.00 175.17 175.93 2jg6 n ALA 174 N 5.11 2.56 -1.76 3.66 0.00 -1.26 -1.65 120.51 127.16 2jg6 n ALA 174 Ca -0.12 -1.40 -0.38 0.00 0.00 0.00 0.00 53.44 51.54 2jg6 n ALA 174 Cb 0.44 -0.83 0.00 0.00 0.00 0.00 0.00 19.45 19.06 2jg6 n ALA 174 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.50 176.49 2jg6 s HIS 175 N -1.32 2.73 0.57 0.00 3.76 -1.26 -4.86 115.29 114.90 2jg6 s HIS 175 Ca 0.44 1.46 -0.18 0.00 -0.15 0.00 0.00 55.06 56.63 2jg6 s HIS 175 Cb 0.25 -3.56 -0.04 0.00 1.11 0.00 0.00 32.58 30.33 2jg6 s HIS 175 CO 0.26 -2.00 1.09 -0.51 -0.85 0.00 0.00 174.74 172.73 2jg6 s LEU 176 N -2.95 3.62 0.30 0.89 1.43 -1.26 -4.33 118.68 116.37 2jg6 s LEU 176 Ca 0.63 2.00 0.05 0.00 -1.03 0.00 0.00 54.13 55.78 2jg6 s LEU 176 Cb -0.34 -4.56 0.71 0.00 0.03 0.00 0.00 46.19 42.03 2jg6 s LEU 176 CO 0.42 -1.22 1.77 0.50 0.23 0.00 0.00 176.35 178.05 2jg6 h LYS 177 N 0.79 0.72 -0.63 1.70 3.64 -1.24 -0.30 116.57 121.25 2jg6 h LYS 177 Ca -0.48 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 58.85 2jg6 h LYS 177 Cb 1.24 -0.16 0.00 0.00 -0.41 0.00 0.00 32.23 32.90 2jg6 h LYS 177 CO 0.57 0.47 0.00 -0.25 -2.27 0.00 0.00 179.45 177.97 2jg6 n ASP 178 N -4.79 3.44 -4.72 4.20 8.00 -1.26 -4.92 116.55 116.50 2jg6 n ASP 178 Ca 0.22 -2.04 -0.42 0.00 0.71 0.00 0.00 54.79 53.27 2jg6 n ASP 178 Cb 0.55 -0.43 -0.03 0.00 -0.02 0.00 0.00 41.12 41.19 2jg6 n ASP 178 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2jg6 h PRO 180 N 6.42 0.00 -0.23 0.00 0.11 -1.91 -1.91 132.00 134.48 2jg6 h PRO 180 Ca -0.42 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.69 2jg6 h PRO 180 Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 2jg6 h PRO 180 CO 0.79 0.00 0.00 0.43 -0.21 0.00 0.00 178.00 179.01 2jg6 n SER 181 N -3.26 2.63 -4.68 -2.05 7.64 -1.26 -4.93 113.62 107.71 2jg6 n SER 181 Ca -0.02 -1.86 -0.42 0.00 1.01 0.00 0.00 58.87 57.57 2jg6 n SER 181 Cb 0.13 -0.14 -0.03 0.00 -1.01 0.00 0.00 64.21 63.16 2jg6 n SER 181 CO 0.00 0.00 0.00 -0.75 -3.01 0.00 0.00 175.04 171.28 2jg6 s LYS 182 N -1.71 4.21 0.58 1.43 2.20 -0.72 -4.94 119.74 120.78 2jg6 s LYS 182 Ca 0.35 2.17 -0.18 0.00 -0.36 0.00 0.00 55.97 57.96 2jg6 s LYS 182 Cb 0.20 -3.76 -0.04 0.00 -1.51 0.00 0.00 37.83 32.72 2jg6 s LYS 182 CO 0.30 -0.75 1.10 -1.25 -0.36 0.00 0.00 175.35 174.39 2jg6 s PRO 183 N 3.21 3.25 0.09 4.03 0.04 -1.26 -5.00 135.00 139.35 2jg6 s PRO 183 Ca 0.71 1.46 -0.30 0.00 0.04 0.00 0.00 61.00 62.91 2jg6 s PRO 183 Cb -0.35 -2.00 -0.05 0.00 0.04 0.00 0.00 34.50 32.14 2jg6 s PRO 183 CO 0.29 -0.91 0.97 0.21 0.04 0.00 0.00 177.00 177.61 2jg6 s LYS 184 N -3.63 4.66 -0.06 4.56 2.47 -1.26 -5.06 119.74 121.43 2jg6 s LYS 184 Ca 0.69 1.46 0.06 0.00 -1.56 0.00 0.00 55.97 56.62 2jg6 s LYS 184 Cb -0.21 -3.39 -0.01 0.00 -1.46 0.00 0.00 37.83 32.76 2jg6 s LYS 184 CO 0.32 0.14 -0.24 -1.01 0.16 0.00 0.00 175.35 174.72 2jg6 s HIS 185 N 0.22 2.46 -1.20 4.03 3.76 -1.26 -5.11 115.29 118.19 2jg6 s HIS 185 Ca 0.48 -0.66 0.10 0.00 -0.15 0.00 0.00 55.06 54.83 2jg6 s HIS 185 Cb -0.23 -1.60 0.08 0.00 1.11 0.00 0.00 32.58 31.93 2jg6 s HIS 185 CO 0.30 -0.17 0.80 0.09 -0.85 0.00 0.00 174.74 174.91